REMARK Name = BDB063525 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CB PHE A 1 -0.402 3.115 -0.470 0.00 0.00 +0.038 C ATOM 2 CA PHE A 1 -0.012 1.652 -0.295 0.00 0.00 +0.156 C ENDROOT BRANCH 2 3 ATOM 3 C PHE A 1 -1.204 0.726 -0.607 0.00 0.00 +0.234 C ATOM 4 N PHE A 1 -2.270 0.842 0.260 0.00 0.00 -0.301 N ATOM 5 H PHE A 1 -2.059 1.207 1.183 0.00 0.00 +0.150 HD ATOM 6 O PHE A 1 -1.197 -0.048 -1.564 0.00 0.00 -0.274 OA BRANCH 4 7 ATOM 7 CA PHE A 1 -3.392 -0.109 0.197 0.00 0.00 +0.186 C BRANCH 7 8 ATOM 8 C PHE A 1 -3.040 -1.268 1.126 0.00 0.00 +0.326 C ATOM 9 O PHE A 1 -2.483 -1.164 2.211 0.00 0.00 -0.249 OA BRANCH 8 10 ATOM 10 OXT PHE A 1 -3.410 -2.473 0.655 0.00 0.00 -0.479 OA ATOM 11 HXT PHE A 1 -3.128 -3.114 1.340 0.00 0.00 +0.295 HD ENDBRANCH 8 10 ENDBRANCH 7 8 BRANCH 7 12 ATOM 12 CB PHE A 1 -4.683 0.570 0.669 0.00 0.00 +0.069 C BRANCH 12 13 ATOM 13 CG PHE A 1 -5.920 -0.275 0.485 0.00 0.00 -0.045 A ATOM 14 CD2 PHE A 1 -6.548 -0.866 1.590 0.00 0.00 +0.004 A ATOM 15 CE2 PHE A 1 -7.686 -1.656 1.416 0.00 0.00 +0.000 A ATOM 16 CZ PHE A 1 -8.205 -1.861 0.140 0.00 0.00 +0.000 A ATOM 17 CE1 PHE A 1 -7.589 -1.277 -0.965 0.00 0.00 +0.000 A ATOM 18 CD1 PHE A 1 -6.451 -0.487 -0.794 0.00 0.00 +0.004 A ENDBRANCH 12 13 ENDBRANCH 7 12 ENDBRANCH 4 7 ENDBRANCH 2 3 BRANCH 2 19 ATOM 19 N PHE A 1 1.081 1.287 -1.188 0.00 0.00 -0.303 N ATOM 20 H PHE A 1 0.843 0.679 -1.968 0.00 0.00 +0.149 HD ATOM 21 C UNK A 0 2.393 1.566 -0.895 0.00 0.00 +0.227 C ATOM 22 O UNK A 0 2.734 2.191 0.108 0.00 0.00 -0.274 OA BRANCH 21 23 ATOM 23 C UNK A 0 3.394 1.040 -1.932 0.00 0.00 +0.177 C BRANCH 23 24 ATOM 24 N UNK A 0 4.702 0.756 -1.320 0.00 0.00 -0.304 NA ATOM 25 H UNK A 0 4.932 1.544 -0.707 0.00 0.00 +0.123 HD BRANCH 24 26 ATOM 26 C UNK A 0 4.660 -0.452 -0.495 0.00 0.00 +0.116 C BRANCH 26 27 ATOM 27 C UNK A 0 5.980 -0.660 0.209 0.00 0.00 -0.034 A ATOM 28 C UNK A 0 6.159 -0.221 1.529 0.00 0.00 +0.005 A ATOM 29 C UNK A 0 7.383 -0.402 2.175 0.00 0.00 +0.000 A ATOM 30 C UNK A 0 8.442 -1.014 1.507 0.00 0.00 +0.000 A ATOM 31 C UNK A 0 8.280 -1.440 0.190 0.00 0.00 +0.000 A ATOM 32 C UNK A 0 7.057 -1.261 -0.458 0.00 0.00 +0.005 A ENDBRANCH 26 27 ENDBRANCH 24 26 ENDBRANCH 23 24 ENDBRANCH 21 23 ENDBRANCH 2 19 TORSDOF 11