REMARK Name = BDB050384 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C TRP A 1 -0.168 0.911 -1.071 0.00 0.00 +0.231 C ATOM 2 N UNK A 2 -1.210 0.583 -0.234 0.00 0.00 -0.301 N ATOM 3 H UNK A 2 -1.139 0.836 0.745 0.00 0.00 +0.150 HD ATOM 4 O TRP A 1 -0.344 0.984 -2.288 0.00 0.00 -0.274 OA ENDROOT BRANCH 1 5 ATOM 5 CA TRP A 1 1.161 1.277 -0.385 0.00 0.00 +0.142 C BRANCH 5 6 ATOM 6 N TRP A 1 0.999 2.572 0.312 0.00 0.00 -0.320 NA ATOM 7 H1 TRP A 1 0.253 2.536 1.001 0.00 0.00 +0.119 HD ATOM 8 H2 TRP A 1 0.742 3.289 -0.369 0.00 0.00 +0.119 HD ENDBRANCH 5 6 BRANCH 5 9 ATOM 9 CB TRP A 1 1.609 0.139 0.550 0.00 0.00 +0.065 C BRANCH 9 10 ATOM 10 CG TRP A 1 3.070 0.180 0.880 0.00 0.00 -0.020 A ATOM 11 CD2 TRP A 1 4.141 -0.352 0.091 0.00 0.00 +0.003 A ATOM 12 CE2 TRP A 1 5.330 -0.094 0.772 0.00 0.00 +0.047 A ATOM 13 CZ2 TRP A 1 6.584 -0.479 0.282 0.00 0.00 +0.026 A ATOM 14 CH2 TRP A 1 6.623 -1.149 -0.944 0.00 0.00 +0.002 A ATOM 15 CZ3 TRP A 1 5.454 -1.421 -1.649 0.00 0.00 +0.001 A ATOM 16 NE1 TRP A 1 4.997 0.571 1.929 0.00 0.00 -0.360 N ATOM 17 HE1 TRP A 1 5.664 0.891 2.617 0.00 0.00 +0.165 HD ATOM 18 CE3 TRP A 1 4.208 -1.029 -1.145 0.00 0.00 +0.010 A ATOM 19 CD1 TRP A 1 3.641 0.736 2.008 0.00 0.00 +0.087 A ENDBRANCH 9 10 ENDBRANCH 5 9 ENDBRANCH 1 5 BRANCH 2 20 ATOM 20 C UNK A 2 -2.542 0.265 -0.760 0.00 0.00 +0.182 C BRANCH 20 21 ATOM 21 C UNK A 2 -3.261 1.572 -1.151 0.00 0.00 +0.325 C ATOM 22 O UNK A 2 -4.254 2.017 -0.592 0.00 0.00 -0.249 OA BRANCH 21 23 ATOM 23 O UNK A 2 -2.681 2.212 -2.197 0.00 0.00 -0.479 OA ATOM 24 H UNK A 2 -1.865 1.757 -2.523 0.00 0.00 +0.295 HD ENDBRANCH 21 23 ENDBRANCH 20 21 BRANCH 20 25 ATOM 25 C UNK A 2 -3.327 -0.544 0.282 0.00 0.00 +0.034 C BRANCH 25 26 ATOM 26 C UNK A 2 -4.589 -1.194 -0.300 0.00 0.00 +0.013 C BRANCH 26 27 ATOM 27 C UNK A 2 -5.339 -2.034 0.730 0.00 0.00 +0.120 C BRANCH 27 28 ATOM 28 C UNK A 2 -5.983 -1.179 1.786 0.00 0.00 +0.305 C ATOM 29 O UNK A 2 -5.506 -0.907 2.875 0.00 0.00 -0.251 OA BRANCH 28 30 ATOM 30 O UNK A 2 -7.171 -0.683 1.400 0.00 0.00 -0.481 OA ATOM 31 H UNK A 2 -7.450 -0.107 2.142 0.00 0.00 +0.295 HD ENDBRANCH 28 30 ENDBRANCH 27 28 ENDBRANCH 26 27 ENDBRANCH 25 26 ENDBRANCH 20 25 ENDBRANCH 2 20 TORSDOF 12