CLT
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CA | CB1 | sing | 1.53Å | 1.53Å | |
CA | CB2 | sing | 1.51Å | 1.49Å | |
CA | HA1 | sing | 1.09Å | 1.12Å | |
CA | HA2 | sing | 1.09Å | 1.11Å | |
CB1 | CG | sing | 1.53Å | 1.46Å | |
CB1 | HB11 | sing | 1.09Å | 1.12Å | |
CB1 | HB12 | sing | 1.09Å | 1.12Å | |
CG | CD | sing | 1.51Å | 1.50Å | |
CG | HG1 | sing | 1.09Å | 1.11Å | |
CG | HG2 | sing | 1.09Å | 1.12Å | |
CD | CE1 | doub | 1.38Å | 1.39Å | Aromatic |
CD | CE2 | sing | 1.38Å | 1.40Å | Aromatic |
CE1 | CZ1 | sing | 1.38Å | 1.38Å | Aromatic |
CE1 | HE1 | sing | 1.08Å | 1.10Å | |
CE2 | CZ2 | doub | 1.38Å | 1.39Å | Aromatic |
CE2 | HE2 | sing | 1.08Å | 1.10Å | |
CZ1 | CH | doub | 1.38Å | 1.42Å | Aromatic |
CZ1 | HZ1 | sing | 1.08Å | 1.10Å | |
CZ2 | CH | sing | 1.38Å | 1.39Å | Aromatic |
CZ2 | HZ2 | sing | 1.08Å | 1.10Å | |
CH | HH | sing | 1.08Å | 1.10Å | |
CB2 | OG1 | doub | 1.21Å | 1.24Å | |
CB2 | OG2 | sing | 1.34Å | 1.25Å | |
OG2 | HO2 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CB1 | CA | CB2 | 104.3° | 109.5° |
CB1 | CA | HA1 | 114.1° | 109.5° |
CB1 | CA | HA2 | 114.2° | 109.5° |
CA | CB1 | CG | 111.4° | 109.4° |
CA | CB1 | HB11 | 111.5° | 109.4° |
CA | CB1 | HB12 | 111.5° | 109.5° |
CB2 | CA | HA1 | 114.2° | 109.5° |
CB2 | CA | HA2 | 114.2° | 109.4° |
CA | CB2 | OG1 | 117.6° | 119.9° |
CA | CB2 | OG2 | 124.0° | 120.1° |
HA1 | CA | HA2 | 96.3° | 109.4° |
CG | CB1 | HB11 | 111.5° | 109.5° |
CG | CB1 | HB12 | 111.5° | 109.5° |
CB1 | CG | CD | 113.1° | 109.4° |
CB1 | CG | HG1 | 110.9° | 109.5° |
CB1 | CG | HG2 | 110.9° | 109.5° |
HB11 | CB1 | HB12 | 98.9° | 109.5° |
CD | CG | HG1 | 110.9° | 109.5° |
CD | CG | HG2 | 110.9° | 109.5° |
CG | CD | CE1 | 117.5° | 120.0° |
CG | CD | CE2 | 122.5° | 120.0° |
HG1 | CG | HG2 | 99.5° | 109.5° |
CE1 | CD | CE2 | 119.2° | 120.0° |
CD | CE1 | CZ1 | 121.4° | 120.0° |
CD | CE1 | HE1 | 119.5° | 120.0° |
CD | CE2 | CZ2 | 120.3° | 120.0° |
CD | CE2 | HE2 | 120.1° | 120.0° |
CZ1 | CE1 | HE1 | 119.1° | 120.0° |
CE1 | CZ1 | CH | 118.4° | 120.0° |
CE1 | CZ1 | HZ1 | 119.7° | 120.0° |
CZ2 | CE2 | HE2 | 119.6° | 120.0° |
CE2 | CZ2 | CH | 119.8° | 120.0° |
CE2 | CZ2 | HZ2 | 120.4° | 120.0° |
CH | CZ1 | HZ1 | 121.9° | 120.0° |
CZ1 | CH | CZ2 | 120.2° | 120.0° |
CZ1 | CH | HH | 121.0° | 120.0° |
CH | CZ2 | HZ2 | 119.8° | 120.0° |
CZ2 | CH | HH | 118.7° | 120.0° |
OG1 | CB2 | OG2 | 118.3° | 120.0° |
CB2 | OG2 | HO2 | 124.0° | 120.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CB1 | CA | CB2 | HA1 | 125.2° | 120.1° |
CB1 | CA | CB2 | HA2 | 125.3° | 120.0° |
CB1 | CA | HA1 | HA2 | 120.0° | 120.0° |
CA | CB1 | CG | HB11 | 125.2° | 119.9° |
CA | CB1 | CG | HB12 | 125.3° | 120.0° |
CA | CB1 | HB11 | HB12 | 117.4° | 120.0° |
