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Hydrogen bonds with H..A < r(A) + 2.000 Angstroms and D-H d(D-H) d(H..A) O1-H1A 0.745 2.412 164.72 3.137 Cl1 [ x-1, y, z ] O14-H4A 0.910 ------------------------------------------------------------------------------ Alternative approximate positions for H attached to O14: 0.4896 0.3953 0.9345 O..Cl1 [ -x+2, -y+1, -z+1 ] 3.411 O14-H4B 0.834 0.834 179.97 1.667 O14 [ -x+1, -y+1, -z+2 ] FMAP and GRID set by program ÕâÊÇÒ»¸öË®µÄ¼ÓÇâ²»¶Ô£¬Ó¦¸ÃÔõô°ì°¡£¬±¾È˲»ÊǺܻá½âÎö¾§Ì壬Çó°ïÖú |
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