Browse entries in the PDBbind-CN Database
HEADER 5LDM_COMPLEX COMPND 5LDM_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 174 GLU PRO GLN ARG LEU PHE PHE ALA ILE ASP LEU PRO ALA SEQRES 2 A 174 GLU ILE ARG GLU GLN ILE ILE HIS TRP ARG ALA LYS HIS SEQRES 3 A 174 PHE PRO PRO GLU ALA GLY ARG PRO VAL ALA ALA ASP ASN SEQRES 4 A 174 LEU HIS LEU THR LEU ALA PHE LEU GLY GLU VAL SER ALA SEQRES 5 A 174 GLU LYS GLU LYS ALA LEU SER LEU LEU ALA GLY ARG ILE SEQRES 6 A 174 ARG GLN PRO GLY PHE THR LEU THR LEU ASP ASP ALA GLY SEQRES 7 A 174 GLN TRP LEU ARG SER ARG VAL VAL TRP LEU GLY MET ARG SEQRES 8 A 174 GLN PRO PRO ARG GLY LEU ILE GLN LEU ALA ASN MET LEU SEQRES 9 A 174 ARG SER GLN ALA ALA ARG SER GLY CYS PHE GLN SER ASN SEQRES 10 A 174 ARG PRO PHE HIS PRO HIS ILE THR LEU LEU ARG ASP ALA SEQRES 11 A 174 SER GLU ALA VAL THR ILE PRO PRO PRO GLY PHE ASN TRP SEQRES 12 A 174 SER TYR ALA VAL THR GLU PHE THR LEU TYR ALA SER SER SEQRES 13 A 174 PHE ALA ARG GLY ARG THR ARG TYR THR PRO LEU LYS ARG SEQRES 14 A 174 TRP ALA LEU THR GLN HET UNN A 209 35 ATOM 1 N GLU A 3 39.998 -40.577 20.716 1.00123.29 N ATOM 2 CA GLU A 3 39.333 -39.799 19.677 1.00123.20 C ATOM 3 C GLU A 3 38.032 -39.199 20.219 1.00113.53 C ATOM 4 O GLU A 3 37.085 -39.937 20.499 1.00108.46 O ATOM 5 CB GLU A 3 39.025 -40.687 18.470 1.00126.62 C ATOM 6 CG GLU A 3 38.617 -39.920 17.222 1.00130.72 C ATOM 7 CD GLU A 3 37.888 -40.784 16.212 1.00130.16 C ATOM 8 OE1 GLU A 3 36.890 -41.435 16.589 1.00125.15 O ATOM 9 OE2 GLU A 3 38.313 -40.809 15.038 1.00134.91 O ATOM 10 HN3 GLU A 3 39.371 -41.346 21.027 1.00 0.00 H ATOM 11 HN2 GLU A 3 40.217 -39.959 21.523 1.00 0.00 H ATOM 12 HN1 GLU A 3 40.879 -40.979 20.336 1.00 0.00 H ATOM 13 N PRO A 4 37.976 -37.859 20.366 1.00111.36 N ATOM 14 CA PRO A 4 36.807 -37.219 20.991 1.00104.14 C ATOM 15 C PRO A 4 35.550 -37.197 20.117 1.00 97.45 C ATOM 16 O PRO A 4 35.649 -37.116 18.894 1.00 97.95 O ATOM 17 CB PRO A 4 37.290 -35.789 21.244 1.00108.90 C ATOM 18 CG PRO A 4 38.307 -35.549 20.194 1.00114.71 C ATOM 19 CD PRO A 4 38.999 -36.866 19.987 1.00115.67 C ATOM 20 N GLN A 5 34.382 -37.253 20.754 1.00 91.20 N ATOM 21 CA GLN A 5 33.107 -37.282 20.043 1.00 86.71 C ATOM 22 C GLN A 5 32.061 -36.408 20.726 1.00 80.31 C ATOM 23 O GLN A 5 32.080 -36.247 21.945 1.00 82.15 O ATOM 24 CB GLN A 5 32.561 -38.711 19.978 1.00 82.66 C ATOM 25 CG GLN A 5 33.408 -39.699 19.203 1.00 83.16 C ATOM 26 CD GLN A 5 32.646 -40.977 18.912 1.00 77.65 C ATOM 27 OE1 GLN A 5 32.090 -41.146 17.827 1.00 77.11 O ATOM 28 NE2 GLN A 5 32.602 -41.879 19.889 1.00 73.77 N ATOM 29 HE22 GLN A 5 33.087 -41.694 20.790 1.00 0.00 H ATOM 30 HE21 GLN A 5 32.083 -42.769 19.752 1.00 0.00 H ATOM 31 H GLN A 5 34.378 -37.277 21.794 1.00 0.00 H ATOM 32 N ARG A 6 31.146 -35.856 19.933 1.00 72.44 N ATOM 33 CA ARG A 6 29.977 -35.168 20.468 1.00 65.34 C ATOM 34 C ARG A 6 28.904 -36.213 20.787 1.00 60.80 C ATOM 35 O ARG A 6 28.316 -36.807 19.879 1.00 57.53 O ATOM 36 CB ARG A 6 29.449 -34.145 19.460 1.00 64.10 C ATOM 37 CG ARG A 6 28.453 -33.166 20.045 1.00 64.61 C ATOM 38 CD ARG A 6 28.016 -32.120 19.023 1.00 72.40 C ATOM 39 NE ARG A 6 29.144 -31.383 18.454 1.00 83.35 N ATOM 40 CZ ARG A 6 29.793 -30.394 19.066 1.00 92.64 C ATOM 41 NH1 ARG A 6 30.806 -29.792 18.454 1.00100.47 N ATOM 42 NH2 ARG A 6 29.444 -30.004 20.287 1.00 92.73 N ATOM 43 HE ARG A 6 29.463 -31.651 17.501 1.00 0.00 H ATOM 44 HH12 ARG A 6 31.315 -29.019 18.929 1.00 0.00 H ATOM 45 HH11 ARG A 6 31.090 -30.093 17.500 1.00 0.00 H ATOM 46 HH22 ARG A 6 29.960 -29.230 20.753 1.00 0.00 H ATOM 47 HH21 ARG A 6 28.655 -30.472 20.777 1.00 0.00 H ATOM 48 H ARG A 6 31.268 -35.917 18.902 1.00 0.00 H ATOM 49 N LEU A 7 28.665 -36.439 22.078 1.00 59.44 N ATOM 50 CA LEU A 7 27.795 -37.520 22.528 1.00 54.58 C ATOM 51 C LEU A 7 26.607 -36.998 23.318 1.00 49.72 C ATOM 52 O LEU A 7 26.678 -35.930 23.922 1.00 52.01 O ATOM 53 CB LEU A 7 28.583 -38.503 23.401 1.00 55.71 C ATOM 54 CG LEU A 7 29.849 -39.113 22.799 1.00 58.23 C ATOM 55 CD1 LEU A 7 30.368 -40.216 23.701 1.00 56.51 C ATOM 56 CD2 LEU A 7 29.593 -39.646 21.400 1.00 59.64 C ATOM 57 H LEU A 7 29.113 -35.825 22.788 1.00 0.00 H ATOM 58 N PHE A 8 25.525 -37.773 23.320 1.00 44.24 N ATOM 59 CA PHE A 8 24.329 -37.445 24.093 1.00 44.98 C ATOM 60 C PHE A 8 23.460 -38.687 24.317 1.00 43.43 C ATOM 61 O PHE A 8 23.364 -39.552 23.446 1.00 44.84 O ATOM 62 CB PHE A 8 23.515 -36.355 23.388 1.00 45.61 C ATOM 63 CG PHE A 8 22.895 -36.796 22.090 1.00 45.41 C ATOM 64 CD1 PHE A 8 21.620 -37.340 22.060 1.00 45.18 C ATOM 65 CD2 PHE A 8 23.582 -36.660 20.896 1.00 45.08 C ATOM 66 CE1 PHE A 8 21.052 -37.745 20.861 1.00 43.00 C ATOM 67 CE2 PHE A 8 23.017 -37.067 19.698 1.00 42.67 C ATOM 68 CZ PHE A 8 21.755 -37.606 19.681 1.00 41.53 C ATOM 69 H PHE A 8 25.531 -38.643 22.751 1.00 0.00 H ATOM 70 N PHE A 9 22.852 -38.789 25.495 1.00 42.61 N ATOM 71 CA PHE A 9 21.870 -39.845 25.753 1.00 42.12 C ATOM 72 C PHE A 9 20.491 -39.390 25.289 1.00 41.62 C ATOM 73 O PHE A 9 20.133 -38.218 25.455 1.00 44.28 O ATOM 74 CB PHE A 9 21.802 -40.180 27.241 1.00 41.84 C ATOM 75 CG PHE A 9 23.036 -40.833 27.774 1.00 41.41 C ATOM 76 CD1 PHE A 9 23.267 -42.184 27.565 1.00 40.66 C ATOM 77 CD2 PHE A 9 23.958 -40.103 28.499 1.00 41.86 C ATOM 78 CE1 PHE A 9 24.400 -42.791 28.064 1.00 41.64 C ATOM 79 CE2 PHE A 9 25.089 -40.702 29.003 1.00 44.34 C ATOM 80 CZ PHE A 9 25.312 -42.050 28.786 1.00 44.53 C ATOM 81 H PHE A 9 23.078 -38.107 26.247 1.00 0.00 H ATOM 82 N ALA A 10 19.713 -40.311 24.725 1.00 39.12 N ATOM 83 CA ALA A 10 18.395 -39.954 24.202 1.00 41.35 C ATOM 84 C ALA A 10 17.385 -41.099 24.232 1.00 42.63 C ATOM 85 O ALA A 10 17.750 -42.273 24.215 1.00 41.99 O ATOM 86 CB ALA A 10 18.527 -39.404 22.781 1.00 40.52 C ATOM 87 H ALA A 10 20.046 -41.294 24.656 1.00 0.00 H ATOM 88 N ILE A 11 16.110 -40.721 24.291 1.00 45.61 N ATOM 89 CA ILE A 11 14.989 -41.632 24.082 1.00 46.37 C ATOM 90 C ILE A 11 14.566 -41.529 22.619 1.00 45.54 C ATOM 91 O ILE A 11 14.621 -40.450 22.033 1.00 47.87 O ATOM 92 CB ILE A 11 13.793 -41.238 24.976 1.00 50.68 C ATOM 93 CG1 ILE A 11 14.153 -41.365 26.459 1.00 54.77 C ATOM 94 CG2 ILE A 11 12.570 -42.072 24.655 1.00 49.78 C ATOM 95 CD1 ILE A 11 14.590 -42.739 26.878 1.00 55.89 C ATOM 96 H ILE A 11 15.901 -39.723 24.497 1.00 0.00 H ATOM 97 N ASP A 12 14.148 -42.648 22.034 1.00 44.39 N ATOM 98 CA ASP A 12 13.813 -42.710 20.611 1.00 43.94 C ATOM 99 C ASP A 12 12.313 -42.859 20.406 1.00 43.98 C ATOM 100 O ASP A 12 11.565 -43.026 21.368 1.00 48.13 O ATOM 101 CB ASP A 12 14.529 -43.892 19.960 1.00 44.23 C ATOM 102 CG ASP A 12 15.977 -43.599 19.658 1.00 44.92 C ATOM 103 OD1 ASP A 12 16.236 -42.648 18.892 1.00 45.15 O ATOM 104 OD2 ASP A 12 16.858 -44.309 20.193 1.00 44.38 O ATOM 105 H ASP A 12 14.056 -43.510 22.609 1.00 0.00 H ATOM 106 N LEU A 13 11.886 -42.819 19.148 1.00 41.40 N ATOM 107 CA LEU A 13 10.473 -42.907 18.806 1.00 43.85 C ATOM 108 C LEU A 13 10.193 -44.061 17.852 1.00 45.65 C ATOM 109 O LEU A 13 10.925 -44.250 16.876 1.00 44.62 O ATOM 110 CB LEU A 13 9.993 -41.593 18.174 1.00 46.38 C ATOM 111 CG LEU A 13 9.689 -40.481 19.178 1.00 50.12 C ATOM 112 CD1 LEU A 13 10.953 -39.732 19.535 1.00 52.05 C ATOM 113 CD2 LEU A 13 8.651 -39.532 18.626 1.00 53.88 C ATOM 114 H LEU A 13 12.584 -42.722 18.383 1.00 0.00 H ATOM 115 N PRO A 14 9.129 -44.841 18.127 1.00 48.83 N ATOM 116 CA PRO A 14 8.743 -45.902 17.187 1.00 46.41 C ATOM 117 C PRO A 14 8.429 -45.327 15.817 1.00 39.12 C ATOM 118 O PRO A 14 7.973 -44.192 15.726 1.00 42.06 O ATOM 119 CB PRO A 14 7.474 -46.484 17.809 1.00 51.16 C ATOM 120 CG PRO A 14 7.561 -46.151 19.253 1.00 54.18 C ATOM 121 CD PRO A 14 8.260 -44.826 19.318 1.00 53.46 C ATOM 122 N ALA A 15 8.682 -46.097 14.769 1.00 49.38 N ATOM 123 CA ALA A 15 8.524 -45.609 13.408 1.00 49.25 C ATOM 124 C ALA A 15 7.123 -45.069 13.151 1.00 52.81 C ATOM 125 O ALA A 15 6.969 -44.010 12.542 1.00 52.11 O ATOM 126 CB ALA A 15 8.843 -46.715 12.422 1.00 52.36 C ATOM 127 H ALA A 15 9.001 -47.075 14.923 1.00 0.00 H ATOM 128 N GLU A 16 6.110 -45.799 13.611 1.00 58.76 N ATOM 129 CA GLU A 16 4.721 -45.425 13.371 1.00 66.62 C ATOM 130 C GLU A 16 4.480 -43.991 13.817 1.00 60.43 C ATOM 131 O GLU A 16 3.796 -43.216 13.144 1.00 62.36 O ATOM 132 CB GLU A 16 3.766 -46.378 14.099 1.00 75.79 C ATOM 133 CG GLU A 16 4.125 -46.648 15.555 1.00 80.29 C ATOM 134 CD GLU A 16 4.999 -47.883 15.723 1.00 89.55 C ATOM 135 OE1 GLU A 16 4.825 -48.603 16.733 1.00 91.86 O ATOM 136 OE2 GLU A 16 5.858 -48.135 14.846 1.00 93.10 O ATOM 137 H GLU A 16 6.315 -46.660 14.157 1.00 0.00 H ATOM 138 N ILE A 17 5.085 -43.635 14.941 1.00 53.92 N ATOM 139 CA ILE A 17 4.888 -42.324 15.533 1.00 46.20 C ATOM 140 C ILE A 17 5.762 -41.297 14.837 1.00 41.76 C ATOM 141 O ILE A 17 5.344 -40.160 14.647 1.00 40.35 O ATOM 142 CB ILE A 17 5.168 -42.365 17.045 1.00 44.74 C ATOM 143 CG1 ILE A 17 4.302 -43.467 17.665 1.00 46.30 C ATOM 144 CG2 ILE A 17 4.926 -40.991 17.686 1.00 41.85 C ATOM 145 CD1 ILE A 17 3.819 -43.204 19.062 1.00 46.04 C ATOM 146 H ILE A 17 5.718 -44.313 15.412 1.00 0.00 H ATOM 147 N ARG A 18 6.966 -41.693 14.440 1.00 43.26 N ATOM 148 CA ARG A 18 7.823 -40.792 13.681 1.00 45.11 C ATOM 149 C ARG A 18 7.093 -40.384 12.409 1.00 47.46 C ATOM 150 O ARG A 18 7.092 -39.211 12.041 1.00 45.14 O ATOM 151 CB ARG A 18 9.168 -41.435 13.333 1.00 48.80 C ATOM 152 CG ARG A 18 10.115 -41.587 14.511 1.00 50.44 C ATOM 153 CD ARG A 18 11.566 -41.820 14.061 1.00 57.36 C ATOM 154 NE ARG A 18 12.116 -43.054 14.623 1.00 62.04 N ATOM 155 CZ ARG A 18 12.285 -44.191 13.950 1.00 70.28 C ATOM 156 NH1 ARG A 18 12.784 -45.250 14.574 1.00 72.49 N ATOM 157 NH2 ARG A 18 11.974 -44.281 12.659 1.00 75.27 N ATOM 158 HE ARG A 18 12.396 -43.042 15.624 1.00 0.00 H ATOM 159 HH12 ARG A 18 12.920 -46.142 14.057 1.00 0.00 H ATOM 160 HH11 ARG A 18 13.040 -45.188 15.580 1.00 0.00 H ATOM 161 HH22 ARG A 18 12.114 -45.178 12.152 1.00 0.00 H ATOM 162 HH21 ARG A 18 11.591 -43.454 12.157 1.00 0.00 H ATOM 163 H ARG A 18 7.299 -42.651 14.672 1.00 0.00 H ATOM 164 N GLU A 19 6.443 -41.348 11.759 1.00 52.03 N ATOM 165 CA GLU A 19 5.724 -41.073 10.514 1.00 57.11 C ATOM 166 C GLU A 19 4.502 -40.176 10.725 1.00 53.88 C ATOM 167 O GLU A 19 4.227 -39.292 9.916 1.00 54.11 O ATOM 168 CB GLU A 19 5.316 -42.372 9.819 1.00 67.01 C ATOM 169 CG GLU A 19 6.382 -42.942 8.885 1.00 78.23 C ATOM 170 CD GLU A 19 6.696 -42.027 7.704 1.00 87.11 C ATOM 171 OE1 GLU A 19 7.696 -42.287 6.996 1.00 92.61 O ATOM 172 OE2 GLU A 19 5.945 -41.051 7.478 1.00 88.14 O ATOM 173 H GLU A 19 6.446 -42.314 12.143 1.00 0.00 H ATOM 174 N GLN A 20 3.778 -40.392 11.815 1.00 52.57 N ATOM 175 CA GLN A 20 2.639 -39.541 12.136 1.00 51.29 C ATOM 176 C GLN A 20 3.095 -38.111 12.387 1.00 46.59 C ATOM 177 O GLN A 20 2.450 -37.163 11.954 1.00 45.86 O ATOM 178 CB GLN A 20 1.892 -40.087 13.353 1.00 50.88 C ATOM 179 CG GLN A 20 1.057 -41.322 13.041 1.00 56.01 C ATOM 180 CD GLN A 20 0.396 -41.909 14.274 1.00 57.31 C ATOM 181 OE1 GLN A 20 -0.800 -41.724 14.491 1.00 61.61 O ATOM 182 NE2 GLN A 20 1.172 -42.620 15.088 1.00 54.11 N ATOM 183 HE22 GLN A 20 2.179 -42.750 14.864 1.00 0.00 H ATOM 184 HE21 GLN A 20 0.771 -43.045 15.948 1.00 0.00 H ATOM 185 H GLN A 20 4.026 -41.178 12.449 1.00 0.00 H ATOM 186 N ILE A 21 4.223 -37.961 13.068 1.00 46.01 N ATOM 187 CA ILE A 21 4.755 -36.638 13.379 1.00 44.90 C ATOM 188 C ILE A 21 5.151 -35.846 12.136 1.00 47.23 C ATOM 189 O ILE A 21 4.736 -34.702 11.978 1.00 50.68 O ATOM 190 CB ILE A 21 5.965 -36.733 14.306 1.00 42.86 C ATOM 191 CG1 ILE A 21 5.516 -37.218 15.680 1.00 38.51 C ATOM 192 CG2 ILE A 21 6.643 -35.368 14.445 1.00 44.82 C ATOM 193 CD1 ILE A 21 6.650 -37.651 16.575 1.00 38.85 C ATOM 194 H ILE A 21 4.740 -38.805 13.388 1.00 0.00 H ATOM 195 N ILE A 22 5.955 -36.436 11.259 1.00 47.23 N ATOM 196 CA ILE A 22 6.377 -35.717 10.064 1.00 51.96 C ATOM 197 C ILE A 22 5.186 -35.384 9.169 1.00 52.28 C ATOM 198 O ILE A 22 5.210 -34.397 8.437 1.00 53.53 O ATOM 199 CB ILE A 22 7.456 -36.481 9.262 1.00 56.19 C ATOM 200 CG1 ILE A 22 6.859 -37.681 8.533 1.00 64.80 C ATOM 201 CG2 ILE A 22 8.605 -36.893 10.175 1.00 55.89 C ATOM 202 CD1 ILE A 22 6.615 -37.429 7.056 1.00 72.28 C ATOM 203 H ILE A 22 6.283 -37.409 11.425 1.00 0.00 H ATOM 204 N HIS A 23 4.139 -36.199 9.240 1.00 54.05 N ATOM 205 CA HIS A 23 2.930 -35.958 8.457 1.00 57.66 C ATOM 206 C HIS A 23 2.176 -34.742 9.009 1.00 54.15 C ATOM 207 O HIS A 23 1.743 -33.864 8.264 1.00 53.73 O ATOM 208 CB HIS A 23 2.043 -37.200 8.482 1.00 61.13 C ATOM 209 CG HIS A 23 0.940 -37.175 7.473 1.00 67.68 C ATOM 210 ND1 HIS A 23 -0.298 -36.633 7.737 1.00 68.64 N ATOM 211 CD2 HIS A 23 0.894 -37.625 6.197 1.00 74.21 C ATOM 212 CE1 HIS A 23 -1.063 -36.751 6.665 1.00 74.15 C ATOM 213 NE2 HIS A 23 -0.364 -37.349 5.718 1.00 77.34 N ATOM 214 H HIS A 23 4.181 -37.027 9.867 1.00 0.00 H ATOM 215 N TRP A 24 2.041 -34.710 10.329 1.00 51.90 N ATOM 216 CA TRP A 24 1.457 -33.592 11.053 1.00 52.42 C ATOM 217 C TRP A 24 2.235 -32.308 10.757 1.00 54.24 C ATOM 218 O TRP A 24 1.651 -31.256 10.477 1.00 55.08 O ATOM 219 CB TRP A 24 1.523 -33.941 12.538 1.00 49.64 C ATOM 