Dipole moment for 1nms: CASPASE-3 TETHERED TO IRREVERSIBLE INHIBITOR

show whole-molecule ChainID = ASpherical CASPASE-3 TETHERED TO IRREVERSIBLE INHIBITOR
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 1940. 240. 268.34 33. 32. 0. 616. 2275. 0.0000 0.3175
No.Dev.Units 0.15 0.10 0.04 0.50 0.21 0.43 0.18 -0.05 0.25 -0.18
Dipole vector (in atomic units): -93.92 77.58 40.04
Mass Moments vector: 514.75 494.90 371.74
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show whole-molecule ChainID = BSpherical CASPASE-3 TETHERED TO IRREVERSIBLE INHIBITOR
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 1940. 240. 268.39 33. 32. 0. 637. 2095. 0.0000 0.3281
No.Dev.Units 0.15 0.10 0.04 0.50 0.21 0.43 0.22 -0.11 0.25 -0.15
Dipole vector (in atomic units): 49.23 -75.81 -96.92
Mass Moments vector: 374.56 495.39 512.43
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Bioinformatics and Biological Computing
Weizmann Institute of Science