REMARK Name = BDB055484 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.674 -0.220 0.050 0.00 0.00 +0.003 A ATOM 2 C LIG 1 -1.385 0.984 0.240 0.00 0.00 +0.037 A ATOM 3 C LIG 1 -2.782 0.924 0.353 0.00 0.00 +0.068 A ATOM 4 C LIG 1 -3.501 -0.262 0.284 0.00 0.00 +0.041 A ATOM 5 C LIG 1 -4.856 0.131 0.444 0.00 0.00 +0.146 A ATOM 6 N LIG 1 -4.988 1.445 0.592 0.00 0.00 -0.158 NA ATOM 7 C LIG 1 -2.802 -1.465 0.092 0.00 0.00 +0.014 A ATOM 8 N LIG 1 -3.725 1.899 0.538 0.00 0.00 -0.275 N ATOM 9 H LIG 1 -3.573 2.896 0.633 0.00 0.00 +0.189 HD ATOM 10 C LIG 1 -1.403 -1.423 -0.026 0.00 0.00 +0.011 A ENDROOT BRANCH 1 15 ATOM 11 C LIG 1 2.982 0.517 0.421 0.00 0.00 +0.124 A ATOM 12 N LIG 1 3.492 -0.411 -0.400 0.00 0.00 -0.200 NA ATOM 13 C LIG 1 2.633 -1.201 -1.044 0.00 0.00 +0.215 A ATOM 14 N LIG 1 1.308 -1.165 -0.909 0.00 0.00 -0.215 NA ATOM 15 C LIG 1 0.801 -0.235 -0.075 0.00 0.00 +0.078 A ATOM 16 C LIG 1 1.621 0.632 0.622 0.00 0.00 +0.072 A BRANCH 11 18 ATOM 17 C LIG 1 5.245 1.216 0.849 0.00 0.00 +0.127 C ATOM 18 N LIG 1 3.830 1.371 1.154 0.00 0.00 -0.332 N ATOM 19 H LIG 1 3.525 2.332 1.033 0.00 0.00 +0.147 HD ENDBRANCH 11 18 BRANCH 13 20 ATOM 20 N LIG 1 3.159 -2.164 -1.881 0.00 0.00 -0.327 N ATOM 21 H LIG 1 4.099 -2.389 -1.586 0.00 0.00 +0.145 HD ATOM 22 H LIG 1 2.505 -2.928 -1.970 0.00 0.00 +0.145 HD ENDBRANCH 13 20 ENDBRANCH 1 15 BRANCH 5 23 ATOM 23 N LIG 1 -5.902 -0.710 0.431 0.00 0.00 -0.341 N ATOM 24 H LIG 1 -6.809 -0.271 0.313 0.00 0.00 +0.144 HD ATOM 25 H LIG 1 -5.822 -1.593 -0.058 0.00 0.00 +0.144 HD ENDBRANCH 5 23 TORSDOF 4