220 CG TRP A 24 1.019 -32.934 13.491 1.00 48.57 C ATOM 221 CD1 TRP A 24 -0.270 -32.735 13.855 1.00 49.98 C ATOM 222 CD2 TRP A 24 1.803 -32.016 14.258 1.00 48.47 C ATOM 223 NE1 TRP A 24 -0.347 -31.737 14.792 1.00 50.82 N ATOM 224 CE2 TRP A 24 0.916 -31.278 15.055 1.00 49.63 C ATOM 225 CE3 TRP A 24 3.168 -31.740 14.340 1.00 51.29 C ATOM 226 CZ2 TRP A 24 1.347 -30.279 15.920 1.00 51.05 C ATOM 227 CZ3 TRP A 24 3.596 -30.749 15.199 1.00 50.37 C ATOM 228 CH2 TRP A 24 2.687 -30.031 15.978 1.00 50.88 C ATOM 229 HE1 TRP A 24 -1.222 -31.386 15.231 1.00 0.00 H ATOM 230 H TRP A 24 2.371 -35.530 10.876 1.00 0.00 H ATOM 231 N ARG A 25 3.560 -32.410 10.802 1.00 53.84 N ATOM 232 CA ARG A 25 4.437 -31.258 10.616 1.00 53.56 C ATOM 233 C ARG A 25 4.278 -30.636 9.233 1.00 57.86 C ATOM 234 O ARG A 25 4.105 -29.428 9.109 1.00 58.79 O ATOM 235 CB ARG A 25 5.895 -31.669 10.825 1.00 53.33 C ATOM 236 CG ARG A 25 6.888 -30.513 10.784 1.00 54.25 C ATOM 237 CD ARG A 25 8.298 -30.998 11.080 1.00 52.82 C ATOM 238 NE ARG A 25 8.776 -31.932 10.065 1.00 52.87 N ATOM 239 CZ ARG A 25 9.847 -32.706 10.201 1.00 48.07 C ATOM 240 NH1 ARG A 25 10.198 -33.523 9.221 1.00 50.18 N ATOM 241 NH2 ARG A 25 10.562 -32.671 11.315 1.00 43.62 N ATOM 242 HE ARG A 25 8.242 -31.996 9.175 1.00 0.00 H ATOM 243 HH12 ARG A 25 11.036 -34.130 9.325 1.00 0.00 H ATOM 244 HH11 ARG A 25 9.636 -33.558 8.347 1.00 0.00 H ATOM 245 HH22 ARG A 25 11.399 -33.280 11.415 1.00 0.00 H ATOM 246 HH21 ARG A 25 10.286 -32.035 12.090 1.00 0.00 H ATOM 247 H ARG A 25 3.986 -33.343 10.976 1.00 0.00 H ATOM 248 N ALA A 26 4.345 -31.466 8.197 1.00 60.02 N ATOM 249 CA ALA A 26 4.209 -30.987 6.826 1.00 64.70 C ATOM 250 C ALA A 26 2.859 -30.308 6.591 1.00 66.90 C ATOM 251 O ALA A 26 2.743 -29.422 5.744 1.00 72.70 O ATOM 252 CB ALA A 26 4.397 -32.139 5.849 1.00 66.51 C ATOM 253 H ALA A 26 4.498 -32.480 8.368 1.00 0.00 H ATOM 254 N LYS A 27 1.848 -30.722 7.349 1.00 62.70 N ATOM 255 CA LYS A 27 0.496 -30.200 7.186 1.00 62.49 C ATOM 256 C LYS A 27 0.353 -28.794 7.768 1.00 62.05 C ATOM 257 O LYS A 27 -0.297 -27.929 7.173 1.00 63.90 O ATOM 258 CB LYS A 27 -0.514 -31.138 7.855 1.00 62.33 C ATOM 259 CG LYS A 27 -1.953 -30.623 7.865 1.00 67.63 C ATOM 260 CD LYS A 27 -2.882 -31.552 8.630 1.00 70.90 C ATOM 261 CE LYS A 27 -3.111 -32.858 7.891 1.00 76.48 C ATOM 262 NZ LYS A 27 -3.852 -32.658 6.618 1.00 83.63 N ATOM 263 HZ1 LYS A 27 -4.779 -32.233 6.821 1.00 0.00 H ATOM 264 HZ2 LYS A 27 -3.308 -32.025 5.997 1.00 0.00 H ATOM 265 HZ3 LYS A 27 -3.985 -33.576 6.148 1.00 0.00 H ATOM 266 H LYS A 27 2.027 -31.440 8.080 1.00 0.00 H ATOM 267 N HIS A 28 0.965 -28.574 8.928 1.00 58.54 N ATOM 268 CA HIS A 28 0.770 -27.342 9.681 1.00 59.14 C ATOM 269 C HIS A 28 1.922 -26.346 9.546 1.00 57.63 C ATOM 270 O HIS A 28 1.772 -25.172 9.888 1.00 56.44 O ATOM 271 CB HIS A 28 0.535 -27.682 11.153 1.00 59.11 C ATOM 272 CG HIS A 28 -0.728 -28.446 11.393 1.00 61.65 C ATOM 273 ND1 HIS A 28 -0.764 -29.822 11.480 1.00 62.10 N ATOM 274 CD2 HIS A 28 -2.005 -28.029 11.553 1.00 64.15 C ATOM 275 CE1 HIS A 28 -2.005 -30.216 11.689 1.00 64.13 C ATOM 276 NE2 HIS A 28 -2.781 -29.146 11.737 1.00 65.19 N ATOM 277 H HIS A 28 1.602 -29.303 9.309 1.00 0.00 H ATOM 278 N PHE A 29 3.060 -26.814 9.039 1.00 58.02 N ATOM 279 CA PHE A 29 4.257 -25.985 8.920 1.00 59.59 C ATOM 280 C PHE A 29 4.792 -25.988 7.488 1.00 61.97 C ATOM 281 O PHE A 29 5.327 -26.999 7.024 1.00 64.03 O ATOM 282 CB PHE A 29 5.333 -26.478 9.889 1.00 56.39 C ATOM 283 CG PHE A 29 4.889 -26.479 11.321 1.00 56.04 C ATOM 284 CD1 PHE A 29 4.474 -27.649 11.932 1.00 54.16 C ATOM 285 CD2 PHE A 29 4.864 -25.304 12.053 1.00 58.31 C ATOM 286 CE1 PHE A 29 4.051 -27.647 13.248 1.00 53.82 C ATOM 287 CE2 PHE A 29 4.446 -25.300 13.374 1.00 57.04 C ATOM 288 CZ PHE A 29 4.036 -26.471 13.970 1.00 54.29 C ATOM 289 H PHE A 29 3.098 -27.802 8.717 1.00 0.00 H ATOM 290 N PRO A 30 4.654 -24.853 6.781 1.00 62.30 N ATOM 291 CA PRO A 30 5.204 -24.802 5.426 1.00 66.23 C ATOM 292 C PRO A 30 6.728 -24.715 5.451 1.00 69.75 C ATOM 293 O PRO A 30 7.310 -24.524 6.523 1.00 68.95 O ATOM 294 CB PRO A 30 4.593 -23.521 4.849 1.00 68.77 C ATOM 295 CG PRO A 30 4.364 -22.651 6.028 1.00 66.59 C ATOM 296 CD PRO A 30 4.029 -23.574 7.168 1.00 62.67 C ATOM 297 N PRO A 31 7.370 -24.864 4.282 1.00 72.33 N ATOM 298 CA PRO A 31 8.834 -24.831 4.189 1.00 75.13 C ATOM 299 C PRO A 31 9.449 -23.581 4.821 1.00 78.42 C ATOM 300 O PRO A 31 10.488 -23.674 5.478 1.00 78.52 O ATOM 301 CB PRO A 31 9.083 -24.861 2.679 1.00 77.96 C ATOM 302 CG PRO A 31 7.894 -25.593 2.129 1.00 76.35 C ATOM 303 CD PRO A 31 6.740 -25.183 2.987 1.00 73.69 C ATOM 304 N GLU A 32 8.800 -22.435 4.651 1.00 82.67 N ATOM 305 CA GLU A 32 9.344 -21.174 5.141 1.00 86.78 C ATOM 306 C GLU A 32 9.363 -21.122 6.670 1.00 85.30 C ATOM 307 O GLU A 32 10.083 -20.317 7.260 1.00 86.71 O ATOM 308 CB GLU A 32 8.543 -19.995 4.574 1.00 92.04 C ATOM 309 CG GLU A 32 7.169 -19.807 5.199 1.00 92.57 C ATOM 310 CD GLU A 32 6.318 -18.792 4.456 1.00100.15 C ATOM 311 OE1 GLU A 32 5.073 -18.883 4.543 1.00100.02 O ATOM 312 OE2 GLU A 32 6.892 -17.902 3.789 1.00106.17 O ATOM 313 H GLU A 32 7.884 -22.437 4.158 1.00 0.00 H ATOM 314 N ALA A 33 8.581 -21.989 7.307 1.00 82.07 N ATOM 315 CA ALA A 33 8.444 -21.969 8.763 1.00 80.79 C ATOM 316 C ALA A 33 9.753 -22.324 9.473 1.00 79.02 C ATOM 317 O ALA A 33 10.012 -21.855 10.583 1.00 81.05 O ATOM 318 CB ALA A 33 7.330 -22.910 9.201 1.00 76.07 C ATOM 319 H ALA A 33 8.055 -22.698 6.757 1.00 0.00 H ATOM 320 N GLY A 34 10.577 -23.149 8.835 1.00 74.72 N ATOM 321 CA GLY A 34 11.858 -23.524 9.406 1.00 70.78 C ATOM 322 C GLY A 34 12.467 -24.737 8.733 1.00 67.16 C ATOM 323 O GLY A 34 11.929 -25.250 7.751 1.00 66.48 O ATOM 324 H GLY A 34 10.299 -23.533 7.909 1.00 0.00 H ATOM 325 N ARG A 35 13.598 -25.194 9.262 1.00 66.31 N ATOM 326 CA ARG A 35 14.298 -26.346 8.704 1.00 67.09 C ATOM 327 C ARG A 35 13.836 -27.621 9.406 1.00 61.07 C ATOM 328 O ARG A 35 14.078 -27.787 10.601 1.00 60.03 O ATOM 329 CB ARG A 35 15.812 -26.170 8.853 1.00 71.87 C ATOM 330 CG ARG A 35 16.630 -27.273 8.204 1.00 75.94 C ATOM 331 CD ARG A 35 18.103 -26.908 8.151 1.00 83.57 C ATOM 332 NE ARG A 35 18.630 -26.545 9.466 1.00 87.05 N ATOM 333 CZ ARG A 35 19.167 -27.402 10.332 1.00 89.52 C ATOM 334 NH1 ARG A 35 19.259 -28.696 10.042 1.00 89.86 N ATOM 335 NH2 ARG A 35 19.616 -26.962 11.501 1.00 90.71 N ATOM 336 HE ARG A 35 18.582 -25.544 9.745 1.00 0.00 H ATOM 337 HH12 ARG A 35 19.681 -29.354 10.728 1.00 0.00 H ATOM 338 HH11 ARG A 35 18.909 -29.050 9.129 1.00 0.00 H ATOM 339 HH22 ARG A 35 20.036 -27.628 12.181 1.00 0.00 H ATOM 340 HH21 ARG A 35 19.548 -25.952 11.737 1.00 0.00 H ATOM 341 H ARG A 35 13.995 -24.717 10.097 1.00 0.00 H ATOM 342 N PRO A 36 13.169 -28.528 8.668 1.00 59.16 N ATOM 343 CA PRO A 36 12.557 -29.707 9.299 1.00 56.06 C ATOM 344 C PRO A 36 13.543 -30.816 9.628 1.00 57.68 C ATOM 345 O PRO A 36 14.292 -31.253 8.759 1.00 60.71 O ATOM 346 CB PRO A 36 11.577 -30.195 8.235 1.00 56.24 C ATOM 347 CG PRO A 36 12.227 -29.822 6.954 1.00 60.01 C ATOM 348 CD PRO A 36 12.949 -28.522 7.211 1.00 60.90 C ATOM 349 N VAL A 37 13.523 -31.271 10.874 1.00 56.95 N ATOM 350 CA VAL A 37 14.404 -32.343 11.312 1.00 60.23 C ATOM 351 C VAL A 37 14.055 -33.627 10.562 1.00 61.91 C ATOM 352 O VAL A 37 12.879 -33.973 10.426 1.00 60.62 O ATOM 353 CB VAL A 37 14.275 -32.574 12.837 1.00 58.02 C ATOM 354 CG1 VAL A 37 15.128 -33.752 13.288 1.00 58.57 C ATOM 355 CG2 VAL A 37 14.670 -31.316 13.589 1.00 57.43 C ATOM 356 H VAL A 37 12.860 -30.850 11.556 1.00 0.00 H ATOM 357 N ALA A 38 15.079 -34.325 10.075 1.00 63.90 N ATOM 358 CA ALA A 38 14.881 -35.589 9.374 1.00 63.42 C ATOM 359 C ALA A 38 14.138 -36.564 10.281 1.00 58.12 C ATOM 360 O ALA A 38 14.336 -36.562 11.493 1.00 57.38 O ATOM 361 CB ALA A 38 16.221 -36.174 8.935 1.00 66.68 C ATOM 362 H ALA A 38 16.045 -33.960 10.198 1.00 0.00 H ATOM 363 N ALA A 39 13.278 -37.387 9.691 1.00 67.61 N ATOM 364 CA ALA A 39 12.435 -38.300 10.457 1.00 64.17 C ATOM 365 C ALA A 39 13.245 -39.203 11.384 1.00 62.93 C ATOM 366 O ALA A 39 12.848 -39.449 12.523 1.00 62.23 O ATOM 367 CB ALA A 39 11.590 -39.143 9.516 1.00 68.05 C ATOM 368 H ALA A 39 13.203 -37.381 8.654 1.00 0.00 H ATOM 369 N ASP A 40 14.386 -39.684 10.899 1.00 63.06 N ATOM 370 CA ASP A 40 15.208 -40.613 11.664 1.00 58.74 C ATOM 371 C ASP A 40 16.006 -39.903 12.762 1.00 53.36 C ATOM 372 O ASP A 40 16.552 -40.552 13.650 1.00 51.69 O ATOM 373 CB ASP A 40 16.146 -41.396 10.733 1.00 64.89 C ATOM 374 CG ASP A 40 15.396 -42.303 9.767 1.00 70.76 C ATOM 375 OD1 ASP A 40 14.270 -42.738 10.093 1.00 70.51 O ATOM 376 OD2 ASP A 40 15.937 -42.585 8.676 1.00 77.49 O ATOM 377 H ASP A 40 14.699 -39.390 9.952 1.00 0.00 H ATOM 378 N ASN A 41 16.058 -38.575 12.712 1.00 54.76 N ATOM 379 CA ASN A 41 16.777 -37.794 13.721 1.00 54.52 C ATOM 380 C ASN A 41 15.877 -37.280 14.842 1.00 52.05 C ATOM 381 O ASN A 41 16.359 -36.690 15.810 1.00 51.21 O ATOM 382 CB ASN A 41 17.523 -36.619 13.076 1.00 58.15 C ATOM 383 CG ASN A 41 18.725 -37.069 12.255 1.00 63.62 C ATOM 384 OD1 ASN A 41 19.118 -38.234 12.295 1.00 64.70 O ATOM 385 ND2 ASN A 41 19.319 -36.140 11.515 1.00 66.19 N ATOM 386 HD22 ASN A 41 18.953 -35.166 11.511 1.00 0.00 H ATOM 387 HD21 ASN A 41 20.150 -36.386 10.940 1.00 0.00 H ATOM 388 H ASN A 41 15.576 -38.078 11.936 1.00 0.00 H ATOM 389 N LEU A 42 14.573 -37.507 14.719 1.00 51.80 N ATOM 390 CA LEU A 42 13.637 -37.127 15.773 1.00 46.76 C ATOM 391 C LEU A 42 13.888 -37.960 17.017 1.00 42.83 C ATOM 392 O LEU A 42 13.950 -39.185 16.948 1.00 42.86 O ATOM 393 CB LEU A 42 12.200 -37.328 15.306 1.00 46.88 C ATOM 394 CG LEU A 42 11.742 -36.391 14.197 1.00 46.21 C ATOM 395 CD1 LEU A 42 10.457 -36.902 13.577 1.00 48.74 C ATOM 396 CD2 LEU A 42 11.553 -35.007 14.767 1.00 44.36 C ATOM 397 H LEU A 42 14.213 -37.963 13.857 1.00 0.00 H ATOM 398 N HIS A 43 14.032 -37.286 18.152 1.00 41.64 N ATOM 399 CA HIS A 43 14.371 -37.947 19.407 1.00 41.92 C ATOM 400 C HIS A 43 14.146 -36.975 20.552 1.00 39.88 C ATOM 401 O HIS A 43 13.915 -35.783 20.329 1.00 40.57 O ATOM 402 CB HIS A 43 15.846 -38.347 19.405 1.00 43.45 C ATOM 403 CG HIS A 43 16.769 -37.171 19.462 1.00 42.83 C ATOM 404 ND1 HIS A 43 17.286 -36.578 18.332 1.00 45.84 N ATOM 405 CD2 HIS A 43 17.213 -36.439 20.510 1.00 41.37 C ATOM 406 CE1 HIS A 43 18.031 -35.545 18.683 1.00 46.72 C ATOM 407 NE2 HIS A 43 18.001 -35.438 20.000 1.00 43.81 N ATOM 408 H HIS A 43 13.899 -36.255 18.146 1.00 0.00 H ATOM 409 N LEU A 44 14.264 -37.489 21.774 1.00 39.32 N ATOM 410 CA LEU A 44 14.155 -36.691 22.992 1.00 39.65 C ATOM 411 C LEU A 44 15.449 -36.821 23.778 1.00 40.60 C ATOM 412 O LEU A 44 15.759 -37.887 24.307 1.00 39.71 O ATOM 413 CB LEU A 44 12.982 -37.189 23.840 1.00 41.72 C ATOM 414 CG LEU A 44 12.611 -36.393 25.095 1.00 43.36 C ATOM 415 CD1 LEU A 44 11.160 -36.619 25.432 1.00 44.82 C ATOM 416 CD2 LEU A 44 13.472 -36.764 26.292 1.00 44.81 C ATOM 417 H LEU A 44 14.443 -38.509 21.866 1.00 0.00 H ATOM 418 N THR A 45 16.211 -35.738 23.854 1.00 43.28 N ATOM 419 CA THR A 45 17.497 -35.785 24.521 1.00 45.60 C ATOM 420 C THR A 45 17.289 -35.863 26.024 1.00 43.73 C ATOM 421 O THR A 45 16.428 -35.171 26.575 1.00 42.86 O ATOM 422 CB THR A 45 18.350 -34.559 24.191 1.00 50.16 C ATOM 423 OG1 THR A 45 18.466 -34.421 22.767 1.00 52.47 O ATOM 424 CG2 THR A 45 19.735 -34.702 24.800 1.00 51.31 C ATOM 425 HG1 THR A 45 19.019 -33.627 22.558 1.00 0.00 H ATOM 426 H THR A 45 15.883 -34.847 23.431 1.00 0.00 H ATOM 427 N LEU A 46 18.068 -36.729 26.670 1.00 40.34 N ATOM 428 CA LEU A 46 18.041 -36.878 28.118 1.00 39.25 C ATOM 429 C LEU A 46 19.186 -36.105 28.745 1.00 40.81 C ATOM 430 O LEU A 46 19.071 -35.610 29.868 1.00 42.42 O ATOM 431 CB LEU A 46 18.166 -38.348 28.507 1.00 41.17 C ATOM 432 CG LEU A 46 16.998 -39.261 28.120 1.00 44.16 C ATOM 433 CD1 LEU A 46 17.419 -40.714 28.235 1.00 45.75 C ATOM 434 CD2 LEU A 46 15.771 -38.989 28.985 1.00 44.40 C ATOM 435 H LEU A 46 18.721 -37.322 26.119 1.00 0.00 H ATOM 436 N ALA A 47 20.294 -36.015 28.010 1.00 41.01 N ATOM 437 CA ALA A 47 21.497 -35.332 28.486 1.00 41.28 C ATOM 438 C ALA A 47 22.513 -35.176 27.360 1.00 44.60 C ATOM 439 O ALA A 47 22.888 -36.157 26.714 1.00 50.36 O ATOM 440 CB ALA A 47 22.122 -36.097 29.651 1.00 39.13 C ATOM 441 H ALA A 47 20.304 -36.446 27.064 1.00 0.00 H ATOM 442 N PHE A 48 22.945 -33.939 27.131 1.00 46.43 N ATOM 443 CA PHE A 48 23.999 -33.638 26.170 1.00 47.02 C ATOM 444 C PHE A 48 25.344 -33.602 26.873 1.00 50.38 C ATOM 445 O PHE A 48 25.536 -32.863 27.836 1.00 55.19 O ATOM 446 CB PHE A 48 23.751 -32.292 25.496 1.00 46.74 C ATOM 447 CG PHE A 48 24.778 -31.944 24.461 1.00 48.17 C ATOM 448 CD1 PHE A 48 24.764 -32.559 23.221 1.00 43.62 C ATOM 449 CD2 PHE A 48 25.768 -31.009 24.731 1.00 52.16 C ATOM 450 CE1 PHE A 48 25.709 -32.244 22.270 1.00 46.90 C ATOM 451 CE2 PHE A 48 26.718 -30.688 23.780 1.00 52.95 C ATOM 452 CZ PHE A 48 26.690 -31.306 22.550 1.00 51.36 C ATOM 453 H PHE A 48 22.513 -33.154 27.659 1.00 0.00 H ATOM 454 N LEU A 49 26.284 -34.388 26.370 1.00 49.83 N ATOM 455 CA LEU A 49 27.543 -34.596 27.053 