REMARK Name = LIG001632 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C UNK A 0 -1.303 -2.426 0.897 0.00 0.00 +0.217 C ENDROOT BRANCH 1 4 ATOM 2 N LEU A 1 0.367 -0.884 -0.048 0.00 0.00 -0.300 N ATOM 3 H LEU A 1 -0.429 -0.276 -0.210 0.00 0.00 +0.150 HD ATOM 4 C UNK A 0 0.172 -2.013 0.722 0.00 0.00 +0.244 C ATOM 5 O UNK A 0 1.097 -2.639 1.233 0.00 0.00 -0.273 OA BRANCH 2 6 ATOM 6 CA LEU A 1 1.692 -0.256 -0.143 0.00 0.00 +0.182 C BRANCH 6 7 ATOM 7 C LEU A 1 1.835 0.635 1.090 0.00 0.00 +0.325 C ATOM 8 O LEU A 1 0.975 1.370 1.556 0.00 0.00 -0.249 OA BRANCH 7 9 ATOM 9 OXT LEU A 1 3.047 0.549 1.672 0.00 0.00 -0.479 OA ATOM 10 HXT LEU A 1 2.977 1.110 2.473 0.00 0.00 +0.295 HD ENDBRANCH 7 9 ENDBRANCH 6 7 BRANCH 6 11 ATOM 11 CB LEU A 1 1.768 0.546 -1.449 0.00 0.00 +0.036 C BRANCH 11 13 ATOM 12 CD1 LEU A 1 4.262 0.078 -1.812 0.00 0.00 +0.007 C ATOM 13 CG LEU A 1 3.138 1.110 -1.880 0.00 0.00 -0.015 C ATOM 14 CD2 LEU A 1 3.526 2.386 -1.134 0.00 0.00 +0.007 C ENDBRANCH 11 13 ENDBRANCH 6 11 ENDBRANCH 2 6 ENDBRANCH 1 4 BRANCH 1 15 ATOM 15 O UNK A 0 -1.418 -3.810 1.250 0.00 0.00 -0.381 OA ATOM 16 H UNK A 0 -0.907 -3.885 2.082 0.00 0.00 +0.210 HD ENDBRANCH 1 15 BRANCH 1 17 ATOM 17 C UNK A 0 -1.980 -1.536 1.987 0.00 0.00 +0.093 C BRANCH 17 18 ATOM 18 N UNK A 0 -2.307 -2.329 3.197 0.00 0.00 -0.324 NA ATOM 19 H UNK A 0 -2.910 -1.790 3.819 0.00 0.00 +0.119 HD ATOM 20 H UNK A 0 -2.848 -3.148 2.906 0.00 0.00 +0.119 HD ENDBRANCH 17 18 BRANCH 17 21 ATOM 21 C UNK A 0 -3.263 -0.859 1.444 0.00 0.00 +0.056 C BRANCH 21 22 ATOM 22 C UNK A 0 -2.989 0.168 0.369 0.00 0.00 -0.046 A ATOM 23 C UNK A 0 -3.347 -0.079 -0.963 0.00 0.00 +0.004 A ATOM 24 C UNK A 0 -3.051 0.852 -1.960 0.00 0.00 +0.000 A ATOM 25 C UNK A 0 -2.402 2.041 -1.635 0.00 0.00 +0.000 A ATOM 26 C UNK A 0 -2.053 2.303 -0.312 0.00 0.00 +0.000 A ATOM 27 C UNK A 0 -2.349 1.375 0.686 0.00 0.00 +0.004 A ENDBRANCH 21 22 ENDBRANCH 17 21 ENDBRANCH 1 17 TORSDOF 11