Rotamer Library for HIS
|
---|
Conformation
| Prob (%)
| Average Angles
| PDB
|
---|
Chi1 | Chi2 | Chi1 | Chi2
|
---|
g+ | Ng+ | 2.6106 | 50.7 | 72.7 | PDB
| g+ | Cg- | 1.3153 | 62.5 | 101.7 | PDB
| g+ | Nt | 0.0122 | 67.8 | 171.5 | PDB
| g+ | Cg+ | 2.4954 | 52.7 | 256.1 | PDB
| g+ | Ng- | 1.5761 | 65.1 | 284.0 | PDB
| g+ | Ct | 0.1317 | 63.5 | 357.2 | PDB
| t | Ng+ | 15.0192 | 182.9 | 62.7 | PDB
| t | Cg- | 3.7358 | 191.0 | 103.4 | PDB
| t | Nt | 0.8251 | 190.6 | 187.5 | PDB
| t | Cg+ | 9.5247 | 184.3 | 246.3 | PDB
| t | Ng- | 3.8894 | 193.4 | 288.8 | PDB
| t | Ct | 3.0335 | 191.5 | 367.1 | PDB
| g- | Ng+ | 7.6311 | 283.3 | 70.0 | PDB
| g- | Cg- | 15.9300 | 296.7 | 112.9 | PDB
| g- | Nt | 1.9405 | 291.4 | 172.0 | PDB
| g- | Cg+ | 4.3155 | 285.4 | 251.5 | PDB
| g- | Ng- | 19.9413 | 297.2 | 298.4 | PDB
| g- | Ct | 6.0727 | 289.5 | 351.8 | PDB
| |
Rotamer Definitions for HIS
|
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Angle | Conformation | Start Angle | Stop Angle
|
---|
chi1 | g+ | 0 | 120
| chi1 | t | 120 | 240
| chi1 | g- | 240 | 0
| chi2 | Ng+ | 30 | 90
| chi2 | Cg- | 90 | 150
| chi2 | Nt | 150 | 210
| chi2 | Cg+ | 210 | 270
| chi2 | Ng- | 270 | 330
| chi2 | Ct | 330 | 30
| |