1.00 50.93 C ATOM 456 C LEU A 49 28.636 -33.730 26.442 1.00 56.92 C ATOM 457 O LEU A 49 29.624 -33.416 27.099 1.00 58.76 O ATOM 458 CB LEU A 49 27.918 -36.074 26.977 1.00 52.00 C ATOM 459 CG LEU A 49 26.822 -37.056 27.416 1.00 48.48 C ATOM 460 CD1 LEU A 49 27.287 -38.462 27.173 1.00 48.48 C ATOM 461 CD2 LEU A 49 26.451 -36.875 28.879 1.00 47.17 C ATOM 462 H LEU A 49 26.113 -34.867 25.463 1.00 0.00 H ATOM 463 N GLY A 50 28.453 -33.336 25.185 1.00 59.58 N ATOM 464 CA GLY A 50 29.440 -32.526 24.494 1.00 63.55 C ATOM 465 C GLY A 50 30.593 -33.375 24.007 1.00 66.68 C ATOM 466 O GLY A 50 30.459 -34.584 23.848 1.00 67.03 O ATOM 467 H GLY A 50 27.584 -33.614 24.686 1.00 0.00 H ATOM 468 N GLU A 51 31.734 -32.744 23.768 1.00 71.46 N ATOM 469 CA GLU A 51 32.921 -33.466 23.339 1.00 75.89 C ATOM 470 C GLU A 51 33.410 -34.349 24.490 1.00 72.23 C ATOM 471 O GLU A 51 33.589 -33.869 25.609 1.00 72.36 O ATOM 472 CB GLU A 51 34.006 -32.482 22.898 1.00 85.63 C ATOM 473 CG GLU A 51 34.688 -32.861 21.595 1.00 95.06 C ATOM 474 CD GLU A 51 35.727 -31.842 21.155 1.00108.23 C ATOM 475 OE1 GLU A 51 35.758 -30.730 21.726 1.00111.56 O ATOM 476 OE2 GLU A 51 36.516 -32.153 20.236 1.00115.41 O ATOM 477 H GLU A 51 31.781 -31.712 23.890 1.00 0.00 H ATOM 478 N VAL A 52 33.601 -35.639 24.219 1.00 69.75 N ATOM 479 CA VAL A 52 34.002 -36.595 25.247 1.00 68.31 C ATOM 480 C VAL A 52 35.109 -37.518 24.740 1.00 73.36 C ATOM 481 O VAL A 52 35.015 -38.059 23.641 1.00 76.80 O ATOM 482 CB VAL A 52 32.795 -37.454 25.703 1.00 68.03 C ATOM 483 CG1 VAL A 52 33.228 -38.519 26.725 1.00 68.92 C ATOM 484 CG2 VAL A 52 31.678 -36.563 26.262 1.00 62.04 C ATOM 485 H VAL A 52 33.460 -35.976 23.245 1.00 0.00 H ATOM 486 N SER A 53 36.152 -37.696 25.548 1.00 74.87 N ATOM 487 CA SER A 53 37.221 -38.635 25.224 1.00 79.34 C ATOM 488 C SER A 53 36.747 -40.080 25.375 1.00 79.60 C ATOM 489 O SER A 53 35.680 -40.345 25.935 1.00 71.24 O ATOM 490 CB SER A 53 38.432 -38.404 26.128 1.00 81.65 C ATOM 491 OG SER A 53 38.139 -38.757 27.467 1.00 76.97 O ATOM 492 HG SER A 53 38.937 -38.599 28.031 1.00 0.00 H ATOM 493 H SER A 53 36.206 -37.152 26.433 1.00 0.00 H ATOM 494 N ALA A 54 37.561 -41.011 24.887 1.00 79.71 N ATOM 495 CA ALA A 54 37.226 -42.428 24.943 1.00 80.19 C ATOM 496 C ALA A 54 37.216 -42.927 26.381 1.00 79.06 C ATOM 497 O ALA A 54 36.364 -43.732 26.757 1.00 81.05 O ATOM 498 CB ALA A 54 38.209 -43.237 24.110 1.00 81.91 C ATOM 499 H ALA A 54 38.461 -40.720 24.454 1.00 0.00 H ATOM 500 N GLU A 55 38.162 -42.449 27.183 1.00 78.20 N ATOM 501 CA GLU A 55 38.246 -42.860 28.578 1.00 76.44 C ATOM 502 C GLU A 55 36.988 -42.456 29.327 1.00 74.38 C ATOM 503 O GLU A 55 36.479 -43.211 30.153 1.00 73.52 O ATOM 504 CB GLU A 55 39.473 -42.248 29.260 1.00 80.58 C ATOM 505 CG GLU A 55 39.422 -42.339 30.780 1.00 83.44 C ATOM 506 CD GLU A 55 40.739 -41.992 31.440 1.00 90.57 C ATOM 507 OE1 GLU A 55 40.780 -41.003 32.201 1.00 92.40 O ATOM 508 OE2 GLU A 55 41.730 -42.718 31.209 1.00 94.58 O ATOM 509 H GLU A 55 38.854 -41.770 26.808 1.00 0.00 H ATOM 510 N LYS A 56 36.486 -41.262 29.036 1.00 74.45 N ATOM 511 CA LYS A 56 35.304 -40.756 29.717 1.00 75.83 C ATOM 512 C LYS A 56 34.034 -41.372 29.143 1.00 70.15 C ATOM 513 O LYS A 56 33.037 -41.525 29.852 1.00 69.90 O ATOM 514 CB LYS A 56 35.235 -39.239 29.610 1.00 82.65 C ATOM 515 CG LYS A 56 35.056 -38.547 30.943 1.00 90.50 C ATOM 516 CD LYS A 56 35.195 -37.045 30.797 1.00 98.06 C ATOM 517 CE LYS A 56 34.004 -36.434 30.068 1.00 99.16 C ATOM 518 NZ LYS A 56 34.289 -35.037 29.639 1.00103.16 N ATOM 519 HZ1 LYS A 56 34.499 -34.455 30.475 1.00 0.00 H ATOM 520 HZ2 LYS A 56 35.107 -35.033 28.997 1.00 0.00 H ATOM 521 HZ3 LYS A 56 33.459 -34.651 29.146 1.00 0.00 H ATOM 522 H LYS A 56 36.946 -40.678 28.308 1.00 0.00 H ATOM 523 N GLU A 57 34.065 -41.715 27.858 1.00 66.54 N ATOM 524 CA GLU A 57 32.955 -42.433 27.247 1.00 60.59 C ATOM 525 C GLU A 57 32.802 -43.772 27.948 1.00 61.47 C ATOM 526 O GLU A 57 31.698 -44.153 28.331 1.00 59.24 O ATOM 527 CB GLU A 57 33.184 -42.639 25.749 1.00 60.00 C ATOM 528 CG GLU A 57 32.180 -43.585 25.094 1.00 61.03 C ATOM 529 CD GLU A 57 32.257 -43.581 23.577 1.00 66.66 C ATOM 530 OE1 GLU A 57 32.889 -42.665 23.010 1.00 70.16 O ATOM 531 OE2 GLU A 57 31.683 -44.498 22.947 1.00 67.76 O ATOM 532 H GLU A 57 34.894 -41.467 27.281 1.00 0.00 H ATOM 533 N LYS A 58 33.922 -44.473 28.116 1.00 65.73 N ATOM 534 CA LYS A 58 33.948 -45.740 28.836 1.00 67.83 C ATOM 535 C LYS A 58 33.303 -45.596 30.210 1.00 67.56 C ATOM 536 O LYS A 58 32.402 -46.356 30.567 1.00 68.95 O ATOM 537 CB LYS A 58 35.389 -46.232 29.008 1.00 71.68 C ATOM 538 CG LYS A 58 35.848 -47.263 27.981 1.00 74.83 C ATOM 539 CD LYS A 58 37.256 -47.800 28.297 1.00 79.49 C ATOM 540 CE LYS A 58 37.291 -48.638 29.581 1.00 81.20 C ATOM 541 NZ LYS A 58 38.645 -49.198 29.885 1.00 85.57 N ATOM 542 HZ1 LYS A 58 38.949 -49.811 29.102 1.00 0.00 H ATOM 543 HZ2 LYS A 58 39.323 -48.418 30.000 1.00 0.00 H ATOM 544 HZ3 LYS A 58 38.600 -49.753 30.763 1.00 0.00 H ATOM 545 H LYS A 58 34.809 -44.103 27.719 1.00 0.00 H ATOM 546 N ALA A 59 33.764 -44.609 30.971 1.00 66.93 N ATOM 547 CA ALA A 59 33.329 -44.434 32.352 1.00 66.26 C ATOM 548 C ALA A 59 31.854 -44.074 32.431 1.00 66.10 C ATOM 549 O ALA A 59 31.129 -44.589 33.281 1.00 67.24 O ATOM 550 CB ALA A 59 34.160 -43.368 33.030 1.00 66.34 C ATOM 551 H ALA A 59 34.455 -43.942 30.570 1.00 0.00 H ATOM 552 N LEU A 60 31.418 -43.179 31.552 1.00 65.22 N ATOM 553 CA LEU A 60 30.017 -42.796 31.493 1.00 62.87 C ATOM 554 C LEU A 60 29.168 -43.995 31.110 1.00 62.38 C ATOM 555 O LEU A 60 28.118 -44.237 31.705 1.00 63.30 O ATOM 556 CB LEU A 60 29.810 -41.680 30.474 1.00 61.52 C ATOM 557 CG LEU A 60 30.305 -40.296 30.889 1.00 63.24 C ATOM 558 CD1 LEU A 60 30.352 -39.368 29.690 1.00 62.26 C ATOM 559 CD2 LEU A 60 29.422 -39.715 31.980 1.00 62.76 C ATOM 560 H LEU A 60 32.093 -42.743 30.892 1.00 0.00 H ATOM 561 N SER A 61 29.629 -44.734 30.104 1.00 62.05 N ATOM 562 CA SER A 61 28.924 -45.918 29.624 1.00 60.18 C ATOM 563 C SER A 61 28.723 -46.930 30.744 1.00 61.16 C ATOM 564 O SER A 61 27.746 -47.680 30.745 1.00 62.84 O ATOM 565 CB SER A 61 29.686 -46.575 28.472 1.00 59.16 C ATOM 566 OG SER A 61 29.438 -45.905 27.248 1.00 57.83 O ATOM 567 HG SER A 61 29.730 -44.962 27.324 1.00 0.00 H ATOM 568 H SER A 61 30.521 -44.459 29.645 1.00 0.00 H ATOM 569 N LEU A 62 29.640 -46.935 31.704 1.00 60.28 N ATOM 570 CA LEU A 62 29.558 -47.863 32.821 1.00 63.30 C ATOM 571 C LEU A 62 28.542 -47.386 33.852 1.00 62.64 C ATOM 572 O LEU A 62 27.731 -48.171 34.349 1.00 62.78 O ATOM 573 CB LEU A 62 30.934 -48.035 33.472 1.00 68.40 C ATOM 574 CG LEU A 62 31.553 -49.433 33.386 1.00 72.40 C ATOM 575 CD1 LEU A 62 31.712 -49.892 31.940 1.00 73.81 C ATOM 576 CD2 LEU A 62 32.895 -49.449 34.097 1.00 75.77 C ATOM 577 H LEU A 62 30.432 -46.263 31.656 1.00 0.00 H ATOM 578 N LEU A 63 28.588 -46.100 34.176 1.00 61.74 N ATOM 579 CA LEU A 63 27.639 -45.532 35.118 1.00 62.37 C ATOM 580 C LEU A 63 26.214 -45.737 34.608 1.00 60.77 C ATOM 581 O LEU A 63 25.319 -46.083 35.375 1.00 60.97 O ATOM 582 CB LEU A 63 27.925 -44.045 35.328 1.00 62.85 C ATOM 583 CG LEU A 63 29.272 -43.729 35.987 1.00 64.10 C ATOM 584 CD1 LEU A 63 29.553 -42.235 35.941 1.00 64.48 C ATOM 585 CD2 LEU A 63 29.295 -44.229 37.418 1.00 64.68 C ATOM 586 H LEU A 63 29.314 -45.490 33.749 1.00 0.00 H ATOM 587 N ALA A 64 26.013 -45.540 33.308 1.00 59.48 N ATOM 588 CA ALA A 64 24.697 -45.732 32.706 1.00 59.17 C ATOM 589 C ALA A 64 24.261 -47.179 32.884 1.00 57.39 C ATOM 590 O ALA A 64 23.077 -47.466 33.065 1.00 59.97 O ATOM 591 CB ALA A 64 24.726 -45.366 31.229 1.00 58.47 C ATOM 592 H ALA A 64 26.809 -45.243 32.708 1.00 0.00 H ATOM 593 N GLY A 65 25.235 -48.083 32.836 1.00 54.06 N ATOM 594 CA GLY A 65 24.984 -49.500 32.990 1.00 51.38 C ATOM 595 C GLY A 65 24.575 -49.845 34.406 1.00 54.94 C ATOM 596 O GLY A 65 24.021 -50.916 34.654 1.00 53.80 O ATOM 597 H GLY A 65 26.212 -47.760 32.682 1.00 0.00 H ATOM 598 N ARG A 66 24.859 -48.940 35.339 1.00 60.34 N ATOM 599 CA ARG A 66 24.504 -49.145 36.742 1.00 65.62 C ATOM 600 C ARG A 66 23.083 -48.670 37.020 1.00 62.15 C ATOM 601 O ARG A 66 22.526 -48.956 38.078 1.00 63.87 O ATOM 602 CB ARG A 66 25.475 -48.408 37.668 1.00 70.70 C ATOM 603 CG ARG A 66 26.808 -49.101 37.884 1.00 75.84 C ATOM 604 CD ARG A 66 27.731 -48.251 38.757 1.00 81.26 C ATOM 605 NE ARG A 66 28.796 -49.039 39.375 1.00 89.32 N ATOM 606 CZ ARG A 66 28.679 -49.701 40.525 1.00 96.00 C ATOM 607 NH1 ARG A 66 27.537 -49.684 41.203 1.00 97.75 N ATOM 608 NH2 ARG A 66 29.708 -50.387 41.003 1.00 99.64 N ATOM 609 HE ARG A 66 29.710 -49.086 38.882 1.00 0.00 H ATOM 610 HH12 ARG A 66 27.457 -50.204 42.100 1.00 0.00 H ATOM 611 HH11 ARG A 66 26.723 -49.150 40.837 1.00 0.00 H ATOM 612 HH22 ARG A 66 29.616 -50.904 41.901 1.00 0.00 H ATOM 613 HH21 ARG A 66 30.607 -50.408 40.480 1.00 0.00 H ATOM 614 H ARG A 66 25.346 -48.064 35.063 1.00 0.00 H ATOM 615 N ILE A 67 22.501 -47.941 36.072 1.00 57.85 N ATOM 616 CA ILE A 67 21.135 -47.454 36.223 1.00 54.79 C ATOM 617 C ILE A 67 20.137 -48.608 36.230 1.00 58.16 C ATOM 618 O ILE A 67 20.205 -49.519 35.400 1.00 58.68 O ATOM 619 CB ILE A 67 20.752 -46.459 35.109 1.00 49.48 C ATOM 620 CG1 ILE A 67 21.571 -45.173 35.256 1.00 49.72 C ATOM 621 CG2 ILE A 67 19.244 -46.155 35.150 1.00 46.66 C ATOM 622 CD1 ILE A 67 21.281 -44.095 34.208 1.00 46.83 C ATOM 623 H ILE A 67 23.031 -47.714 35.206 1.00 0.00 H ATOM 624 N ARG A 68 19.201 -48.526 37.168 1.00 58.45 N ATOM 625 CA ARG A 68 18.229 -49.572 37.417 1.00 58.69 C ATOM 626 C ARG A 68 16.883 -48.892 37.617 1.00 58.67 C ATOM 627 O ARG A 68 16.583 -48.391 38.698 1.00 60.02 O ATOM 628 CB ARG A 68 18.649 -50.368 38.659 1.00 60.87 C ATOM 629 CG ARG A 68 18.774 -51.874 38.458 1.00 63.00 C ATOM 630 CD ARG A 68 19.632 -52.243 37.257 1.00 62.24 C ATOM 631 NE ARG A 68 20.941 -52.780 37.618 1.00 63.85 N ATOM 632 CZ ARG A 68 22.026 -52.670 36.859 1.00 62.68 C ATOM 633 NH1 ARG A 68 23.172 -53.198 37.266 1.00 64.59 N ATOM 634 NH2 ARG A 68 21.971 -52.024 35.700 1.00 60.52 N ATOM 635 HE ARG A 68 21.030 -53.280 38.526 1.00 0.00 H ATOM 636 HH12 ARG A 68 24.023 -53.113 36.674 1.00 0.00 H ATOM 637 HH11 ARG A 68 23.220 -53.697 38.177 1.00 0.00 H ATOM 638 HH22 ARG A 68 22.823 -51.941 35.110 1.00 0.00 H ATOM 639 HH21 ARG A 68 21.076 -51.601 35.382 1.00 0.00 H ATOM 640 H ARG A 68 19.163 -47.668 37.754 1.00 0.00 H ATOM 641 N GLN A 69 16.083 -48.857 36.556 1.00 58.60 N ATOM 642 CA GLN A 69 14.869 -48.055 36.549 1.00 58.59 C ATOM 643 C GLN A 69 13.783 -48.672 35.672 1.00 51.43 C ATOM 644 O GLN A 69 14.051 -49.054 34.537 1.00 49.71 O ATOM 645 CB GLN A 69 15.192 -46.661 36.026 1.00 63.27 C ATOM 646 CG GLN A 69 14.150 -45.636 36.362 1.00 69.40 C ATOM 647 CD GLN A 69 14.366 -44.357 35.602 1.00 73.99 C ATOM 648 OE1 GLN A 69 15.371 -43.669 35.793 1.00 76.89 O ATOM 649 NE2 GLN A 69 13.433 -44.036 34.716 1.00 74.30 N ATOM 650 HE22 GLN A 69 12.602 -44.649 34.591 1.00 0.00 H ATOM 651 HE21 GLN A 69 13.532 -43.171 34.147 1.00 0.00 H ATOM 652 H GLN A 69 16.330 -49.414 35.713 1.00 0.00 H ATOM 653 N PRO A 70 12.546 -48.754 36.188 1.00 48.48 N ATOM 654 CA PRO A 70 11.462 -49.328 35.381 1.00 49.22 C ATOM 655 C PRO A 70 11.178 -48.539 34.112 1.00 48.94 C ATOM 656 O PRO A 70 11.447 -47.342 34.057 1.00 49.89 O ATOM 657 CB PRO A 70 10.247 -49.256 36.313 1.00 48.69 C ATOM 658 CG PRO A 70 10.816 -49.166 37.682 1.00 51.08 C ATOM 659 CD PRO A 70 12.092 -48.404 37.545 1.00 49.83 C ATOM 660 N GLY A 71 10.636 -49.213 33.106 1.00 49.07 N ATOM 661 CA GLY A 71 10.193 -48.538 31.904 1.00 50.90 C ATOM 662 C GLY A 71 9.014 -47.653 32.257 1.00 53.29 C ATOM 663 O GLY A 71 8.481 -47.742 33.362 1.00 60.48 O ATOM 664 H GLY A 71 10.527 -50.245 33.182 1.00 0.00 H ATOM 665 N PHE A 72 8.605 -46.799 31.325 1.00 46.95 N ATOM 666 CA PHE A 72 7.483 -45.901 31.548 1.00 40.83 C ATOM 667 C PHE A 72 6.889 -45.513 30.206 1.00 40.45 C ATOM 668 O PHE A 72 7.462 -45.812 29.155 1.00 41.81 O ATOM 669 CB PHE A 72 7.945 -44.656 32.297 1.00 42.59 C ATOM 670 CG PHE A 72 9.081 -43.934 31.625 1.00 43.53 C ATOM 671 CD1 PHE A 72 10.386 -44.155 32.021 1.00 45.61 C ATOM 672 CD2 PHE A 72 8.845 -43.047 30.591 1.00 43.80 C ATOM 673 CE1 PHE A 72 11.434 -43.502 31.404 1.00 45.30 C ATOM 674 CE2 PHE A 72 9.888 -42.397 29.967 1.00 43.51 C ATOM 675 CZ PHE A 72 11.184 -42.625 30.376 1.00 44.34 C ATOM 676 H PHE A 72 9.101 -46.772 30.411 1.00 0.00 H ATOM 677 N THR A 73 5.744 -44.838 30.247 1.00 40.31 N ATOM 678 CA THR A 73 5.001 -44.493 29.043 1.00 39.30 C ATOM 679 C THR A 73 5.095 -42.996 28.780 1.00 39.10 C ATOM 680 O THR A 73 4.974 -42.200 29.704 1.00 40.68 O ATOM 681 CB THR A 73 3.516 -44.880 29.194 1.00 41.20 C ATOM 682 OG1 THR A 73 3.402 -46.296 29.331 1.00 45.66 O ATOM 683 CG2 THR A 73 2.694 -44.436 27.986 1.00 41.40 C ATOM 684 HG1 THR A 73 2.448 -46.541 29.428 1.00 0.00 H ATOM 685 H THR A 73 5.366 -44.546 31.171 1.00 0.00 H ATOM 686 N LEU A 74 5.327 -42.628 27.520 1.00 41.10 N ATOM 687 CA LEU A 74 5.272 -41.234 27.087 1.00 44.67 C ATOM 688 C LEU A 74 4.045 -41.008 26.232 1.00 43.11 C ATOM 689 