Dynameomics - Rotamers

Aspartic Acid (ASP)

Rotamer Library for ASP
Conformation		Prob (%)	Average Angles		PDB
Chi1	Chi2	Prob (%)	Chi1	Chi2	PDB
g+	g+	2.2512	61.6	70.8	PDB
g+	t	0.4607	63.6	176.0	PDB
g+	g-	3.2774	74.0	110.5	PDB
t	g+	62.8026	182.2	62.3	PDB
t	t	7.8928	188.0	188.8	PDB
t	g-	12.9803	194.2	107.4	PDB
g-	g+	2.5229	276.6	69.0	PDB
g-	t	1.6639	282.4	174.3	PDB
g-	g-	6.1482	285.5	115.3	PDB

Rotamer Definitions for ASP
Angle	Conformation	Start Angle	Stop Angle
chi1	g+	0	120
chi1	t	120	240
chi1	g-	240	0
chi2	g+	30	90
chi2	g-	90	150
chi2	t	150	210
chi2	g+	210	270
chi2	g-	270	330
chi2	t	330	30