REMARK Name = BDB049048 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CA ARG A 2 0.607 -0.756 0.433 0.00 0.00 +0.159 C ENDROOT BRANCH 1 3 ATOM 2 C TRP A 1 2.011 -0.419 -1.620 0.00 0.00 +0.234 C ATOM 3 N ARG A 2 1.677 -1.131 -0.490 0.00 0.00 -0.302 N ATOM 4 H ARG A 2 2.232 -1.944 -0.253 0.00 0.00 +0.150 HD ATOM 5 O TRP A 1 1.455 0.625 -1.962 0.00 0.00 -0.274 OA BRANCH 2 6 ATOM 6 CA TRP A 1 3.151 -1.033 -2.458 0.00 0.00 +0.163 C BRANCH 6 9 ATOM 7 C UNK A 0 3.156 -0.560 -6.235 0.00 0.00 +0.109 C ATOM 8 C UNK A 0 3.518 -1.169 -4.909 0.00 0.00 +0.211 C ATOM 9 N TRP A 1 2.978 -0.532 -3.824 0.00 0.00 -0.304 N ATOM 10 H TRP A 1 2.289 0.206 -3.944 0.00 0.00 +0.149 HD ATOM 11 O UNK A 0 4.247 -2.153 -4.819 0.00 0.00 -0.276 OA ENDBRANCH 6 9 BRANCH 6 12 ATOM 12 CB TRP A 1 4.526 -0.649 -1.892 0.00 0.00 +0.069 C BRANCH 12 13 ATOM 13 CG TRP A 1 4.850 -1.307 -0.584 0.00 0.00 -0.020 A ATOM 14 CD2 TRP A 1 4.956 -0.673 0.696 0.00 0.00 +0.003 A ATOM 15 CE2 TRP A 1 5.252 -1.666 1.631 0.00 0.00 +0.047 A ATOM 16 CZ2 TRP A 1 5.410 -1.399 2.996 0.00 0.00 +0.026 A ATOM 17 CH2 TRP A 1 5.264 -0.075 3.420 0.00 0.00 +0.002 A ATOM 18 CZ3 TRP A 1 4.976 0.940 2.512 0.00 0.00 +0.001 A ATOM 19 NE1 TRP A 1 5.354 -2.853 0.943 0.00 0.00 -0.360 N ATOM 20 HE1 TRP A 1 5.587 -3.742 1.364 0.00 0.00 +0.165 HD ATOM 21 CE3 TRP A 1 4.822 0.655 1.150 0.00 0.00 +0.010 A ATOM 22 CD1 TRP A 1 5.108 -2.650 -0.388 0.00 0.00 +0.087 A ENDBRANCH 12 13 ENDBRANCH 6 12 ENDBRANCH 2 6 ENDBRANCH 1 3 BRANCH 1 23 ATOM 23 C ARG A 2 -0.778 -0.665 -0.277 0.00 0.00 +0.234 C ATOM 24 N VAL A 3 -1.772 -0.028 0.451 0.00 0.00 -0.302 N ATOM 25 H VAL A 3 -1.610 0.026 1.446 0.00 0.00 +0.150 HD ATOM 26 O ARG A 2 -0.982 -1.194 -1.368 0.00 0.00 -0.274 OA BRANCH 24 27 ATOM 27 CA VAL A 3 -3.201 -0.055 0.081 0.00 0.00 +0.162 C BRANCH 27 28 ATOM 28 C VAL A 3 -3.779 -1.403 0.608 0.00 0.00 +0.237 C ATOM 29 N PRO A 4 -5.094 -1.447 1.036 0.00 0.00 -0.286 N ATOM 30 CA PRO A 4 -5.659 -2.732 1.477 0.00 0.00 +0.184 C ATOM 31 CB PRO A 4 -6.989 -2.354 2.135 0.00 0.00 +0.035 C ATOM 32 CG PRO A 4 -6.762 -0.924 2.601 0.00 0.00 +0.021 C ATOM 33 CD PRO A 4 -5.916 -0.334 1.483 0.00 0.00 +0.109 C ATOM 34 O VAL A 3 -3.085 -2.425 0.663 0.00 0.00 -0.274 OA BRANCH 30 35 ATOM 35 C PRO A 4 -5.921 -3.744 0.359 0.00 0.00 +0.325 C ATOM 36 O PRO A 4 -6.296 -4.896 0.527 0.00 0.00 -0.249 OA BRANCH 35 37 ATOM 37 OXT PRO A 4 -5.785 -3.256 -0.890 0.00 0.00 -0.479 OA ATOM 38 HXT PRO A 4 -5.924 -4.032 -1.470 0.00 0.00 +0.295 HD ENDBRANCH 35 37 ENDBRANCH 30 35 ENDBRANCH 27 28 BRANCH 27 39 ATOM 39 CB VAL A 3 -3.507 0.243 -1.411 0.00 0.00 +0.012 C ATOM 40 CG2 VAL A 3 -2.808 1.529 -1.880 0.00 0.00 +0.009 C ATOM 41 CG1 VAL A 3 -5.005 0.392 -1.696 0.00 0.00 +0.009 C ENDBRANCH 27 39 ENDBRANCH 24 27 ENDBRANCH 1 23 BRANCH 1 42 ATOM 42 CB ARG A 2 0.995 0.383 1.391 0.00 0.00 +0.033 C BRANCH 42 43 ATOM 43 CG ARG A 2 1.164 1.767 0.764 0.00 0.00 +0.023 C BRANCH 43 44 ATOM 44 CD ARG A 2 1.332 2.841 1.839 0.00 0.00 +0.115 C BRANCH 44 45 ATOM 45 NE ARG A 2 1.610 4.123 1.211 0.00 0.00 -0.356 N ATOM 46 HE ARG A 2 1.022 4.308 0.406 0.00 0.00 +0.162 HD BRANCH 45 47 ATOM 47 CZ ARG A 2 1.838 5.223 1.963 0.00 0.00 +0.188 C ATOM 48 NH1 ARG A 2 1.973 5.229 3.237 0.00 0.00 -0.269 NA ATOM 49 HH1 ARG A 2 2.118 6.185 3.562 0.00 0.00 +0.190 HD BRANCH 47 50 ATOM 50 NH2 ARG A 2 1.923 6.329 1.200 0.00 0.00 -0.370 N ATOM 51 HH21 ARG A 2 2.376 6.147 0.311 0.00 0.00 +0.159 HD ATOM 52 HH22 ARG A 2 2.349 7.124 1.659 0.00 0.00 +0.159 HD ENDBRANCH 47 50 ENDBRANCH 45 47 ENDBRANCH 44 45 ENDBRANCH 43 44 ENDBRANCH 42 43 ENDBRANCH 1 42 TORSDOF 17