O LEU A 74 3.759 -41.795 25.334 1.00 42.00 O ATOM 690 CB LEU A 74 6.473 -40.864 26.226 1.00 47.35 C ATOM 691 CG LEU A 74 7.855 -40.761 26.843 1.00 51.11 C ATOM 692 CD1 LEU A 74 8.782 -40.112 25.833 1.00 50.40 C ATOM 693 CD2 LEU A 74 7.827 -39.974 28.129 1.00 55.08 C ATOM 694 H LEU A 74 5.556 -43.361 26.819 1.00 0.00 H ATOM 695 N THR A 75 3.358 -39.904 26.495 1.00 42.13 N ATOM 696 CA THR A 75 2.222 -39.484 25.696 1.00 42.46 C ATOM 697 C THR A 75 2.414 -38.014 25.341 1.00 38.85 C ATOM 698 O THR A 75 2.349 -37.153 26.211 1.00 39.63 O ATOM 699 CB THR A 75 0.914 -39.650 26.479 1.00 45.74 C ATOM 700 OG1 THR A 75 0.830 -40.986 26.989 1.00 46.11 O ATOM 701 CG2 THR A 75 -0.290 -39.360 25.594 1.00 46.03 C ATOM 702 HG1 THR A 75 0.848 -41.627 26.235 1.00 0.00 H ATOM 703 H THR A 75 3.645 -39.317 27.305 1.00 0.00 H ATOM 704 N LEU A 76 2.671 -37.735 24.067 1.00 35.60 N ATOM 705 CA LEU A 76 2.953 -36.376 23.629 1.00 36.49 C ATOM 706 C LEU A 76 1.682 -35.551 23.438 1.00 37.79 C ATOM 707 O LEU A 76 1.086 -35.559 22.361 1.00 35.61 O ATOM 708 CB LEU A 76 3.742 -36.399 22.329 1.00 37.07 C ATOM 709 CG LEU A 76 4.938 -37.349 22.307 1.00 39.22 C ATOM 710 CD1 LEU A 76 5.658 -37.207 20.981 1.00 38.78 C ATOM 711 CD2 LEU A 76 5.879 -37.098 23.481 1.00 39.87 C ATOM 712 H LEU A 76 2.671 -38.505 23.368 1.00 0.00 H ATOM 713 N ASP A 77 1.302 -34.810 24.476 1.00 40.21 N ATOM 714 CA ASP A 77 0.085 -34.012 24.448 1.00 42.64 C ATOM 715 C ASP A 77 0.352 -32.533 24.217 1.00 42.84 C ATOM 716 O ASP A 77 -0.588 -31.751 24.117 1.00 45.79 O ATOM 717 CB ASP A 77 -0.714 -34.200 25.748 1.00 48.01 C ATOM 718 CG ASP A 77 0.093 -33.875 26.992 1.00 53.11 C ATOM 719 OD1 ASP A 77 -0.390 -34.156 28.112 1.00 55.23 O ATOM 720 OD2 ASP A 77 1.210 -33.341 26.858 1.00 55.10 O ATOM 721 H ASP A 77 1.892 -34.801 25.332 1.00 0.00 H ATOM 722 N ASP A 78 1.624 -32.152 24.122 1.00 42.70 N ATOM 723 CA ASP A 78 1.990 -30.739 24.095 1.00 42.20 C ATOM 724 C ASP A 78 2.912 -30.390 22.934 1.00 41.90 C ATOM 725 O ASP A 78 3.732 -31.196 22.511 1.00 40.94 O ATOM 726 CB ASP A 78 2.659 -30.348 25.416 1.00 45.26 C ATOM 727 CG ASP A 78 2.662 -28.845 25.653 1.00 50.26 C ATOM 728 OD1 ASP A 78 1.938 -28.125 24.935 1.00 50.51 O ATOM 729 OD2 ASP A 78 3.383 -28.384 26.567 1.00 53.98 O ATOM 730 H ASP A 78 2.370 -32.874 24.066 1.00 0.00 H ATOM 731 N ALA A 79 2.761 -29.173 22.425 1.00 44.70 N ATOM 732 CA ALA A 79 3.660 -28.641 21.411 1.00 45.59 C ATOM 733 C ALA A 79 3.872 -27.162 21.689 1.00 47.31 C ATOM 734 O ALA A 79 3.119 -26.552 22.441 1.00 46.53 O ATOM 735 CB ALA A 79 3.096 -28.856 20.020 1.00 45.36 C ATOM 736 H ALA A 79 1.975 -28.581 22.762 1.00 0.00 H ATOM 737 N GLY A 80 4.916 -26.591 21.101 1.00 49.76 N ATOM 738 CA GLY A 80 5.245 -25.203 21.349 1.00 49.63 C ATOM 739 C GLY A 80 6.433 -24.731 20.539 1.00 49.62 C ATOM 740 O GLY A 80 6.889 -25.418 19.624 1.00 46.70 O ATOM 741 H GLY A 80 5.507 -27.149 20.452 1.00 0.00 H ATOM 742 N GLN A 81 6.932 -23.549 20.891 1.00 53.44 N ATOM 743 CA GLN A 81 7.993 -22.896 20.144 1.00 56.81 C ATOM 744 C GLN A 81 8.828 -21.999 21.050 1.00 61.67 C ATOM 745 O GLN A 81 8.297 -21.117 21.727 1.00 64.75 O ATOM 746 CB GLN A 81 7.384 -22.060 19.015 1.00 59.99 C ATOM 747 CG GLN A 81 8.306 -20.991 18.457 1.00 63.18 C ATOM 748 CD GLN A 81 7.761 -20.363 17.198 1.00 66.51 C ATOM 749 OE1 GLN A 81 6.559 -20.102 17.088 1.00 67.60 O ATOM 750 NE2 GLN A 81 8.642 -20.117 16.232 1.00 68.03 N ATOM 751 HE22 GLN A 81 9.645 -20.354 16.370 1.00 0.00 H ATOM 752 HE21 GLN A 81 8.328 -19.687 15.339 1.00 0.00 H ATOM 753 H GLN A 81 6.548 -23.075 21.733 1.00 0.00 H ATOM 754 N TRP A 82 10.138 -22.226 21.051 1.00 62.02 N ATOM 755 CA TRP A 82 11.075 -21.363 21.762 1.00 64.33 C ATOM 756 C TRP A 82 11.741 -20.446 20.754 1.00 66.47 C ATOM 757 O TRP A 82 12.507 -20.894 19.906 1.00 65.40 O ATOM 758 CB TRP A 82 12.130 -22.201 22.479 1.00 64.89 C ATOM 759 CG TRP A 82 11.566 -23.064 23.575 1.00 65.29 C ATOM 760 CD1 TRP A 82 10.470 -22.796 24.346 1.00 66.23 C ATOM 761 CD2 TRP A 82 12.060 -24.339 24.012 1.00 62.81 C ATOM 762 NE1 TRP A 82 10.257 -23.820 25.238 1.00 63.56 N ATOM 763 CE2 TRP A 82 11.221 -24.777 25.053 1.00 62.37 C ATOM 764 CE3 TRP A 82 13.130 -25.150 23.623 1.00 64.01 C ATOM 765 CZ2 TRP A 82 11.419 -25.989 25.711 1.00 61.43 C ATOM 766 CZ3 TRP A 82 13.325 -26.355 24.281 1.00 63.05 C ATOM 767 CH2 TRP A 82 12.474 -26.761 25.312 1.00 61.66 C ATOM 768 HE1 TRP A 82 9.490 -23.862 25.939 1.00 0.00 H ATOM 769 H TRP A 82 10.507 -23.046 20.528 1.00 0.00 H ATOM 770 N LEU A 83 11.446 -19.158 20.849 1.00 70.54 N ATOM 771 CA LEU A 83 11.911 -18.207 19.858 1.00 75.79 C ATOM 772 C LEU A 83 13.398 -17.935 19.982 1.00 79.95 C ATOM 773 O LEU A 83 14.067 -17.680 18.982 1.00 82.53 O ATOM 774 CB LEU A 83 11.130 -16.905 19.985 1.00 81.87 C ATOM 775 CG LEU A 83 9.729 -16.916 19.377 1.00 84.56 C ATOM 776 CD1 LEU A 83 8.951 -15.702 19.846 1.00 88.65 C ATOM 777 CD2 LEU A 83 9.819 -16.937 17.862 1.00 87.31 C ATOM 778 H LEU A 83 10.871 -18.823 21.648 1.00 0.00 H ATOM 779 N ARG A 84 13.919 -17.983 21.204 1.00 84.16 N ATOM 780 CA ARG A 84 15.329 -17.673 21.435 1.00 91.58 C ATOM 781 C ARG A 84 16.194 -18.751 20.786 1.00 85.36 C ATOM 782 O ARG A 84 17.191 -18.454 20.124 1.00 88.35 O ATOM 783 CB ARG A 84 15.653 -17.614 22.930 1.00100.31 C ATOM 784 CG ARG A 84 14.627 -16.892 23.806 1.00107.85 C ATOM 785 CD ARG A 84 14.623 -17.432 25.237 1.00111.39 C ATOM 786 NE ARG A 84 14.670 -18.896 25.285 1.00109.75 N ATOM 787 CZ ARG A 84 13.625 -19.701 25.103 1.00106.02 C ATOM 788 NH1 ARG A 84 12.419 -19.202 24.862 1.00105.14 N ATOM 789 NH2 ARG A 84 13.794 -21.015 25.164 1.00102.43 N ATOM 790 HE ARG A 84 15.591 -19.341 25.476 1.00 0.00 H ATOM 791 HH12 ARG A 84 11.610 -19.841 24.722 1.00 0.00 H ATOM 792 HH11 ARG A 84 12.283 -18.172 24.814 1.00 0.00 H ATOM 793 HH22 ARG A 84 12.983 -21.651 25.023 1.00 0.00 H ATOM 794 HH21 ARG A 84 14.737 -21.410 25.353 1.00 0.00 H ATOM 795 H ARG A 84 13.314 -18.245 22.008 1.00 0.00 H ATOM 796 N SER A 85 15.792 -20.005 20.982 1.00 76.28 N ATOM 797 CA SER A 85 16.483 -21.157 20.409 1.00 70.36 C ATOM 798 C SER A 85 16.090 -21.345 18.949 1.00 66.34 C ATOM 799 O SER A 85 16.739 -22.086 18.210 1.00 63.95 O ATOM 800 CB SER A 85 16.117 -22.425 21.180 1.00 67.92 C ATOM 801 OG SER A 85 16.091 -22.192 22.578 1.00 70.64 O ATOM 802 HG SER A 85 15.851 -23.030 23.047 1.00 0.00 H ATOM 803 H SER A 85 14.949 -20.171 21.569 1.00 0.00 H ATOM 804 N ARG A 86 15.011 -20.679 18.553 1.00 66.67 N ATOM 805 CA ARG A 86 14.481 -20.768 17.196 1.00 68.25 C ATOM 806 C ARG A 86 14.090 -22.192 16.790 1.00 64.11 C ATOM 807 O ARG A 86 14.421 -22.638 15.691 1.00 64.62 O ATOM 808 CB ARG A 86 15.477 -20.180 16.195 1.00 73.00 C ATOM 809 CG ARG A 86 15.759 -18.707 16.426 1.00 78.56 C ATOM 810 CD ARG A 86 16.341 -18.051 15.194 1.00 82.55 C ATOM 811 NE ARG A 86 16.330 -16.593 15.311 1.00 87.56 N ATOM 812 CZ ARG A 86 17.383 -15.799 15.112 1.00 91.88 C ATOM 813 NH1 ARG A 86 17.245 -14.488 15.252 1.00 95.42 N ATOM 814 NH2 ARG A 86 18.569 -16.298 14.777 1.00 92.04 N ATOM 815 HE ARG A 86 15.430 -16.140 15.570 1.00 0.00 H ATOM 816 HH12 ARG A 86 18.060 -13.860 15.099 1.00 0.00 H ATOM 817 HH11 ARG A 86 16.322 -14.087 15.515 1.00 0.00 H ATOM 818 HH22 ARG A 86 19.377 -15.661 14.626 1.00 0.00 H ATOM 819 HH21 ARG A 86 18.688 -17.325 14.666 1.00 0.00 H ATOM 820 H ARG A 86 14.523 -20.068 19.239 1.00 0.00 H ATOM 821 N VAL A 87 13.371 -22.888 17.670 1.00 60.75 N ATOM 822 CA VAL A 87 12.882 -24.237 17.377 1.00 58.60 C ATOM 823 C VAL A 87 11.387 -24.385 17.637 1.00 57.56 C ATOM 824 O VAL A 87 10.812 -23.650 18.442 1.00 57.95 O ATOM 825 CB VAL A 87 13.604 -25.313 18.221 1.00 55.91 C ATOM 826 CG1 VAL A 87 15.064 -25.418 17.817 1.00 56.51 C ATOM 827 CG2 VAL A 87 13.471 -25.002 19.703 1.00 55.41 C ATOM 828 H VAL A 87 13.151 -22.461 18.592 1.00 0.00 H ATOM 829 N VAL A 88 10.774 -25.338 16.934 1.00 55.23 N ATOM 830 CA VAL A 88 9.420 -25.794 17.230 1.00 52.45 C ATOM 831 C VAL A 88 9.548 -27.227 17.720 1.00 52.93 C ATOM 832 O VAL A 88 10.165 -28.070 17.062 1.00 54.56 O ATOM 833 CB VAL A 88 8.486 -25.722 15.995 1.00 48.11 C ATOM 834 CG1 VAL A 88 7.131 -26.367 16.299 1.00 43.63 C ATOM 835 CG2 VAL A 88 8.319 -24.266 15.529 1.00 47.58 C ATOM 836 H VAL A 88 11.283 -25.775 16.140 1.00 0.00 H ATOM 837 N TRP A 89 8.973 -27.489 18.888 1.00 50.83 N ATOM 838 CA TRP A 89 9.200 -28.741 19.588 1.00 47.73 C ATOM 839 C TRP A 89 7.917 -29.459 19.953 1.00 46.28 C ATOM 840 O TRP A 89 6.843 -28.863 20.042 1.00 46.25 O ATOM 841 CB TRP A 89 10.003 -28.482 20.864 1.00 48.64 C ATOM 842 CG TRP A 89 9.447 -27.379 21.697 1.00 49.23 C ATOM 843 CD1 TRP A 89 9.854 -26.081 21.710 1.00 53.21 C ATOM 844 CD2 TRP A 89 8.373 -27.473 22.637 1.00 47.75 C ATOM 845 NE1 TRP A 89 9.102 -25.358 22.603 1.00 53.78 N ATOM 846 CE2 TRP A 89 8.185 -26.192 23.185 1.00 50.71 C ATOM 847 CE3 TRP A 89 7.553 -28.519 23.070 1.00 46.83 C ATOM 848 CZ2 TRP A 89 7.214 -25.926 24.145 1.00 51.05 C ATOM 849 CZ3 TRP A 89 6.589 -28.255 24.020 1.00 47.51 C ATOM 850 CH2 TRP A 89 6.427 -26.969 24.548 1.00 49.87 C ATOM 851 HE1 TRP A 89 9.211 -24.344 22.804 1.00 0.00 H ATOM 852 H TRP A 89 8.343 -26.779 19.313 1.00 0.00 H ATOM 853 N LEU A 90 8.066 -30.759 20.164 1.00 45.42 N ATOM 854 CA LEU A 90 6.999 -31.626 20.614 1.00 44.73 C ATOM 855 C LEU A 90 7.355 -32.010 22.038 1.00 45.43 C ATOM 856 O LEU A 90 8.531 -32.188 22.348 1.00 48.71 O ATOM 857 CB LEU A 90 6.973 -32.859 19.728 1.00 45.88 C ATOM 858 CG LEU A 90 5.655 -33.581 19.509 1.00 51.56 C ATOM 859 CD1 LEU A 90 4.602 -32.657 18.926 1.00 55.81 C ATOM 860 CD2 LEU A 90 5.887 -34.766 18.591 1.00 52.76 C ATOM 861 H LEU A 90 9.002 -31.179 19.997 1.00 0.00 H ATOM 862 N GLY A 91 6.367 -32.130 22.916 1.00 43.56 N ATOM 863 CA GLY A 91 6.665 -32.445 24.300 1.00 44.36 C ATOM 864 C GLY A 91 5.498 -33.022 25.065 1.00 48.78 C ATOM 865 O GLY A 91 4.618 -33.663 24.488 1.00 45.85 O ATOM 866 H GLY A 91 5.381 -31.998 22.612 1.00 0.00 H ATOM 867 N MET A 92 5.485 -32.748 26.369 1.00 51.58 N ATOM 868 CA MET A 92 4.506 -33.309 27.290 1.00 55.86 C ATOM 869 C MET A 92 4.205 -32.311 28.421 1.00 55.78 C ATOM 870 O MET A 92 5.124 -31.697 28.959 1.00 59.20 O ATOM 871 CB MET A 92 5.061 -34.618 27.858 1.00 55.29 C ATOM 872 CG MET A 92 4.017 -35.581 28.406 1.00 56.69 C ATOM 873 SD MET A 92 4.627 -37.283 28.478 1.00 79.01 S ATOM 874 CE MET A 92 3.259 -38.120 29.270 1.00 37.13 C ATOM 875 H MET A 92 6.208 -32.103 26.747 1.00 0.00 H ATOM 876 N ARG A 93 2.928 -32.132 28.770 1.00 54.31 N ATOM 877 CA ARG A 93 2.558 -31.209 29.842 1.00 50.74 C ATOM 878 C ARG A 93 3.026 -31.664 31.212 1.00 49.46 C ATOM 879 O ARG A 93 3.480 -30.859 32.019 1.00 50.03 O ATOM 880 CB ARG A 93 1.038 -31.047 29.890 1.00 51.78 C ATOM 881 CG ARG A 93 0.421 -30.461 28.638 1.00 50.08 C ATOM 882 CD ARG A 93 -1.091 -30.485 28.708 1.00 49.04 C ATOM 883 NE ARG A 93 -1.662 -29.950 27.482 1.00 48.00 N ATOM 884 CZ ARG A 93 -1.800 -28.655 27.235 1.00 50.24 C ATOM 885 NH1 ARG A 93 -2.323 -28.257 26.084 1.00 49.53 N ATOM 886 NH2 ARG A 93 -1.422 -27.757 28.138 1.00 53.45 N ATOM 887 HE ARG A 93 -1.981 -30.623 26.756 1.00 0.00 H ATOM 888 HH12 ARG A 93 -2.433 -27.242 25.886 1.00 0.00 H ATOM 889 HH11 ARG A 93 -2.623 -28.960 25.379 1.00 0.00 H ATOM 890 HH22 ARG A 93 -1.532 -26.742 27.940 1.00 0.00 H ATOM 891 HH21 ARG A 93 -1.016 -28.069 29.043 1.00 0.00 H ATOM 892 H ARG A 93 2.183 -32.659 28.270 1.00 0.00 H ATOM 893 N GLN A 94 2.864 -32.952 31.486 1.00 48.34 N ATOM 894 CA GLN A 94 3.282 -33.531 32.753 1.00 49.35 C ATOM 895 C GLN A 94 4.131 -34.769 32.461 1.00 48.64 C ATOM 896 O GLN A 94 3.607 -35.889 32.407 1.00 50.12 O ATOM 897 CB GLN A 94 2.063 -33.900 33.608 1.00 49.38 C ATOM 898 CG GLN A 94 1.129 -32.735 33.906 1.00 51.02 C ATOM 899 CD GLN A 94 1.763 -31.656 34.771 1.00 54.70 C ATOM 900 OE1 GLN A 94 2.631 -31.932 35.601 1.00 56.38 O ATOM 901 NE2 GLN A 94 1.320 -30.416 34.584 1.00 54.69 N ATOM 902 HE22 GLN A 94 0.586 -30.228 33.872 1.00 0.00 H ATOM 903 HE21 GLN A 94 1.708 -29.634 35.150 1.00 0.00 H ATOM 904 H GLN A 94 2.424 -33.567 30.772 1.00 0.00 H ATOM 905 N PRO A 95 5.444 -34.567 32.251 1.00 45.27 N ATOM 906 CA PRO A 95 6.366 -35.679 32.004 1.00 41.76 C ATOM 907 C PRO A 95 6.322 -36.724 33.129 1.00 42.81 C ATOM 908 O PRO A 95 6.243 -36.337 34.296 1.00 43.06 O ATOM 909 CB PRO A 95 7.735 -34.998 31.982 1.00 42.78 C ATOM 910 CG PRO A 95 7.458 -33.571 31.655 1.00 45.14 C ATOM 911 CD PRO A 95 6.144 -33.268 32.289 1.00 46.17 C ATOM 912 N PRO A 96 6.369 -38.027 32.787 1.00 45.12 N ATOM 913 CA PRO A 96 6.372 -39.076 33.818 1.00 49.08 C ATOM 914 C PRO A 96 7.585 -38.954 34.729 1.00 51.89 C ATOM 915 O PRO A 96 8.633 -38.512 34.262 1.00 54.78 O ATOM 916 CB PRO A 96 6.464 -40.372 33.005 1.00 49.11 C ATOM 917 CG PRO A 96 6.020 -40.010 31.635 1.00 46.72 C ATOM 918 CD PRO A 96 6.441 -38.597 31.430 1.00 44.34 C ATOM 919 N ARG A 97 7.457 -39.333 35.997 1.00 61.12 N ATOM 920 CA ARG A 97 8.559 -39.155 36.933 1.00 63.61 C ATOM 921 C ARG A 97 9.748 -39.971 36.460 1.00 58.53 C ATOM 922 O ARG A 97 10.886 -39.515 36.539 1.00 60.18 O ATOM 923 CB ARG A 97 8.166 -39.559 38.362 1.00 71.78 C ATOM 924 CG