Dipole moment for 1o1l: DEOXY HEMOGLOBIN (A-GLY-C:V1M,L29W,H58Q; B,D:V1M)

show whole-molecule ChainID = AElongated DEOXY HEMOGLOBIN (A-GLY-C:V1M,L29W,H58Q; B,D:V1M)
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 2152. 283. 331.60 28. 24. 4. 152. 3245. 0.0019 0.0705
No.Dev.Units 0.33 0.39 0.46 0.20 -0.20 0.95 -0.94 0.24 0.57 -1.06
Dipole vector (in atomic units): 4.32 28.39 -13.12
Mass Moments vector: 704.02 409.43 571.25
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show whole-molecule ChainID = BSpherical DEOXY HEMOGLOBIN (A-GLY-C:V1M,L29W,H58Q; B,D:V1M)
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 1124. 146. 169.79 14. 15. -1. 204. 1829.-0.0009 0.1814
No.Dev.Units -0.55 -0.53 -0.61 -0.64 -0.66 0.30 -0.81 -0.19 0.09 -0.67
Dipole vector (in atomic units): 7.84 -37.85 -17.54
Mass Moments vector: 286.03 304.35 291.57
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show whole-molecule ChainID = DSpherical DEOXY HEMOGLOBIN (A-GLY-C:V1M,L29W,H58Q; B,D:V1M)
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 1124. 146. 169.92 14. 15. -1. 220. 1489.-0.0009 0.1955
No.Dev.Units -0.55 -0.53 -0.61 -0.64 -0.66 0.30 -0.77 -0.29 0.09 -0.62
Dipole vector (in atomic units): -29.36 -22.72 26.75
Mass Moments vector: 270.25 294.95 315.95
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Bioinformatics and Biological Computing
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