CA | CB1 | CG | CD | 177.7° | 180.0° |
CA | CB1 | CG | HG1 | 57.1° | 60.0° |
CA | CB1 | CG | HG2 | 52.4° | 60.0° |
CB1 | CA | CB2 | OG1 | 60.3° | 0.1° |
CB1 | CA | CB2 | OG2 | 117.0° | 179.9° |
CB2 | CA | HA1 | HA2 | 120.1° | 119.9° |
CB2 | CA | CB1 | CG | 119.6° | 179.9° |
CB2 | CA | CB1 | HB11 | 115.2° | 60.0° |
CB2 | CA | CB1 | HB12 | 5.7° | 60.1° |
CA | CB2 | OG1 | OG2 | 177.4° | 179.9° |
CA | CB2 | OG2 | HO2 | 180.0° | 179.9° |
HA1 | CA | CB1 | CG | 115.1° | 60.0° |
HA1 | CA | CB1 | HB11 | 10.1° | 179.9° |
HA1 | CA | CB1 | HB12 | 119.6° | 60.0° |
HA1 | CA | CB2 | OG1 | 65.0° | 120.0° |
HA1 | CA | CB2 | OG2 | 117.8° | 59.9° |
HA2 | CA | CB1 | CG | 5.7° | 60.0° |
HA2 | CA | CB1 | HB11 | 119.5° | 60.0° |
HA2 | CA | CB1 | HB12 | 131.0° | 180.0° |
HA2 | CA | CB2 | OG1 | 174.4° | 120.1° |
HA2 | CA | CB2 | OG2 | 8.3° | 60.1° |
CG | CB1 | HB11 | HB12 | 117.4° | 120.1° |
CB1 | CG | CD | HG1 | 125.3° | 120.0° |
CB1 | CG | CD | HG2 | 125.3° | 120.0° |
CB1 | CG | HG1 | HG2 | 116.8° | 120.0° |
CB1 | CG | CD | CE1 | 102.6° | 90.0° |
CB1 | CG | CD | CE2 | 87.8° | 90.3° |
HB11 | CB1 | CG | CD | 52.5° | 60.1° |
HB11 | CB1 | CG | HG1 | 177.7° | 179.9° |
HB11 | CB1 | CG | HG2 | 72.8° | 59.9° |
HB12 | CB1 | CG | CD | 57.0° | 60.0° |
HB12 | CB1 | CG | HG1 | 68.2° | 60.0° |
HB12 | CB1 | CG | HG2 | 177.8° | 180.0° |
CD | CG | HG1 | HG2 | 116.7° | 120.0° |
CG | CD | CE1 | CE2 | 170.0° | 179.8° |
CG | CD | CE1 | CZ1 | 175.9° | 180.0° |
CG | CD | CE1 | HE1 | 4.1° | 0.0° |
CG | CD | CE2 | CZ2 | 172.5° | 179.8° |
CG | CD | CE2 | HE2 | 7.5° | 0.2° |
HG1 | CG | CD | CE1 | 22.7° | 30.0° |
HG1 | CG | CD | CE2 | 146.9° | 149.7° |
HG2 | CG | CD | CE1 | 132.2° | 150.0° |
HG2 | CG | CD | CE2 | 37.4° | 29.7° |
CD | CE1 | CZ1 | HE1 | 180.0° | 180.0° |
CE1 | CD | CE2 | CZ2 | 3.1° | 0.4° |
CE1 | CD | CE2 | HE2 | 177.0° | 179.9° |
CD | CE1 | CZ1 | CH | 8.8° | 0.0° |
CD | CE1 | CZ1 | HZ1 | 171.2° | 180.0° |
CE2 | CD | CE1 | CZ1 | 5.9° | 0.2° |
CE2 | CD | CE1 | HE1 | 174.1° | 179.7° |
CD | CE2 | CZ2 | HE2 | 180.0° | 179.7° |
CD | CE2 | CZ2 | CH | 3.5° | 0.4° |
CD | CE2 | CZ2 | HZ2 | 176.6° | 179.8° |
CE1 | CZ1 | CH | HZ1 | 180.0° | 180.0° |
CE1 | CZ1 | CH | CZ2 | 9.1° | 0.1° |
CE1 | CZ1 | CH | HH | 170.9° | 179.9° |
HE1 | CE1 | CZ1 | CH | 171.2° | 180.0° |
HE1 | CE1 | CZ1 | HZ1 | 8.8° | 0.1° |
CE2 | CZ2 | CH | CZ1 | 6.5° | 0.1° |
CE2 | CZ2 | CH | HZ2 | 180.0° | 179.9° |
CE2 | CZ2 | CH | HH | 173.5° | 179.9° |
HE2 | CE2 | CZ2 | CH | 176.6° | 180.0° |
HE2 | CE2 | CZ2 | HZ2 | 3.4° | 0.1° |
CZ1 | CH | CZ2 | HH | 180.0° | 180.0° |
CZ1 | CH | CZ2 | HZ2 | 173.5° | 180.0° |
HZ1 | CZ1 | CH | CZ2 | 170.9° | 180.0° |
HZ1 | CZ1 | CH | HH | 9.1° | 0.0° |
HZ2 | CZ2 | CH | HH | 6.5° | 0.0° |
OG1 | CB2 | OG2 | HO2 | 2.8° | 0.1° |