ARG A 97 9.274 -39.313 39.401 1.00 79.96 C ATOM 925 CD ARG A 97 8.896 -38.249 40.441 1.00 89.02 C ATOM 926 NE ARG A 97 8.450 -36.996 39.829 1.00 92.56 N ATOM 927 CZ ARG A 97 9.264 -36.060 39.350 1.00 93.07 C ATOM 928 NH1 ARG A 97 8.760 -34.959 38.812 1.00 93.58 N ATOM 929 NH2 ARG A 97 10.580 -36.221 39.402 1.00 93.29 N ATOM 930 HE ARG A 97 7.426 -36.826 39.764 1.00 0.00 H ATOM 931 HH12 ARG A 97 9.395 -34.226 38.437 1.00 0.00 H ATOM 932 HH11 ARG A 97 7.729 -34.828 38.765 1.00 0.00 H ATOM 933 HH22 ARG A 97 11.209 -35.484 39.025 1.00 0.00 H ATOM 934 HH21 ARG A 97 10.982 -37.084 39.820 1.00 0.00 H ATOM 935 H ARG A 97 6.566 -39.759 36.322 1.00 0.00 H ATOM 936 N GLY A 98 9.471 -41.164 35.941 1.00 54.17 N ATOM 937 CA GLY A 98 10.514 -42.078 35.514 1.00 53.27 C ATOM 938 C GLY A 98 11.436 -41.455 34.490 1.00 54.41 C ATOM 939 O GLY A 98 12.637 -41.718 34.483 1.00 58.19 O ATOM 940 H GLY A 98 8.477 -41.450 35.838 1.00 0.00 H ATOM 941 N LEU A 99 10.873 -40.608 33.637 1.00 52.32 N ATOM 942 CA LEU A 99 11.652 -39.917 32.624 1.00 50.92 C ATOM 943 C LEU A 99 12.528 -38.861 33.285 1.00 53.92 C ATOM 944 O LEU A 99 13.702 -38.705 32.938 1.00 55.69 O ATOM 945 CB LEU A 99 10.722 -39.265 31.605 1.00 50.19 C ATOM 946 CG LEU A 99 11.350 -38.321 30.580 1.00 49.12 C ATOM 947 CD1 LEU A 99 12.199 -39.077 29.576 1.00 48.84 C ATOM 948 CD2 LEU A 99 10.263 -37.548 29.889 1.00 47.32 C ATOM 949 H LEU A 99 9.849 -40.435 33.695 1.00 0.00 H ATOM 950 N ILE A 100 11.950 -38.135 34.237 1.00 53.60 N ATOM 951 CA ILE A 100 12.675 -37.088 34.946 1.00 53.78 C ATOM 952 C ILE A 100 13.801 -37.710 35.755 1.00 55.15 C ATOM 953 O ILE A 100 14.929 -37.212 35.748 1.00 57.17 O ATOM 954 CB ILE A 100 11.750 -36.286 35.892 1.00 54.62 C ATOM 955 CG1 ILE A 100 10.573 -35.694 35.117 1.00 50.49 C ATOM 956 CG2 ILE A 100 12.523 -35.172 36.590 1.00 58.19 C ATOM 957 CD1 ILE A 100 10.976 -34.756 33.987 1.00 47.04 C ATOM 958 H ILE A 100 10.956 -38.319 34.482 1.00 0.00 H ATOM 959 N GLN A 101 13.490 -38.803 36.445 1.00 52.93 N ATOM 960 CA GLN A 101 14.488 -39.529 37.217 1.00 54.47 C ATOM 961 C GLN A 101 15.648 -39.916 36.323 1.00 51.94 C ATOM 962 O GLN A 101 16.805 -39.655 36.648 1.00 55.40 O ATOM 963 CB GLN A 101 13.885 -40.791 37.828 1.00 56.71 C ATOM 964 CG GLN A 101 12.951 -40.540 38.993 1.00 61.58 C ATOM 965 CD GLN A 101 12.297 -41.813 39.492 1.00 66.28 C ATOM 966 OE1 GLN A 101 12.513 -42.895 38.938 1.00 69.01 O ATOM 967 NE2 GLN A 101 11.493 -41.694 40.547 1.00 68.16 N ATOM 968 HE22 GLN A 101 11.340 -40.762 40.982 1.00 0.00 H ATOM 969 HE21 GLN A 101 11.018 -42.533 40.936 1.00 0.00 H ATOM 970 H GLN A 101 12.509 -39.148 36.433 1.00 0.00 H ATOM 971 N LEU A 102 15.321 -40.523 35.188 1.00 47.89 N ATOM 972 CA LEU A 102 16.329 -41.022 34.262 1.00 47.96 C ATOM 973 C LEU A 102 17.264 -39.911 33.789 1.00 51.67 C ATOM 974 O LEU A 102 18.479 -40.106 33.710 1.00 51.55 O ATOM 975 CB LEU A 102 15.650 -41.683 33.063 1.00 44.94 C ATOM 976 CG LEU A 102 16.550 -42.327 32.011 1.00 45.18 C ATOM 977 CD1 LEU A 102 17.371 -43.449 32.616 1.00 47.09 C ATOM 978 CD2 LEU A 102 15.710 -42.853 30.866 1.00 45.89 C ATOM 979 H LEU A 102 14.315 -40.646 34.953 1.00 0.00 H ATOM 980 N ALA A 103 16.693 -38.743 33.498 1.00 52.59 N ATOM 981 CA ALA A 103 17.448 -37.624 32.941 1.00 53.02 C ATOM 982 C ALA A 103 18.364 -36.980 33.973 1.00 56.43 C ATOM 983 O ALA A 103 19.541 -36.734 33.702 1.00 57.99 O ATOM 984 CB ALA A 103 16.501 -36.586 32.380 1.00 52.37 C ATOM 985 H ALA A 103 15.675 -38.624 33.674 1.00 0.00 H ATOM 986 N ASN A 104 17.814 -36.689 35.147 1.00 56.12 N ATOM 987 CA ASN A 104 18.586 -36.066 36.211 1.00 55.83 C ATOM 988 C ASN A 104 19.735 -36.968 36.634 1.00 56.31 C ATOM 989 O ASN A 104 20.846 -36.496 36.886 1.00 54.68 O ATOM 990 CB ASN A 104 17.689 -35.736 37.407 1.00 56.72 C ATOM 991 CG ASN A 104 16.699 -34.624 37.107 1.00 59.40 C ATOM 992 OD1 ASN A 104 16.897 -33.828 36.190 1.00 61.19 O ATOM 993 ND2 ASN A 104 15.634 -34.552 37.892 1.00 61.73 N ATOM 994 HD22 ASN A 104 15.504 -35.245 38.657 1.00 0.00 H ATOM 995 HD21 ASN A 104 14.928 -33.803 37.744 1.00 0.00 H ATOM 996 H ASN A 104 16.811 -36.911 35.309 1.00 0.00 H ATOM 997 N MET A 105 19.472 -38.272 36.686 1.00 58.65 N ATOM 998 CA MET A 105 20.497 -39.243 37.067 1.00 62.31 C ATOM 999 C MET A 105 21.636 -39.241 36.048 1.00 60.52 C ATOM 1000 O MET A 105 22.805 -39.148 36.415 1.00 62.23 O ATOM 1001 CB MET A 105 19.903 -40.650 37.180 1.00 60.89 C ATOM 1002 CG MET A 105 20.622 -41.538 38.182 1.00 64.83 C ATOM 1003 SD MET A 105 20.119 -43.266 38.069 1.00121.36 S ATOM 1004 CE MET A 105 18.358 -43.152 38.363 1.00 57.81 C ATOM 1005 H MET A 105 18.516 -38.608 36.450 1.00 0.00 H ATOM 1006 N LEU A 106 21.287 -39.342 34.769 1.00 56.54 N ATOM 1007 CA LEU A 106 22.271 -39.260 33.694 1.00 55.24 C ATOM 1008 C LEU A 106 22.969 -37.899 33.688 1.00 54.69 C ATOM 1009 O LEU A 106 24.151 -37.803 33.382 1.00 55.08 O ATOM 1010 CB LEU A 106 21.598 -39.517 32.341 1.00 50.82 C ATOM 1011 CG LEU A 106 21.339 -40.983 31.972 1.00 49.81 C ATOM 1012 CD1 LEU A 106 20.343 -41.086 30.832 1.00 47.34 C ATOM 1013 CD2 LEU A 106 22.627 -41.677 31.591 1.00 52.15 C ATOM 1014 H LEU A 106 20.285 -39.483 34.528 1.00 0.00 H ATOM 1015 N ARG A 107 22.233 -36.851 34.038 1.00 54.96 N ATOM 1016 CA ARG A 107 22.795 -35.509 34.069 1.00 57.86 C ATOM 1017 C ARG A 107 23.780 -35.350 35.228 1.00 62.06 C ATOM 1018 O ARG A 107 24.818 -34.698 35.090 1.00 59.87 O ATOM 1019 CB ARG A 107 21.676 -34.478 34.183 1.00 58.45 C ATOM 1020 CG ARG A 107 20.962 -34.191 32.873 1.00 56.95 C ATOM 1021 CD ARG A 107 19.631 -33.511 33.119 1.00 58.64 C ATOM 1022 NE ARG A 107 19.486 -32.299 32.318 1.00 60.84 N ATOM 1023 CZ ARG A 107 19.559 -31.055 32.789 1.00 63.82 C ATOM 1024 NH1 ARG A 107 19.765 -30.809 34.080 1.00 66.00 N ATOM 1025 NH2 ARG A 107 19.414 -30.040 31.953 1.00 65.08 N ATOM 1026 HE ARG A 107 19.312 -32.416 31.299 1.00 0.00 H ATOM 1027 HH12 ARG A 107 19.818 -29.828 34.420 1.00 0.00 H ATOM 1028 HH11 ARG A 107 19.873 -31.598 34.749 1.00 0.00 H ATOM 1029 HH22 ARG A 107 19.469 -29.063 32.306 1.00 0.00 H ATOM 1030 HH21 ARG A 107 19.245 -30.219 30.942 1.00 0.00 H ATOM 1031 H ARG A 107 21.235 -36.992 34.295 1.00 0.00 H ATOM 1032 N SER A 108 23.452 -35.956 36.365 1.00 65.36 N ATOM 1033 CA SER A 108 24.316 -35.904 37.534 1.00 72.13 C ATOM 1034 C SER A 108 25.579 -36.734 37.305 1.00 72.88 C ATOM 1035 O SER A 108 26.655 -36.377 37.784 1.00 79.42 O ATOM 1036 CB SER A 108 23.575 -36.400 38.775 1.00 77.64 C ATOM 1037 OG SER A 108 23.442 -37.808 38.755 1.00 81.82 O ATOM 1038 HG SER A 108 22.933 -38.079 37.950 1.00 0.00 H ATOM 1039 H SER A 108 22.555 -36.480 36.420 1.00 0.00 H ATOM 1040 N GLN A 109 25.452 -37.836 36.571 1.00 68.23 N ATOM 1041 CA GLN A 109 26.613 -38.658 36.230 1.00 68.77 C ATOM 1042 C GLN A 109 27.527 -37.936 35.241 1.00 67.77 C ATOM 1043 O GLN A 109 28.749 -38.096 35.279 1.00 71.16 O ATOM 1044 CB GLN A 109 26.181 -39.990 35.629 1.00 66.65 C ATOM 1045 CG GLN A 109 25.451 -40.909 36.583 1.00 67.67 C ATOM 1046 CD GLN A 109 24.841 -42.098 35.865 1.00 65.36 C ATOM 1047 OE1 GLN A 109 24.895 -42.184 34.639 1.00 65.30 O ATOM 1048 NE2 GLN A 109 24.256 -43.019 36.623 1.00 62.28 N ATOM 1049 HE22 GLN A 109 24.234 -42.905 37.656 1.00 0.00 H ATOM 1050 HE21 GLN A 109 23.820 -43.854 36.183 1.00 0.00 H ATOM 1051 H GLN A 109 24.510 -38.118 36.233 1.00 0.00 H ATOM 1052 N ALA A 110 26.925 -37.151 34.351 1.00 62.95 N ATOM 1053 CA ALA A 110 27.683 -36.325 33.422 1.00 62.24 C ATOM 1054 C ALA A 110 28.442 -35.253 34.193 1.00 65.64 C ATOM 1055 O ALA A 110 29.619 -35.006 33.931 1.00 69.48 O ATOM 1056 CB ALA A 110 26.754 -35.689 32.404 1.00 58.06 C ATOM 1057 H ALA A 110 25.886 -37.127 34.318 1.00 0.00 H ATOM 1058 N ALA A 111 27.763 -34.626 35.151 1.00 65.54 N ATOM 1059 CA ALA A 111 28.368 -33.572 35.960 1.00 70.29 C ATOM 1060 C ALA A 111 29.579 -34.096 36.720 1.00 75.36 C ATOM 1061 O ALA A 111 30.670 -33.529 36.621 1.00 78.80 O ATOM 1062 CB ALA A 111 27.350 -32.992 36.932 1.00 69.35 C ATOM 1063 H ALA A 111 26.774 -34.894 35.328 1.00 0.00 H ATOM 1064 N ARG A 112 29.382 -35.181 37.469 1.00 75.83 N ATOM 1065 CA ARG A 112 30.451 -35.775 38.269 1.00 82.67 C ATOM 1066 C ARG A 112 31.562 -36.351 37.389 1.00 85.98 C ATOM 1067 O ARG A 112 32.651 -36.652 37.876 1.00 88.68 O ATOM 1068 CB ARG A 112 29.907 -36.886 39.171 1.00 85.07 C ATOM 1069 CG ARG A 112 28.764 -36.489 40.100 1.00 87.00 C ATOM 1070 CD ARG A 112 28.160 -37.736 40.737 1.00 90.93 C ATOM 1071 NE ARG A 112 26.837 -37.512 41.326 1.00 92.36 N ATOM 1072 CZ ARG A 112 25.742 -38.224 41.044 1.00 91.61 C ATOM 1073 NH1 ARG A 112 24.597 -37.928 41.644 1.00 92.65 N ATOM 1074 NH2 ARG A 112 25.774 -39.222 40.164 1.00 87.80 N ATOM 1075 HE ARG A 112 26.743 -36.740 42.016 1.00 0.00 H ATOM 1076 HH12 ARG A 112 23.740 -38.478 41.430 1.00 0.00 H ATOM 1077 HH11 ARG A 112 24.556 -37.146 42.329 1.00 0.00 H ATOM 1078 HH22 ARG A 112 24.910 -39.763 39.960 1.00 0.00 H ATOM 1079 HH21 ARG A 112 26.663 -39.461 39.681 1.00 0.00 H ATOM 1080 H ARG A 112 28.438 -35.618 37.484 1.00 0.00 H ATOM 1081 N SER A 113 31.277 -36.515 36.099 1.00 84.47 N ATOM 1082 CA SER A 113 32.260 -37.021 35.143 1.00 89.68 C ATOM 1083 C SER A 113 33.067 -35.894 34.499 1.00 92.69 C ATOM 1084 O SER A 113 34.015 -36.146 33.756 1.00 97.83 O ATOM 1085 CB SER A 113 31.569 -37.838 34.051 1.00 87.43 C ATOM 1086 OG SER A 113 31.014 -39.032 34.577 1.00 88.35 O ATOM 1087 HG SER A 113 30.347 -38.806 35.273 1.00 0.00 H ATOM 1088 H SER A 113 30.323 -36.275 35.760 1.00 0.00 H ATOM 1089 N GLY A 114 32.685 -34.652 34.777 1.00 85.54 N ATOM 1090 CA GLY A 114 33.417 -33.507 34.273 1.00 88.16 C ATOM 1091 C GLY A 114 32.940 -33.049 32.910 1.00 85.82 C ATOM 1092 O GLY A 114 33.742 -32.603 32.085 1.00 87.65 O ATOM 1093 H GLY A 114 31.843 -34.498 35.368 1.00 0.00 H ATOM 1094 N CYS A 115 31.635 -33.166 32.676 1.00 82.38 N ATOM 1095 CA CYS A 115 31.016 -32.663 31.455 1.00 82.01 C ATOM 1096 C CYS A 115 30.412 -31.308 31.758 1.00 89.40 C ATOM 1097 O CYS A 115 30.279 -30.942 32.928 1.00 93.43 O ATOM 1098 CB CYS A 115 29.936 -33.620 30.952 1.00 75.21 C ATOM 1099 SG CYS A 115 30.569 -35.227 30.413 1.00 83.07 S ATOM 1100 H CYS A 115 31.037 -33.632 33.388 1.00 0.00 H ATOM 1101 N PHE A 116 30.056 -30.561 30.715 1.00 92.53 N ATOM 1102 CA PHE A 116 29.510 -29.220 30.908 1.00101.31 C ATOM 1103 C PHE A 116 27.992 -29.222 30.843 1.00105.08 C ATOM 1104 O PHE A 116 27.386 -29.606 29.841 1.00 99.26 O ATOM 1105 CB PHE A 116 30.135 -28.209 29.936 1.00101.48 C ATOM 1106 CG PHE A 116 31.507 -27.730 30.360 1.00106.74 C ATOM 1107 CD1 PHE A 116 31.819 -27.552 31.704 1.00110.03 C ATOM 1108 CD2 PHE A 116 32.485 -27.465 29.419 1.00108.39 C ATOM 1109 CE1 PHE A 116 33.070 -27.120 32.096 1.00115.81 C ATOM 1110 CE2 PHE A 116 33.743 -27.033 29.809 1.00114.14 C ATOM 1111 CZ PHE A 116 34.034 -26.860 31.148 1.00118.11 C ATOM 1112 H PHE A 116 30.168 -30.937 29.752 1.00 0.00 H ATOM 1113 N GLN A 117 27.402 -28.769 31.945 1.00116.13 N ATOM 1114 CA GLN A 117 25.984 -28.942 32.210 1.00120.84 C ATOM 1115 C GLN A 117 25.110 -27.909 31.522 1.00122.96 C ATOM 1116 O GLN A 117 25.577 -26.847 31.108 1.00127.89 O ATOM 1117 CB GLN A 117 25.728 -28.912 33.719 1.00127.90 C ATOM 1118 CG GLN A 117 25.693 -30.288 34.364 1.00128.01 C ATOM 1119 CD GLN A 117 24.576 -31.162 33.810 1.00124.10 C ATOM 1120 OE1 GLN A 117 24.803 -31.999 32.935 1.00120.90 O ATOM 1121 NE2 GLN A 117 23.363 -30.965 34.314 1.00124.11 N ATOM 1122 HE22 GLN A 117 23.217 -30.247 35.052 1.00 0.00 H ATOM 1123 HE21 GLN A 117 22.559 -31.529 33.971 1.00 0.00 H ATOM 1124 H GLN A 117 27.981 -28.268 32.649 1.00 0.00 H ATOM 1125 N SER A 118 23.830 -28.249 31.421 1.00119.83 N ATOM 1126 CA SER A 118 22.848 -27.451 30.703 1.00118.66 C ATOM 1127 C SER A 118 22.833 -26.000 31.153 1.00123.72 C ATOM 1128 O SER A 118 22.620 -25.103 30.338 1.00125.20 O ATOM 1129 CB SER A 118 21.455 -28.052 30.895 1.00114.73 C ATOM 1130 OG SER A 118 21.077 -28.835 29.775 1.00109.78 O ATOM 1131 HG SER A 118 20.174 -29.211 29.926 1.00 0.00 H ATOM 1132 H SER A 118 23.514 -29.129 31.877 1.00 0.00 H ATOM 1133 N ASN A 119 23.040 -25.784 32.451 1.00125.89 N ATOM 1134 CA ASN A 119 22.919 -24.459 33.053 1.00130.70 C ATOM 1135 C ASN A 119 21.464 -23.971 33.024 1.00124.68 C ATOM 1136 O ASN A 119 21.164 -22.853 33.446 1.00131.58 O ATOM 1137 CB ASN A 119 23.838 -23.456 32.346 1.00137.67 C ATOM 1138 CG ASN A 119 24.009 -22.168 33.123 1.00148.02 C ATOM 1139 OD1 ASN A 119 23.953 -22.156 34.351 1.00152.27 O ATOM 1140 ND2 ASN A 119 24.222 -21.072 32.406 1.00152.34 N ATOM 1141 HD22 ASN A 119 24.262 -21.129 31.368 1.00 0.00 H ATOM 1142 HD21 ASN A 119 24.349 -20.156 32.882 1.00 0.00 H ATOM 1143 H ASN A 119 23.297 -26.588 33.058 1.00 0.00 H ATOM 1144 N ARG A 120 20.568 -24.828 32.535 1.00111.24 N ATOM 1145 CA ARG A 120 19.146 -24.527 32.432 1.00103.43 C ATOM 1146 C ARG A 120 18.392 -25.764 32.905 1.00 92.45 C ATOM 1147 O ARG A 120 18.942 -26.867 32.875 1.00 84.08 O ATOM 1148 CB ARG A 120 18.776 -24.211 30.979 1.00102.97 C ATOM 1149 CG ARG A 120 17.578 -23.268 30.806 1.00107.71 C ATOM 1150 CD ARG A 120 17.736 -22.332 29.609 1.00112.63 C ATOM 1151 NE ARG A 120 19.043 -21.666 29.597 1.00120.38 N ATOM 1152 CZ ARG A 120 19.990 -21.852 28.677 1.00121.57 C ATOM 1153 NH1 ARG A 120 19.800 -22.674 27.648 1.00116.69 N ATOM 1154 NH2 ARG A 120 21.140 -21.198 28.780 1.00127.21 N ATOM 1155 HE ARG A 120 19.247 -20.996 30.366 1.00 0.00 H ATOM 1156 HH12 ARG A 120 20.552 -22.805 26.941 1.00 0.00 H ATOM 1157 HH11 ARG A 120 18.900 -23.186 27.550 1.00 0.00 H ATOM 1158 HH22 ARG A 120 21.883 -21.338 28.066 1.00 0.00 H ATOM 1159 HH21 ARG A 120 21.298 -20.546 29.574 1.00 0.00 H ATOM 1160 H ARG A 120 20.901 -25.758 32.211 1.00 0.00 H ATOM 1161 N PRO A 121 17.139 -25.594 33.352 1.00 94.18 N ATOM 1162 CA PRO A 121 16.389 -26.783 33.766 1.00 89.61 C ATOM 1163 C PRO A 121 16.186 -27.757 32.612 1.00 77.96 C ATOM 1164 O PRO A 121 16.240 -27.367 31.445 1.00 76.09 O ATOM 1165 CB PRO A 121 15.039 -26.211 34.217 1.00 94.34 C ATOM 1166 CG PRO A 121 15.307 -24.788 34.533 1.00102.15 C ATOM 1167 CD PRO A 121 16.373 -24.356 33.580 1.00101.38 C ATOM 1168 N PHE A 122 15.959 -29.018 32.946 1.00 71.96 N ATOM 1169 CA PHE A 122 15.669 -30.023 31.940 1.00 64.22 C ATOM 1170 C PHE A 122 14.229 -29.867 31.479 1.00 62.33 C ATOM 1171 O PHE A 122 13.307 -30.065 32.271 1.00 64.60 O ATOM 1172 CB PHE A 122 15.895 -31.423 32.522 1.00 59.40 C ATOM 1173 CG PHE A 122 15.473 -32.533 31.610 1.00 54.70 C ATOM 1174 CD1 PHE A 122 16.023 -32.654 30.348 1.00 52.83 C ATOM 1175 CD2 PHE A 122 14.536 -33.465 32.020 1.00 52.38 C ATOM 1176 CE1 PHE A 122 15.639 -33.674 29.509 1.00 49.72 C ATOM 1177 CE2 PHE A 122 14.150 -34.489 31.187 1.00 48.59 C ATOM 1178 CZ PHE A 122 14.701 -34.594 29.930 1.00 48.70 C ATOM 1179 H PHE A 122 15.989 -29.294 33.948 1.00 0.00 H ATOM 1180 N HIS A 123 14.036 -29.500 30.213 1.00 59.42 N ATOM 1181 CA HIS A 123 12.696 -29.457 29.624 1.00 58.42 C ATOM 1182 C HIS A 123 12.578 -30.500 28.519 1.00 52.61 C ATOM 1183 O HIS A 123 12.978 -30.245 27.382 1.00 50.95 O ATOM 1184 CB HIS A 123 12.363 -28.068 29.064 1.00 61.38 C ATOM 1185 CG HIS A 123 10.954 -27.950 28.561 1.00 63.41 C ATOM 1186 ND1 HIS A 123 10.546 -28.470 27.351 1.00 61.94 N ATOM 1187 CD2 HIS A 123 9.856 -27.381 29.114 1.00 67.71 C ATOM 1188 CE1 HIS A 123 9.261 -28.218 27.175 1.00 62.64 C ATOM 1189 NE2 HIS A 123 8.819 -27.561 28.230 1.00 66.46 N ATOM 1190 H HIS A 123 14.856 -29.238 29.629 1.00 0.00 H ATOM 1191 N PRO A 124 12.025 -31.681 28.845 1.00 49.51 N ATOM 1192 CA PRO A 124 11.946 -32.734 27.825 1.00 45.27 C ATOM 1193 C PRO A 124 11.162 -32.296 26.593 1.00 46.12 C ATOM 1194 O PRO A 124 10.098 -31.706 26.725 1.00 50.69 O ATOM 1195 CB PRO A 124 11.228 -33.876 28.545 1.00 43.51 C ATOM 1196 CG PRO A 124 10.566 -33.254 29.718 1.00 47.32 C ATOM 1197 CD PRO A 124 11.426 -32.109 30.121 1.00 48.06 C ATOM 1198 N HIS A 125 11.702 -32.563 25.411 1.00 44.55 N ATOM 1199 CA HIS A 125 11.092 -32.106 24.173 1.00 45.22 C ATOM 1200 C HIS A 125 11.698 -32.854 22.985 1.00 46.50 C ATOM 1201 O HIS A 125 12.803 -33.400 23.080 1.00 45.79 O ATOM 1202 CB HIS A 125 11.334 -30.607 23.997 1.00 46.81 C ATOM 1203 CG HIS A 125 12.764 -30.265 23.740 1.00 47.82 C ATOM 1204 ND1 HIS A 125 13.699 -30.178 24.750 1.00 51.26 N ATOM 1205 CD2 HIS A 125 13.433 -30.024 22.588 1.00 47.92 C ATOM 1206 CE1 HIS A 125 14.878 -29.884 24.232 1.00 51.13 C ATOM 1207 NE2 HIS A 125 14.744 -29.785 22.921 1.00 49.57 N ATOM 1208 H HIS A 125 12.584 -33.113 25.369 1.00 0.00 H ATOM 1209 N ILE A 126 10.958 -32.887 21.879 1.00 48.10 N ATOM 1210 CA ILE A 126 11.463 -33.405 20.614 1.00 48.78 C ATOM 1211 C ILE A 126 11.407 -32.273 19.608 1.00 48.32 C ATOM 1212 O ILE A 126 10.341 -31.712 19.364 1.00 52.24 O ATOM 1213 CB ILE A 126 10.617 -34.576 20.076 1.00 47.86 C ATOM 1214 CG1 ILE A 126 10.722 -35.786 20.997 1.00 49.32 C ATOM 1215 CG2 ILE A 126 11.067 -34.973 18.672 1.00 46.92 C ATOM 1216 CD1 ILE A 126 9.686 -35.801 22.084 1.00 54.01 C ATOM 1217 H ILE A 126 9.982 -32.529 21.919 1.00 0.00 H ATOM 1218 N THR A 127 12.548 -31.952 19.012 1.00 43.18 N ATOM 1219 CA THR A 127 12.625 -30.831 18.092 1.00 44.97 C ATOM 1220 C THR A 127 12.181 -31.224 16.687 1.00 47.28 C ATOM 1221 O THR A 127 12.717 -32.161 16.098 1.00 49.26 O ATOM 1222 CB THR A 127 14.051 -30.246 18.058 1.00 42.01 C ATOM 1223 OG1 THR A 127 14.381 -29.749 19.359 1.00 42.99 O ATOM 1224 CG2 THR A 127 14.166 -29.110 17.045 1.00 44.39 C ATOM 1225 HG1 THR A 127 15.296 -29.372 19.344 1.00 0.00 H ATOM 1226 H THR A 127 13.402 -32.513 19.207 1.00 0.00 H ATOM 1227 N LEU A 128 11.213 -30.477 16.156 1.00 48.00 N ATOM 1228 CA LEU A 128 10.663 -30.722 14.826 1.00 51.51 C ATOM 1229 C LEU A 128 11.251 -29.788 13.772 1.00 51.99 C ATOM 1230 O LEU A 128 11.607 -30.224 12.673 1.00 53.29 O ATOM 1231 CB LEU A 128 9.150 -30.510 14.852 1.00 57.01 C ATOM 1232 CG LEU A 128 8.376 -31.293 15.902 1.00 55.70 C ATOM 1233 CD1 LEU A 128 6.984 -30.737 15.995 1.00 59.24 C ATOM 1234 CD2 LEU A 128 8.353 -32.763 15.548 1.00 54.03 C ATOM 1235 H LEU A 128 10.833 -29.685 16.713 1.00 0.00 H ATOM 1236 N LEU A 129 11.311 -28.498 14.108 1.00 51.53 N ATOM 1237 CA LEU A 129 11.837 -27.470 13.211 1.00 51.85 C ATOM 1238 C LEU A 129 12.997 -26.734 13.856 1.00 52.68 C ATOM 1239 O LEU A 129 12.952 -26.405 15.040 1.00 50.48 O ATOM 1240 CB LEU A 129 10.755 -26.448 12.851 1.00 51.57 C ATOM 1241 CG LEU A 129 9.611 -26.895 11.945 1.00 51.68 C ATOM 1242 CD1 LEU A 129 8.613 -25.768 11.763 1.00 54.52 C ATOM 1243 CD2 LEU A 129 10.132 -27.354 10.598 1.00 52.28 C ATOM 1244 H LEU A 129 10.969 -28.212 15.048 1.00 0.00 H ATOM 1245 N ARG A 130 14.031 -26.472 13.064 1.00 58.35 N ATOM 1246 CA ARG A 130 15.179 -25.697 13.521 1.00 63.15 C ATOM 1247 C ARG A 130 15.279 -24.405 12.717 1.00 71.74 C ATOM 1248 O ARG A 130 14.763 -24.315 11.601 1.00 72.88 O ATOM 1249 CB ARG A 130 16.466 -26.517 13.405 1.00 61.26 C ATOM 1250 CG ARG A 130 16.480 -27.770 14.286 1.00 56.19 C ATOM 1251 CD ARG A 130 17.891 -28.340 14.472 1.00 54.66 C ATOM 1252 NE ARG A 130 17.879 -29.535 15.313 1.00 52.48 N ATOM 1253 CZ ARG A 130 17.970 -29.524 16.640 1.00 55.41 C ATOM 1254 NH1 ARG A 130 18.091 -28.379 17.298 1.00 60.14 N ATOM 1255 NH2 ARG A 130 17.941 -30.663 17.317 1.00 54.15 N ATOM 1256 HE ARG A 130 17.793 -30.458 14.841 1.00 0.00 H ATOM 1257 HH12 ARG A 130 18.161 -28.380 18.336 1.00 0.00 H ATOM 1258 HH11 ARG A 130 18.115 -27.480 16.776 1.00 0.00 H ATOM 1259 HH22 ARG A 130 18.012 -30.653 18.355 1.00 0.00 H ATOM 1260 HH21 ARG A 130 17.847 -31.567 16.811 1.00 0.00 H ATOM 1261 H ARG A 130 14.022 -26.831 12.088 1.00 0.00 H ATOM 1262 N ASP A 131 15.937 -23.406 13.300 1.00 76.95 N ATOM 1263 CA ASP A 131 16.021 -22.078 12.703 1.00 83.02 C ATOM 1264 C ASP A 131 14.629 -21.573 12.305 1.00 80.35 C ATOM 1265 O ASP A 131 14.410 -21.102 11.188 1.00 79.64 O ATOM 1266 CB ASP A 131 16.998 -22.073 11.523 1.00 89.08 C ATOM 1267 CG ASP A 131 18.453 -22.025 11.976 1.00 96.16 C ATOM 1268 OD1 ASP A 131 18.980 -20.904 12.156 1.00103.53 O ATOM 1269 OD2 ASP A 131 19.068 -23.101 12.158 1.00 93.04 O ATOM 1270 H ASP A 131 16.407 -23.578 14.212 1.00 0.00 H ATOM 1271 N ALA A 132 13.692 -21.703 13.241 1.00 78.44 N ATOM 1272 CA ALA A 132 12.368 -21.106 13.120 1.00 79.75 C ATOM 1273 C ALA A 132 12.379 -19.796 13.893 1.00 88.52 C ATOM 1274 O ALA A 132 11.941 -19.734 15.042 1.00 86.91 O ATOM 1275 CB ALA A 132 11.304 -22.045 13.673 1.00 73.24 C ATOM 1276 H ALA A 132 13.914 -22.254 14.095 1.00 0.00 H ATOM 1277 N SER A 133 12.899 -18.753 13.256 1.00 97.70 N ATOM 1278 CA SER A 133 13.095 -17.467 13.911 1.00106.68 C ATOM 1279 C SER A 133 11.765 -16.805 14.252 1.00109.85 C ATOM 1280 O SER A 133 11.510 -16.473 15.408 1.00116.17 O ATOM 1281 CB SER A 133 13.931 -16.544 13.020 1.00111.21 C ATOM 1282 OG SER A 133 13.406 -16.497 11.706 1.00111.66 O ATOM 1283 HG SER A 133 13.963 -15.895 11.151 1.00 0.00 H ATOM 1284 H SER A 133 13.175 -18.858 12.259 1.00 0.00 H ATOM 1285 N GLU A 134 10.916 -16.629 13.245 1.00104.47 N ATOM 1286 CA GLU A 134 9.668 -15.893 13.412 1.00 99.36 C ATOM 1287 C GLU A 134 8.602 -16.728 14.122 1.00 90.41 C ATOM 1288 O GLU A 134 8.518 -17.944 13.934 1.00 81.07 O ATOM 1289 CB GLU A 134 9.163 -15.420 12.050 1.00101.81 C ATOM 1290 CG GLU A 134 10.090 -14.415 11.376 1.00108.17 C ATOM 1291 CD GLU A 134 9.976 -14.433 9.864 1.00110.74 C ATOM 1292 OE1 GLU A 134 10.122 -15.526 9.272 1.00108.43 O ATOM 1293 OE2 GLU A 134 9.742 -13.359 9.268 1.00114.80 O ATOM 1294 H GLU A 134 11.148 -17.027 12.312 1.00 0.00 H ATOM 1295 N ALA A 135 7.800 -16.063 14.949 1.00 72.45 N ATOM 1296 CA ALA A 135 6.752 -16.729 15.712 1.00 71.26 C ATOM 1297 C ALA A 135 5.647 -17.202 14.780 1.00 71.35 C ATOM 1298 O ALA A 135 5.276 -16.496 13.846 1.00 75.68 O ATOM 1299 CB ALA A 135 6.189 -15.789 16.772 1.00 71.44 C ATOM 1300 H ALA A 135 7.925 -15.036 15.054 1.00 0.00 H ATOM 1301 N VAL A 136 5.136 -18.405 15.028 1.00 68.57 N ATOM 1302 CA VAL A 136 4.068 -18.970 14.208 1.00 69.37 C ATOM 1303 C VAL A 136 3.095 -19.756 15.077 1.00 68.85 C ATOM 1304 O VAL A 136 3.460 -20.232 16.151 1.00 64.18 O ATOM 1305 CB VAL A 136 4.626 -19.895 13.101 1.00 68.43 C ATOM 1306 CG1 VAL A 136 5.605 -19.139 12.211 1.00 71.78 C ATOM 1307 CG2 VAL A 136 5.296 -21.118 13.703 1.00 64.59 C ATOM 1308 H VAL A 136 5.507 -18.958 15.827 1.00 0.00 H ATOM 1309 N THR A 137 1.860 -19.897 14.605 1.00 73.00 N ATOM 1310 CA THR A 137 0.808 -20.550 15.384 1.00 72.99 C ATOM 1311 C THR A 137 1.048 -22.053 15.531 1.00 66.93 C ATOM 1312 O THR A 137 1.262 -22.764 14.548 1.00 68.05 O ATOM 1313 CB THR A 137 -0.571 -20.310 14.759 1.00 76.52 C ATOM 1314 OG1 THR A 137 -0.488 -20.493 13.342 1.00 78.96 O ATOM 1315 CG2 THR A 137 -1.048 -18.894 15.053 1.00 79.99 C ATOM 1316 HG1 THR A 137 -0.192 -21.417 13.147 1.00 0.00 H ATOM 1317 H THR A 137 1.636 -19.533 13.657 1.00 0.00 H ATOM 1318 N ILE A 138 1.005 -22.517 16.777 1.00 60.12 N ATOM 1319 CA ILE A 138 1.335 -23.892 17.122 1.00 52.69 C ATOM 1320 C ILE A 138 0.064 -24.684 17.425 1.00 52.56 C ATOM 1321 O ILE A 138 -0.562 -24.466 18.461 1.00 54.38 O ATOM 1322 CB ILE A 138 2.221 -23.933 18.380 1.00 49.66 C ATOM 1323 CG1 ILE A 138 3.435 -23.003 18.233 1.00 49.18 C ATOM 1324 CG2 ILE A 138 2.671 -25.348 18.667 1.00 50.46 C ATOM 1325 CD1 ILE A 138 4.352 -23.328 17.066 1.00 47.90 C ATOM 1326 H ILE A 138 0.723 -21.868 17.539 1.00 0.00 H ATOM 1327 N PRO A 139 -0.326 -25.610 16.529 1.00 50.12 N ATOM 1328 CA PRO A 139 -1.513 -26.414 16.828 1.00 48.09 C ATOM 1329 C PRO A 139 -1.187 -27.472 17.864 1.00 47.83 C ATOM 1330 O PRO A 139 -0.013 -27.704 18.137 1.00 46.07 O ATOM 1331 CB PRO A 139 -1.835 -27.066 15.482 1.00 47.83 C ATOM 1332 CG PRO A 139 -0.515 -27.199 14.817 1.00 47.04 C ATOM 1333 CD PRO A 139 0.278 -25.989 15.239 1.00 49.57 C ATOM 1334 N PRO A 140 -2.211 -28.111 18.441 1.00 52.60 N ATOM 1335 CA PRO A 140 -1.928 -29.233 19.342 1.00 51.87 C ATOM 1336 C PRO A 140 -1.366 -30.401 18.551 1.00 48.16 C ATOM 1337 O PRO A 140 -1.614 -30.472 17.348 1.00 48.09 O ATOM 1338 CB PRO A 140 -3.306 -29.596 19.884 1.00 54.85 C ATOM 1339 CG PRO A 140 -4.247 -29.195 18.789 1.00 56.21 C ATOM 1340 CD PRO A 140 -3.654 -27.952 18.190 1.00 56.02 C ATOM 1341 N PRO A 141 -0.618 -31.305 19.204 1.00 46.70 N ATOM 1342 CA PRO A 141 -0.123 -32.495 18.500 1.00 45.72 C ATOM 1343 C PRO A 141 -1.250 -33.401 17.995 1.00 46.00 C ATOM 1344 O PRO A 141 -2.427 -33.108 18.215 1.00 46.66 O ATOM 1345 CB PRO A 141 0.716 -33.214 19.567 1.00 44.25 C ATOM 1346 CG PRO A 141 0.271 -32.653 20.870 1.00 44.78 C ATOM 1347 CD PRO A 141 -0.139 -31.250 20.596 1.00 45.92 C ATOM 1348 N GLY A 142 -0.889 -34.484 17.313 1.00 43.95 N ATOM 1349 CA GLY A 142 -1.869 -35.417 16.784 1.00 41.17 C ATOM 1350 C GLY A 142 -2.470 -36.250 17.894 1.00 38.28 C ATOM 1351 O GLY A 142 -2.054 -36.152 19.047 1.00 37.12 O ATOM 1352 H GLY A 142 0.122 -34.668 17.154 1.00 0.00 H ATOM 1353 N PHE A 143 -3.441 -37.086 17.552 1.00 39.90 N ATOM 1354 CA PHE A 143 -4.103 -37.914 18.551 1.00 40.48 C ATOM 1355 C PHE A 143 -3.279 -39.166 18.866 1.00 42.28 C ATOM 1356 O PHE A 143 -2.720 -39.798 17.971 1.00 41.59 O ATOM 1357 CB PHE A 143 -5.506 -38.291 18.070 1.00 39.41 C ATOM 1358 CG PHE A 143 -6.131 -39.410 18.842 1.00 41.49 C ATOM 1359 CD1 PHE A 143 -6.284 -39.326 20.214 1.00 42.22 C ATOM 1360 CD2 PHE A 143 -6.578 -40.547 18.192 1.00 42.31 C ATOM 1361 CE1 PHE A 143 -6.856 -40.360 20.924 1.00 41.93 C ATOM 1362 CE2 PHE A 143 -7.152 -41.581 18.897 1.00 43.33 C ATOM 1363 CZ PHE A 143 -7.295 -41.487 20.264 1.00 43.10 C ATOM 1364 H PHE A 143 -3.734 -37.151 16.556 1.00 0.00 H ATOM 1365 N ASN A 144 -3.185 -39.491 20.152 1.00 43.23 N ATOM 1366 CA ASN A 144 -2.687 -40.792 20.604 1.00 44.06 C ATOM 1367 C ASN A 144 -1.219 -41.095 20.266 1.00 42.59 C ATOM 1368 O ASN A 144 -0.856 -42.237 19.964 1.00 43.40 O ATOM 1369 CB ASN A 144 -3.591 -41.909 20.063 1.00 44.31 C ATOM 1370 CG ASN A 144 -3.819 -43.019 21.076 1.00 44.68 C ATOM 1371 OD1 ASN A 144 -3.952 -42.764 22.273 1.00 46.27 O ATOM 1372 ND2 ASN A 144 -3.869 -44.256 20.600 1.00 44.04 N ATOM 1373 HD22 ASN A 144 -3.751 -44.426 19.581 1.00 0.00 H ATOM 1374 HD21 ASN A 144 -4.026 -45.056 21.246 1.00 0.00 H ATOM 1375 H ASN A 144 -3.477 -38.793 20.866 1.00 0.00 H ATOM 1376 N TRP A 145 -0.375 -40.075 20.341 1.00 39.85 N ATOM 1377 CA TRP A 145 1.058 -40.265 20.175 1.00 38.77 C ATOM 1378 C TRP A 145 1.607 -40.762 21.512 1.00 40.30 C ATOM 1379 O TRP A 145 2.338 -40.054 22.205 1.00 38.82 O ATOM 1380 CB TRP A 145 1.732 -38.959 19.728 1.00 37.51 C ATOM 1381 CG TRP A 145 1.322 -38.518 18.340 1.00 37.69 C ATOM 1382 CD1 TRP A 145 0.507 -39.190 17.477 1.00 38.80 C ATOM 1383 CD2 TRP A 145 1.710 -37.313 17.664 1.00 38.48 C ATOM 1384 NE1 TRP A 145 0.363 -38.481 16.308 1.00 40.37 N ATOM 1385 CE2 TRP A 145 1.092 -37.326 16.398 1.00 38.66 C ATOM 1386 CE3 TRP A 145 2.521 -36.226 18.008 1.00 39.15 C ATOM 1387 CZ2 TRP A 145 1.261 -36.298 15.474 1.00 39.30 C ATOM 1388 CZ3 TRP A 145 2.687 -35.204 17.087 1.00 39.23 C ATOM 1389 CH2 TRP A 145 2.062 -35.250 15.836 1.00 40.73 C ATOM 1390 HE1 TRP A 145 -0.207 -38.774 15.489 1.00 0.00 H ATOM 1391 H TRP A 145 -0.745 -39.120 20.522 1.00 0.00 H ATOM 1392 N SER A 146 1.212 -41.982 21.871 1.00 42.53 N ATOM 1393 CA SER A 146 1.562 -42.582 23.154 1.00 44.96 C ATOM 1394 C SER A 146 2.272 -43.916 22.929 1.00 44.79 C ATOM 1395 O SER A 146 1.851 -44.704 22.086 1.00 44.20 O ATOM 1396 CB SER A 146 0.297 -42.795 23.988 1.00 45.74 C ATOM 1397 OG SER A 146 0.607 -43.019 25.349 1.00 46.65 O ATOM 1398 HG SER A 146 1.093 -42.235 25.709 1.00 0.00 H ATOM 1399 H SER A 146 0.629 -42.531 21.208 1.00 0.00 H ATOM 1400 N TYR A 147 3.348 -44.167 23.675 1.00 43.49 N ATOM 1401 CA TYR A 147 4.124 -45.394 23.485 1.00 42.16 C ATOM 1402 C TYR A 147 5.019 -45.736 24.674 1.00 44.12 C ATOM 1403 O TYR A 147 5.331 -44.884 25.513 1.00 44.03 O ATOM 1404 CB TYR A 147 4.982 -45.290 22.227 1.00 40.94 C ATOM 1405 CG TYR A 147 6.170 -44.362 22.369 1.00 43.98 C ATOM 1406 CD1 TYR A 147 7.416 -44.847 22.750 1.00 45.55 C ATOM 1407 CD2 TYR A 147 6.049 -43.001 22.115 1.00 43.26 C ATOM 1408 CE1 TYR A 147 8.504 -44.002 22.876 1.00 46.18 C ATOM 1409 CE2 TYR A 147 7.133 -42.150 22.242 1.00 44.67 C ATOM 1410 CZ TYR A 147 8.353 -42.656 22.621 1.00 45.91 C ATOM 1411 OH TYR A 147 9.421 -41.806 22.742 1.00 47.05 O ATOM 1412 HH TYR A 147 10.220 -42.320 23.020 1.00 0.00 H ATOM 1413 H TYR A 147 3.640 -43.482 24.401 1.00 0.00 H ATOM 1414 N ALA A 148 5.441 -46.997 24.717 1.00 44.89 N ATOM 1415 CA ALA A 148 6.186 -47.526 25.852 1.00 42.58 C ATOM 1416 C ALA A 148 7.676 -47.350 25.636 1.00 39.68 C ATOM 1417 O ALA A 148 8.178 -47.636 24.556 1.00 39.77 O ATOM 1418 CB ALA A 148 5.853 -48.985 26.058 1.00 41.38 C ATOM 1419 H ALA A 148 5.232 -47.625 23.915 1.00 0.00 H ATOM 1420 N VAL A 149 8.370 -46.864 26.662 1.00 39.11 N ATOM 1421 CA VAL A 149 9.811 -46.642 26.582 1.00 40.12 C ATOM 1422 C VAL A 149 10.548 -47.790 27.253 1.00 40.48 C ATOM 1423 O VAL A 149 10.444 -47.981 28.470 1.00 39.80 O ATOM 1424 CB VAL A 149 10.236 -45.316 27.254 1.00 39.55 C ATOM 1425 CG1 VAL A 149 11.745 -45.079 27.048 1.00 36.08 C ATOM 1426 CG2 VAL A 149 9.383 -44.144 26.725 1.00 36.67 C ATOM 1427 H VAL A 149 7.872 -46.636 27.546 1.00 0.00 H ATOM 1428 N THR A 150 11.297 -48.538 26.443 1.00 38.75 N ATOM 1429 CA THR A 150 11.905 -49.795 26.866 1.00 37.49 C ATOM 1430 C THR A 150 13.400 -49.689 27.064 1.00 39.67 C ATOM 1431 O THR A 150 14.016 -50.583 27.641 1.00 41.43 O ATOM 1432 CB THR A 150 11.684 -50.884 25.811 1.00 36.95 C ATOM 1433 OG1 THR A 150 12.303 -50.489 24.582 1.00 36.27 O ATOM 1434 CG2 THR A 150 10.207 -51.113 25.579 1.00 35.47 C ATOM 1435 HG1 THR A 150 12.160 -51.193 23.901 1.00 0.00 H ATOM 1436 H THR A 150 11.455 -48.212 25.468 1.00 0.00 H ATOM 1437 N GLU A 151 13.992 -48.610 26.566 1.00 42.96 N ATOM 1438 CA GLU A 151 15.430 -48.439 26.673 1.00 46.12 C ATOM 1439 C GLU A 151 15.858 -46.998 26.443 1.00 45.15 C ATOM 1440 O GLU A 151 15.045 -46.143 26.098 1.00 47.25 O ATOM 1441 CB GLU A 151 16.122 -49.352 25.661 1.00 47.72 C ATOM 1442 CG GLU A 151 15.624 -49.180 24.239 1.00 46.21 C ATOM 1443 CD GLU A 151 16.206 -50.212 23.291 1.00 45.61 C ATOM 1444 OE1 GLU A 151 16.460 -51.348 23.732 1.00 42.75 O ATOM 1445 OE2 GLU A 151 16.414 -49.887 22.104 1.00 48.38 O ATOM 1446 H GLU A 151 13.420 -47.880 26.095 1.00 0.00 H ATOM 1447 N PHE A 152 17.143 -46.737 26.659 1.00 43.56 N ATOM 1448 CA PHE A 152 17.749 -45.475 26.259 1.00 40.90 C ATOM 1449 C PHE A 152 19.096 -45.737 25.581 1.00 43.66 C ATOM 1450 O PHE A 152 19.694 -46.806 25.747 1.00 45.08 O ATOM 1451 CB PHE A 152 17.884 -44.517 27.445 1.00 37.98 C ATOM 1452 CG PHE A 152 18.814 -44.993 28.512 1.00 36.13 C ATOM 1453 CD1 PHE A 152 20.148 -44.628 28.489 1.00 37.10 C ATOM 1454 CD2 PHE A 152 18.358 -45.786 29.547 1.00 35.94 C ATOM 1455 CE1 PHE A 152 21.013 -45.057 29.471 1.00 35.88 C ATOM 1456 CE2 PHE A 152 19.224 -46.221 30.535 1.00 37.77 C ATOM 1457 CZ PHE A 152 20.552 -45.854 30.495 1.00 37.28 C ATOM 1458 H PHE A 152 17.733 -47.455 27.127 1.00 0.00 H ATOM 1459 N THR A 153 19.550 -44.760 24.804 1.00 43.05 N ATOM 1460 CA THR A 153 20.654 -44.954 23.876 1.00 42.51 C ATOM 1461 C THR A 153 21.671 -43.822 23.966 1.00 45.05 C ATOM 1462 O THR A 153 21.306 -42.648 24.068 1.00 44.15 O ATOM 1463 CB THR A 153 20.116 -45.048 22.431 1.00 42.16 C ATOM 1464 OG1 THR A 153 19.369 -46.258 22.281 1.00 45.93 O ATOM 1465 CG2 THR A 153 21.235 -45.062 21.418 1.00 44.43 C ATOM 1466 HG1 THR A 153 18.611 -46.257 22.918 1.00 0.00 H ATOM 1467 H THR A 153 19.101 -43.824 24.861 1.00 0.00 H ATOM 1468 N LEU A 154 22.948 -44.199 23.942 1.00 46.79 N ATOM 1469 CA LEU A 154 24.046 -43.252 23.808 1.00 45.57 C ATOM 1470 C LEU A 154 24.329 -43.079 22.327 1.00 44.05 C ATOM 1471 O LEU A 154 24.710 -44.029 21.645 1.00 41.63 O ATOM 1472 CB LEU A 154 25.301 -43.761 24.529 1.00 45.64 C ATOM 1473 CG LEU A 154 26.589 -42.931 24.377 1.00 45.08 C ATOM 1474 CD1 LEU A 154 26.511 -41.607 25.129 1.00 45.38 C ATOM 1475 CD2 LEU A 154 27.812 -43.713 24.837 1.00 45.02 C ATOM 1476 H LEU A 154 23.170 -45.212 24.022 1.00 0.00 H ATOM 1477 N TYR A 155 24.127 -41.860 21.840 1.00 44.73 N ATOM 1478 CA TYR A 155 24.355 -41.534 20.441 1.00 43.59 C ATOM 1479 C TYR A 155 25.617 -40.705 20.281 1.00 46.06 C ATOM 1480 O TYR A 155 26.086 -40.062 21.225 1.00 47.58 O ATOM 1481 CB TYR A 155 23.175 -40.733 19.885 1.00 42.88 C ATOM 1482 CG TYR A 155 21.966 -41.561 19.534 1.00 40.48 C ATOM 1483 CD1 TYR A 155 21.881 -42.204 18.311 1.00 40.83 C ATOM 1484 CD2 TYR A 155 20.905 -41.690 20.418 1.00 38.96 C ATOM 1485 CE1 TYR A 155 20.787 -42.959 17.982 1.00 40.51 C ATOM 1486 CE2 TYR A 155 19.799 -42.447 20.092 1.00 38.61 C ATOM 1487 CZ TYR A 155 19.752 -43.076 18.873 1.00 38.88 C ATOM 1488 OH TYR A 155 18.672 -43.830 18.522 1.00 40.20 O ATOM 1489 HH TYR A 155 17.860 -43.263 18.525 1.00 0.00 H ATOM 1490 H TYR A 155 23.794 -41.112 22.482 1.00 0.00 H ATOM 1491 N ALA A 156 26.154 -40.727 19.066 1.00 45.01 N ATOM 1492 CA ALA A 156 27.217 -39.825 18.667 1.00 43.18 C ATOM 1493 C ALA A 156 26.655 -38.927 17.577 1.00 46.78 C ATOM 1494 O ALA A 156 25.984 -39.404 16.654 1.00 44.86 O ATOM 1495 CB ALA A 156 28.406 -40.600 18.158 1.00 41.92 C ATOM 1496 H ALA A 156 25.798 -41.418 18.375 1.00 0.00 H ATOM 1497 N SER A 157 26.909 -37.627 17.703 1.00 50.13 N ATOM 1498 CA SER A 157 26.465 -36.648 16.722 1.00 51.30 C ATOM 1499 C SER A 157 27.586 -36.409 15.720 1.00 55.15 C ATOM 1500 O SER A 157 28.745 -36.244 16.098 1.00 54.59 O ATOM 1501 CB SER A 157 26.077 -35.342 17.417 1.00 53.65 C ATOM 1502 OG SER A 157 25.649 -34.364 16.482 1.00 57.28 O ATOM 1503 HG SER A 157 25.406 -33.533 16.963 1.00 0.00 H ATOM 1504 H SER A 157 27.444 -37.299 18.532 1.00 0.00 H ATOM 1505 N SER A 158 27.229 -36.401 14.441 1.00 59.11 N ATOM 1506 CA SER A 158 28.185 -36.223 13.359 1.00 64.32 C ATOM 1507 C SER A 158 27.529 -35.448 12.225 1.00 66.79 C ATOM 1508 O SER A 158 26.393 -35.736 11.850 1.00 69.84 O ATOM 1509 CB SER A 158 28.650 -37.591 12.851 1.00 67.13 C ATOM 1510 OG SER A 158 29.275 -37.492 11.583 1.00 72.03 O ATOM 1511 HG SER A 158 29.562 -38.392 11.287 1.00 0.00 H ATOM 1512 H SER A 158 26.224 -36.527 14.203 1.00 0.00 H ATOM 1513 N PHE A 159 28.235 -34.454 11.699 1.00 67.27 N ATOM 1514 CA PHE A 159 27.790 -33.734 10.517 1.00 69.92 C ATOM 1515 C PHE A 159 28.700 -34.075 9.348 1.00 72.48 C ATOM 1516 O PHE A 159 29.919 -33.943 9.443 1.00 73.57 O ATOM 1517 CB PHE A 159 27.821 -32.227 10.761 1.00 75.93 C ATOM 1518 CG PHE A 159 27.323 -31.415 9.596 1.00 81.74 C ATOM 1519 CD1 PHE A 159 26.017 -30.948 9.570 1.00 81.02 C ATOM 1520 CD2 PHE A 159 28.159 -31.121 8.527 1.00 86.20 C ATOM 1521 CE1 PHE A 159 25.555 -30.200 8.500 1.00 84.10 C ATOM 1522 CE2 PHE A 159 27.701 -30.376 7.452 1.00 89.56 C ATOM 1523 CZ PHE A 159 26.398 -29.914 7.440 1.00 88.61 C ATOM 1524 H PHE A 159 29.134 -34.182 12.146 1.00 0.00 H ATOM 1525 N ALA A 160 28.104 -34.500 8.241 1.00 73.17 N ATOM 1526 CA ALA A 160 28.866 -34.861 7.054 1.00 79.24 C ATOM 1527 C ALA A 160 27.941 -34.946 5.848 1.00 83.99 C ATOM 1528 O ALA A 160 26.796 -35.378 5.967 1.00 80.84 O ATOM 1529 CB ALA A 160 29.586 -36.183 7.273 1.00 78.00 C ATOM 1530 H ALA A 160 27.067 -34.577 8.221 1.00 0.00 H ATOM 1531 N ARG A 161 28.446 -34.526 4.691 1.00 92.03 N ATOM 1532 CA ARG A 161 27.666 -34.512 3.458 1.00 96.41 C ATOM 1533 C ARG A 161 26.391 -33.694 3.633 1.00 89.07 C ATOM 1534 O ARG A 161 25.300 -34.137 3.274 1.00 88.66 O ATOM 1535 CB ARG A 161 27.334 -35.939 3.007 1.00101.41 C ATOM 1536 CG ARG A 161 28.558 -36.824 2.787 1.00107.76 C ATOM 1537 CD ARG A 161 28.265 -37.943 1.803 1.00112.69 C ATOM 1538 NE ARG A 161 26.974 -38.569 2.071 1.00112.37 N ATOM 1539 CZ ARG A 161 26.755 -39.447 3.043 1.00110.85 C ATOM 1540 NH1 ARG A 161 25.544 -39.962 3.209 1.00108.42 N ATOM 1541 NH2 ARG A 161 27.742 -39.812 3.852 1.00110.99 N ATOM 1542 HE ARG A 161 26.173 -38.310 1.460 1.00 0.00 H ATOM 1543 HH12 ARG A 161 25.371 -40.650 3.970 1.00 0.00 H ATOM 1544 HH11 ARG A 161 24.767 -39.678 2.578 1.00 0.00 H ATOM 1545 HH22 ARG A 161 27.564 -40.500 4.611 1.00 0.00 H ATOM 1546 HH21 ARG A 161 28.693 -39.410 3.726 1.00 0.00 H ATOM 1547 H ARG A 161 29.432 -34.196 4.664 1.00 0.00 H ATOM 1548 N GLY A 162 26.540 -32.501 4.201 1.00 85.81 N ATOM 1549 CA GLY A 162 25.440 -31.561 4.326 1.00 82.48 C ATOM 1550 C GLY A 162 24.265 -32.067 5.144 1.00 76.95 C ATOM 1551 O GLY A 162 23.168 -31.512 5.065 1.00 77.43 O ATOM 1552 H GLY A 162 27.475 -32.232 4.568 1.00 0.00 H ATOM 1553 N ARG A 163 24.487 -33.123 5.922 1.00 83.94 N ATOM 1554 CA ARG A 163 23.444 -33.674 6.782 1.00 82.62 C ATOM 1555 C ARG A 163 23.988 -34.001 8.168 1.00 74.40 C ATOM 1556 O ARG A 163 25.161 -34.336 8.331 1.00 70.15 O ATOM 1557 CB ARG A 163 22.804 -34.921 6.147 1.00 91.07 C ATOM 1558 CG ARG A 163 23.774 -36.055 5.815 1.00 96.17 C ATOM 1559 CD ARG A 163 23.069 -37.204 5.104 1.00102.76 C ATOM 1560 NE ARG A 163 22.358 -38.081 6.037 1.00103.92 N ATOM 1561 CZ ARG A 163 22.608 -39.380 6.209 1.00107.25 C ATOM 1562 NH1 ARG A 163 23.552 -40.000 5.506 1.00111.14 N ATOM 1563 NH2 ARG A 163 21.900 -40.073 7.090 1.00106.37 N ATOM 1564 HE ARG A 163 21.600 -37.658 6.610 1.00 0.00 H ATOM 1565 HH12 ARG A 163 23.731 -41.014 5.656 1.00 0.00 H ATOM 1566 HH11 ARG A 163 24.111 -39.471 4.807 1.00 0.00 H ATOM 1567 HH22 ARG A 163 22.090 -41.086 7.229 1.00 0.00 H ATOM 1568 HH21 ARG A 163 21.154 -39.604 7.643 1.00 0.00 H ATOM 1569 H ARG A 163 25.427 -33.567 5.917 1.00 0.00 H ATOM 1570 N THR A 164 23.119 -33.880 9.162 1.00 69.57 N ATOM 1571 CA THR A 164 23.444 -34.251 10.527 1.00 65.03 C ATOM 1572 C THR A 164 23.069 -35.715 10.740 1.00 62.10 C ATOM 1573 O THR A 164 21.974 -36.135 10.376 1.00 61.43 O ATOM 1574 CB THR A 164 22.691 -33.352 11.521 1.00 63.81 C ATOM 1575 OG1 THR A 164 23.120 -31.997 11.350 1.00 65.41 O ATOM 1576 CG2 THR A 164 22.963 -33.775 12.949 1.00 60.13 C ATOM 1577 HG1 THR A 164 22.636 -31.416 11.989 1.00 0.00 H ATOM 1578 H THR A 164 22.171 -33.506 8.956 1.00 0.00 H ATOM 1579 N ARG A 165 23.988 -36.484 11.319 1.00 60.94 N ATOM 1580 CA ARG A 165 23.796 -37.919 11.518 1.00 63.10 C ATOM 1581 C ARG A 165 23.959 -38.323 12.979 1.00 57.52 C ATOM 1582 O ARG A 165 24.850 -37.835 13.671 1.00 55.33 O ATOM 1583 CB ARG A 165 24.792 -38.704 10.664 1.00 71.85 C ATOM 1584 CG ARG A 165 24.392 -38.829 9.203 1.00 83.27 C ATOM 1585 CD ARG A 165 25.329 -39.757 8.432 1.00 92.39 C ATOM 1586 NE ARG A 165 25.382 -41.105 9.002 1.00 96.42 N ATOM 1587 CZ ARG A 165 25.897 -42.167 8.384 1.00100.48 C ATOM 1588 NH1 ARG A 165 26.401 -42.056 7.162 1.00105.22 N ATOM 1589 NH2 ARG A 165 25.902 -43.348 8.988 1.00 99.10 N ATOM 1590 HE ARG A 165 24.990 -41.243 9.956 1.00 0.00 H ATOM 1591 HH12 ARG A 165 26.801 -42.890 6.687 1.00 0.00 H ATOM 1592 HH11 ARG A 165 26.396 -41.135 6.679 1.00 0.00 H ATOM 1593 HH22 ARG A 165 26.304 -44.177 8.506 1.00 0.00 H ATOM 1594 HH21 ARG A 165 25.504 -43.445 9.944 1.00 0.00 H ATOM 1595 H ARG A 165 24.875 -36.048 11.642 1.00 0.00 H ATOM 1596 N TYR A 166 23.093 -39.221 13.438 1.00 56.68 N ATOM 1597 CA TYR A 166 23.149 -39.734 14.805 1.00 53.47 C ATOM 1598 C TYR A 166 23.470 -41.218 14.784 1.00 53.26 C ATOM 1599 O TYR A 166 22.650 -42.032 14.365 1.00 58.17 O ATOM 1600 CB TYR A 166 21.817 -39.514 15.529 1.00 50.83 C ATOM 1601 CG TYR A 166 21.447 -38.061 15.731 1.00 49.72 C ATOM 1602 CD1 TYR A 166 22.425 -37.092 15.925 1.00 48.66 C ATOM 1603 CD2 TYR A 166 20.120 -37.659 15.722 1.00 51.05 C ATOM 1604 CE1 TYR A 166 22.089 -35.759 16.109 1.00 49.70 C ATOM 1605 CE2 TYR A 166 19.774 -36.333 15.902 1.00 54.12 C ATOM 1606 CZ TYR A 166 20.762 -35.382 16.096 1.00 53.71 C ATOM 1607 OH TYR A 166 20.419 -34.055 16.275 1.00 55.30 O ATOM 1608 HH TYR A 166 21.241 -33.517 16.399 1.00 0.00 H ATOM 1609 H TYR A 166 22.349 -39.571 12.801 1.00 0.00 H ATOM 1610 N THR A 167 24.667 -41.558 15.247 1.00 50.37 N ATOM 1611 CA THR A 167 25.131 -42.935 15.265 1.00 47.85 C ATOM 1612 C THR A 167 24.942 -43.534 16.648 1.00 45.58 C ATOM 1613 O THR A 167 25.485 -43.029 17.627 1.00 44.82 O ATOM 1614 CB THR A 167 26.614 -43.014 14.880 1.00 49.87 C ATOM 1615 OG1 THR A 167 26.763 -42.648 13.505 1.00 54.67 O ATOM 1616 CG2 THR A 167 27.167 -44.423 15.076 1.00 51.52 C ATOM 1617 HG1 THR A 167 27.719 -42.698 13.253 1.00 0.00 H ATOM 1618 H THR A 167 25.295 -40.812 15.610 1.00 0.00 H ATOM 1619 N PRO A 168 24.160 -44.615 16.742 1.00 45.98 N ATOM 1620 CA PRO A 168 24.045 -45.252 18.057 1.00 47.30 C ATOM 1621 C PRO A 168 25.324 -45.986 18.456 1.00 47.84 C ATOM 1622 O PRO A 168 25.886 -46.719 17.639 1.00 48.38 O ATOM 1623 CB PRO A 168 22.892 -46.240 17.865 1.00 49.37 C ATOM 1624 CG PRO A 168 22.875 -46.524 16.401 1.00 50.63 C ATOM 1625 CD PRO A 168 23.300 -45.257 15.733 1.00 47.59 C ATOM 1626 N LEU A 169 25.773 -45.788 19.693 1.00 47.14 N ATOM 1627 CA LEU A 169 26.968 -46.468 20.196 1.00 50.27 C ATOM 1628 C LEU A 169 26.621 -47.641 21.117 1.00 48.43 C ATOM 1629 O LEU A 169 27.199 -48.717 21.003 1.00 48.29 O ATOM 1630 CB LEU A 169 27.859 -45.481 20.943 1.00 49.99 C ATOM 1631 CG LEU A 169 28.214 -44.230 20.146 1.00 51.80 C ATOM 1632 CD1 LEU A 169 28.974 -43.272 21.028 1.00 53.11 C ATOM 1633 CD2 LEU A 169 29.030 -44.584 18.917 1.00 55.80 C ATOM 1634 H LEU A 169 25.262 -45.133 20.319 1.00 0.00 H ATOM 1635 N LYS A 170 25.679 -47.413 22.028 1.00 46.05 N ATOM 1636 CA LYS A 170 25.300 -48.394 23.039 1.00 47.59 C ATOM 1637 C LYS A 170 23.841 -48.187 23.407 1.00 49.38 C ATOM 1638 O LYS A 170 23.337 -47.071 23.306 1.00 52.86 O ATOM 1639 CB LYS A 170 26.154 -48.221 24.298 1.00 49.43 C ATOM 1640 CG LYS A 170 27.603 -48.637 24.133 1.00 55.57 C ATOM 1641 CD LYS A 170 28.435 -48.255 25.346 1.00 59.78 C ATOM 1642 CE LYS A 170 29.742 -49.028 25.394 1.00 64.41 C ATOM 1643 NZ LYS A 170 29.510 -50.458 25.727 1.00 68.72 N ATOM 1644 HZ1 LYS A 170 29.050 -50.526 26.657 1.00 0.00 H ATOM 1645 HZ2 LYS A 170 28.897 -50.886 25.004 1.00 0.00 H ATOM 1646 HZ3 LYS A 170 30.421 -50.959 25.752 1.00 0.00 H ATOM 1647 H LYS A 170 25.191 -46.495 22.019 1.00 0.00 H ATOM 1648 N ARG A 171 23.169 -49.255 23.834 1.00 47.87 N ATOM 1649 CA ARG A 171 21.788 -49.166 24.303 1.00 45.95 C ATOM 1650 C ARG A 171 21.630 -49.872 25.650 1.00 45.29 C ATOM 1651 O ARG A 171 22.374 -50.799 25.963 1.00 47.81 O ATOM 1652 CB ARG A 171 20.828 -49.772 23.279 1.00 48.01 C ATOM 1653 CG ARG A 171 20.869 -49.122 21.901 1.00 47.66 C ATOM 1654 CD ARG A 171 19.590 -49.414 21.126 1.00 48.09 C ATOM 1655 NE ARG A 171 19.789 -49.420 19.676 1.00 48.52 N ATOM 1656 CZ ARG A 171 19.508 -48.406 18.861 1.00 49.09 C ATOM 1657 NH1 ARG A 171 19.011 -47.268 19.332 1.00 47.47 N ATOM 1658 NH2 ARG A 171 19.729 -48.532 17.559 1.00 51.45 N ATOM 1659 HE ARG A 171 20.180 -50.284 19.249 1.00 0.00 H ATOM 1660 HH12 ARG A 171 18.797 -46.485 18.681 1.00 0.00 H ATOM 1661 HH11 ARG A 171 18.836 -47.160 20.351 1.00 0.00 H ATOM 1662 HH22 ARG A 171 19.512 -47.744 16.916 1.00 0.00 H ATOM 1663 HH21 ARG A 171 20.119 -49.419 17.181 1.00 0.00 H ATOM 1664 H ARG A 171 23.642 -50.181 23.834 1.00 0.00 H ATOM 1665 N TRP A 172 20.669 -49.410 26.446 1.00 43.08 N ATOM 1666 CA TRP A 172 20.429 -49.955 27.778 1.00 44.51 C ATOM 1667 C TRP A 172 18.938 -50.138 28.002 1.00 45.09 C ATOM 1668 O TRP A 172 18.164 -49.193 27.867 1.00 44.07 O ATOM 1669 CB TRP A 172 20.988 -49.024 28.857 1.00 45.14 C ATOM 1670 CG TRP A 172 22.490 -48.952 28.884 1.00 48.51 C ATOM 1671 CD1 TRP A 172 23.337 -49.789 29.550 1.00 52.93 C ATOM 1672 CD2 TRP A 172 23.323 -47.988 28.219 1.00 46.85 C ATOM 1673 NE1 TRP A 172 24.641 -49.408 29.341 1.00 54.64 N ATOM 1674 CE2 TRP A 172 24.658 -48.305 28.528 1.00 49.83 C ATOM 1675 CE3 TRP A 172 23.068 -46.890 27.393 1.00 45.68 C ATOM 1676 CZ2 TRP A 172 25.736 -47.565 28.039 1.00 48.96 C ATOM 1677 CZ3 TRP A 172 24.147 -46.154 26.909 1.00 44.11 C ATOM 1678 CH2 TRP A 172 25.458 -46.497 27.236 1.00 45.35 C ATOM 1679 HE1 TRP A 172 25.479 -49.880 29.736 1.00 0.00 H ATOM 1680 H TRP A 172 20.067 -48.633 26.107 1.00 0.00 H ATOM 1681 N ALA A 173 18.538 -51.356 28.351 1.00 46.12 N ATOM 1682 CA ALA A 173 17.136 -51.633 28.613 1.00 47.14 C ATOM 1683 C ALA A 173 16.743 -51.111 29.994 1.00 48.08 C ATOM 1684 O ALA A 173 17.584 -50.993 30.885 1.00 47.47 O ATOM 1685 CB ALA A 173 16.850 -53.124 28.489 1.00 44.70 C ATOM 1686 H ALA A 173 19.237 -52.121 28.438 1.00 0.00 H ATOM 1687 N LEU A 174 15.461 -50.785 30.148 1.00 50.60 N ATOM 1688 CA LEU A 174 14.917 -50.341 31.425 1.00 54.32 C ATOM 1689 C LEU A 174 14.110 -51.473 32.049 1.00 64.95 C ATOM 1690 O LEU A 174 13.804 -52.457 31.382 1.00 64.61 O ATOM 1691 CB LEU A 174 14.051 -49.100 31.222 1.00 49.90 C ATOM 1692 CG LEU A 174 14.812 -47.900 30.655 1.00 45.76 C ATOM 1693 CD1 LEU A 174 13.887 -47.015 29.849 1.00 45.94 C ATOM 1694 CD2 LEU A 174 15.459 -47.105 31.765 1.00 44.20 C ATOM 1695 H LEU A 174 14.825 -50.850 29.327 1.00 0.00 H ATOM 1696 N THR A 175 13.769 -51.317 33.326 1.00 81.59 N ATOM 1697 CA THR A 175 13.118 -52.354 34.142 1.00 99.25 C ATOM 1698 C THR A 175 14.102 -53.456 34.533 1.00114.91 C ATOM 1699 O THR A 175 13.753 -54.349 35.304 1.00119.88 O ATOM 1700 CB THR A 175 11.866 -53.005 33.464 1.00 98.58 C ATOM 1701 OG1 THR A 175 11.392 -52.187 32.390 1.00 99.99 O ATOM 1702 CG2 THR A 175 10.737 -53.186 34.471 1.00 99.86 C ATOM 1703 HG1 THR A 175 12.107 -52.086 31.713 1.00 0.00 H ATOM 1704 H THR A 175 13.976 -50.403 33.776 1.00 0.00 H ATOM 1705 N GLN A 176 15.328 -53.363 34.019 1.00122.52 N ATOM 1706 CA GLN A 176 16.379 -54.373 34.211 1.00130.88 C ATOM 1707 C GLN A 176 15.896 -55.833 34.141 1.00135.40 C ATOM 1708 O GLN A 176 16.540 -56.732 34.688 1.00138.18 O ATOM 1709 CB GLN A 176 17.170 -54.109 35.509 1.00133.65 C ATOM 1710 CG GLN A 176 16.509 -54.540 36.829 1.00136.15 C ATOM 1711 CD GLN A 176 15.734 -53.426 37.522 1.00135.06 C ATOM 1712 OE1 GLN A 176 15.428 -52.391 36.927 1.00132.49 O ATOM 1713 NE2 GLN A 176 15.424 -53.636 38.800 1.00136.90 N ATOM 1714 OXT GLN A 176 14.873 -56.159 33.530 1.00135.86 O ATOM 1715 HE22 GLN A 176 15.702 -54.525 39.263 1.00 0.00 H ATOM 1716 HE21 GLN A 176 14.904 -52.911 39.335 1.00 0.00 H ATOM 1717 H GLN A 176 15.555 -52.525 33.447 1.00 0.00 H TER 1718 GLN A 176 HETATM 1719 O HOH 1 16.839 -45.585 22.044 1.00 47.57 O HETATM 1720 O HOH 2 25.322 -32.159 17.309 1.00 63.25 O HETATM 1721 O HOH 3 31.963 -39.046 16.465 1.00 67.39 O HETATM 1722 O HOH 4 -5.999 -43.297 23.648 1.00 36.90 O HETATM 1723 O HOH 5 27.335 -50.209 30.654 1.00 54.40 O HETATM 1724 O HOH 6 14.974 -33.142 25.917 1.00 54.97 O HETATM 1725 O HOH 7 24.243 -51.611 23.779 1.00 41.66 O HETATM 1726 O HOH 8 9.771 -18.271 22.622 1.00 60.81 O HETATM 1727 O HOH 9 18.725 -45.535 16.554 1.00 63.05 O HETATM 1728 O HOH 10 0.985 -34.441 30.344 1.00 43.71 O HETATM 1729 O HOH 11 7.329 -49.348 22.723 1.00 41.49 O HETATM 1730 O HOH 12 15.434 -33.294 22.781 1.00 38.96 O HETATM 1731 O HOH 13 13.898 -41.761 17.587 1.00 41.08 O HETATM 1732 O HOH 14 21.301 -49.468 32.969 1.00 43.24 O HETATM 1733 O HOH 15 17.481 -23.690 15.459 1.00 58.50 O HETATM 1734 O HOH 16 27.954 -47.865 16.349 1.00 50.43 O HETATM 1735 O HOH 17 20.405 -49.448 15.099 1.00 37.41 O HETATM 1736 O HOH 18 6.926 -29.853 28.081 1.00 58.77 O HETATM 1737 O HOH 19 16.811 -52.867 21.474 1.00 38.74 O HETATM 1738 O HOH 20 26.519 -41.862 32.439 1.00 50.30 O HETATM 1739 O HOH 21 -4.325 -36.980 14.932 1.00 56.33 O HETATM 1740 O HOH 22 -0.820 -29.712 32.881 1.00 49.07 O HETATM 1741 O HOH 23 15.343 -32.851 19.874 1.00 63.10 O HETATM 1742 O HOH 24 8.308 -27.134 7.310 1.00 52.14 O HETATM 1743 O HOH 25 4.266 -48.805 22.724 1.00 44.97 O HETATM 1744 O HOH 26 17.245 -33.345 16.310 1.00 50.23 O HETATM 1745 O HOH 27 -3.657 -30.864 15.258 1.00 55.59 O HETATM 1746 O HOH 28 -1.607 -38.434 14.094 1.00 51.41 O HETATM 1747 O HOH 29 -0.656 -28.070 30.995 1.00 51.37 O HETATM 1748 O HOH 30 14.418 -34.117 17.626 1.00 45.40 O HETATM 1749 O HOH 31 7.899 -50.059 28.897 1.00 51.50 O HETATM 1750 O HOH 32 5.285 -48.977 20.018 1.00 53.05 O HETATM 1751 O HOH 33 16.284 -44.994 15.794 1.00 66.59 O HETATM 1752 O HOH 34 -1.984 -46.927 23.484 1.00 45.69 O HETATM 1753 P UNN A 35 17.864 -29.617 20.677 1.00 0.20 P HETATM 1754 O1P UNN A 35 17.137 -30.584 19.770 1.00 -0.55 O HETATM 1755 O2P UNN A 35 16.871 -28.920 21.578 1.00 -0.55 O HETATM 1756 O3P UNN A 35 18.615 -28.601 19.852 1.00 -0.55 O HETATM 1757 O2' UNN A 35 18.937 -30.407 21.585 1.00 -0.26 O HETATM 1758 C2' UNN A 35 20.163 -30.865 21.058 1.00 0.17 C HETATM 1759 C3' UNN A 35 19.954 -32.094 20.189 1.00 0.12 C HETATM 1760 C4' UNN A 35 21.033 -33.077 20.606 1.00 0.11 C HETATM 1761 C5' UNN A 35 21.882 -33.503 19.420 1.00 0.07 C HETATM 1762 O5' UNN A 35 22.719 -32.438 19.033 1.00 -0.39 O HETATM 1763 H3 UNN A 35 23.285 -32.201 19.759 1.00 0.21 H HETATM 1764 H1 UNN A 35 22.498 -34.369 19.703 1.00 0.06 H HETATM 1765 H2 UNN A 35 21.227 -33.778 18.580 1.00 0.06 H HETATM 1766 O4' UNN A 35 21.823 -32.441 21.593 1.00 -0.34 O HETATM 1767 C1' UNN A 35 21.121 -31.338 22.143 1.00 0.21 C HETATM 1768 N9 UNN A 35 22.066 -30.304 22.624 1.00 -0.19 N HETATM 1769 C8 UNN A 35 21.984 -29.639 23.820 1.00 0.11 C HETATM 1770 N7 UNN A 35 23.034 -28.788 23.920 1.00 -0.30 N HETATM 1771 C5 UNN A 35 23.794 -28.904 22.812 1.00 0.10 C HETATM 1772 C6 UNN A 35 24.966 -28.271 22.411 1.00 0.13 C HETATM 1773 N6 UNN A 35 25.548 -27.357 23.187 1.00 -0.32 N HETATM 1774 H10 UNN A 35 26.416 -26.896 22.878 1.00 0.18 H HETATM 1775 H11 UNN A 35 25.130 -27.112 24.096 1.00 0.18 H HETATM 1776 N1 UNN A 35 25.525 -28.601 21.194 1.00 -0.27 N HETATM 1777 C2 UNN A 35 24.920 -29.549 20.392 1.00 0.05 C HETATM 1778 N3 UNN A 35 23.760 -30.170 20.803 1.00 -0.27 N HETATM 1779 C4 UNN A 35 23.202 -29.858 21.993 1.00 0.16 C HETATM 1780 H12 UNN A 35 25.360 -29.806 19.435 1.00 0.10 H HETATM 1781 H9 UNN A 35 21.203 -29.773 24.567 1.00 0.13 H HETATM 1782 H8 UNN A 35 20.530 -31.677 23.007 1.00 0.10 H HETATM 1783 H4 UNN A 35 20.561 -33.972 21.038 1.00 0.06 H HETATM 1784 O3' UNN A 35 18.689 -32.681 20.399 1.00 -0.39 O HETATM 1785 H6 UNN A 35 18.010 -32.069 20.139 1.00 0.21 H HETATM 1786 H5 UNN A 35 20.061 -31.828 19.127 1.00 0.07 H HETATM 1787 H7 UNN A 35 20.623 -30.054 20.474 1.00 0.07 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 1753 1754 1755 1756 1757 CONECT 1754 1753 CONECT 1755 1753 CONECT 1756 1753 CONECT 1757 1753 1758 CONECT 1758 1757 1759 1767 1787 CONECT 1759 1758 1760 1784 1786 CONECT 1760 1759 1761 1766 1783 CONECT 1761 1760 1762 1764 1765 CONECT 1762 1761 1763 CONECT 1763 1762 CONECT 1764 1761 CONECT 1765 1761 CONECT 1766 1760 1767 CONECT 1767 1758 1766 1768 1782 CONECT 1768 1767 1769 1779 CONECT 1769 1768 1770 1781 CONECT 1770 1769 1771 CONECT 1771 1770 1772 1779 CONECT 1772 1771 1773 1776 CONECT 1773 1772 1774 1775 CONECT 1774 1773 CONECT 1775 1773 CONECT 1776 1772 1777 CONECT 1777 1776 1778 1780 CONECT 1778 1777 1779 CONECT 1779 1768 1771 1778 CONECT 1780 1777 CONECT 1781 1769 CONECT 1782 1767 CONECT 1783 1760 CONECT 1784 1759 1785 CONECT 1785 1784 CONECT 1786 1759 CONECT 1787 1758 MASTER 0 0 0 0 0 0 0 0 1786 1 39 14 END
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Structure:
Ligand 2D
Ligand 3D
Protein
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Related entries of code: 5ldm
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5ldk
RCSB PDB
PDBbind
177aa, >5LDK_1|Chains... *
5ldo
RCSB PDB
PDBbind
177aa, >5LDO_1|Chains... at 100%
5ldp
RCSB PDB
PDBbind
177aa, >5LDP_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1rgk
RCSB PDB
PDBbind
2AM
6rnt
RCSB PDB
PDBbind
2AM
Entry Information
PDB ID
5ldm
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
RNA 2',3'-cyclic phosphodiesterase
Ligand Name
2AM
EC.Number
E.C.-.-.-.-
Resolution
2.46(Å)
Affinity (Kd/Ki/IC50)
Kd=139uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) PLoS ONE Vol. 12: pp. e0170355-e0170355
Ligand Properties
Formula
C
1
0
H
1
5
N
5
O
7
P
Molecular Weight
348.229
Exact Mass
348.071
No. of atoms
38
No. of bonds
40
Polar Surface Area
202.82
LOGP Value
-3.16 (
Computed with XLOGP3
)
-1.72 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 3
Canonical SMILES
OC[C@H]1O[C@H]([C@@H]([C@@H]1O)OP(O)(O)O)n1cnc2c1ncnc2N
InChI String
InChI=1S/C10H16N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(22-23(18,19)20)6(17)4(1-16)21-10/h2-4,6-7,10,16-20,23H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/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):
A0A140NFI1
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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