TBG
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N | CA | sing | 1.47Å | 1.46Å | |
N | H | sing | 1.01Å | 1.00Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
CA | CB | sing | 1.53Å | 1.55Å | |
CA | C | sing | 1.51Å | 1.54Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
CB | CG1 | sing | 1.53Å | 1.52Å | |
CB | CG2 | sing | 1.53Å | 1.53Å | |
CB | CG3 | sing | 1.53Å | 1.50Å | |
CG1 | HG11 | sing | 1.09Å | 1.10Å | |
CG1 | HG12 | sing | 1.09Å | 1.10Å | |
CG1 | HG13 | sing | 1.09Å | 1.10Å | |
CG2 | HG21 | sing | 1.09Å | 1.10Å | |
CG2 | HG22 | sing | 1.09Å | 1.10Å | |
CG2 | HG23 | sing | 1.09Å | 1.10Å | |
CG3 | HG31 | sing | 1.09Å | 1.10Å | |
CG3 | HG32 | sing | 1.09Å | 1.10Å | |
CG3 | HG33 | sing | 1.09Å | 1.10Å | |
C | O | doub | 1.21Å | 1.24Å | |
C | OXT | sing | 1.34Å | 1.33Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CA | N | H | 109.5° | 111.1° |
CA | N | H2 | 109.5° | 111.0° |
N | CA | CB | 111.5° | 109.4° |
N | CA | C | 110.0° | 109.4° |
N | CA | HA | 108.6° | 109.5° |
H | N | H2 | 109.5° | 111.0° |
CB | CA | C | 112.0° | 109.5° |
CB | CA | HA | 106.5° | 109.4° |
CA | CB | CG1 | 109.9° | 109.5° |
CA | CB | CG2 | 110.3° | 109.5° |
CA | CB | CG3 | 109.6° | 109.5° |
C | CA | HA | 108.0° | 109.5° |
CA | C | O | 121.3° | 120.0° |
CA | C | OXT | 115.5° | 120.0° |
CG1 | CB | CG2 | 110.6° | 109.4° |
CG1 | CB | CG3 | 108.4° | 109.5° |
CB | CG1 | HG11 | 109.5° | 109.4° |
CB | CG1 | HG12 | 109.4° | 109.5° |
CB | CG1 | HG13 | 109.5° | 109.4° |
CG2 | CB | CG3 | 108.0° | 109.4° |
CB | CG2 | HG21 | 109.5° | 109.4° |
CB | CG2 | HG22 | 109.4° | 109.5° |
CB | CG2 | HG23 | 109.4° | 109.5° |
CB | CG3 | HG31 | 109.5° | 109.4° |
CB | CG3 | HG32 | 109.4° | 109.5° |
CB | CG3 | HG33 | 109.5° | 109.5° |
HG11 | CG1 | HG12 | 109.4° | 109.5° |
HG11 | CG1 | HG13 | 109.5° | 109.5° |
HG12 | CG1 | HG13 | 109.5° | 109.5° |
HG21 | CG2 | HG22 | 109.5° | 109.5° |
HG21 | CG2 | HG23 | 109.5° | 109.5° |
HG22 | CG2 | HG23 | 109.5° | 109.5° |
HG31 | CG3 | HG32 | 109.5° | 109.5° |
HG31 | CG3 | HG33 | 109.5° | 109.5° |
HG32 | CG3 | HG33 | 109.5° | 109.5° |
O | C | OXT | 123.3° | 120.0° |
C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CA | N | H | H2 | 120.0° | 123.9° |
N | CA | CB | C | 123.8° | 119.9° |
N | CA | CB | HA | 118.3° | 120.0° |
N | CA | C | HA | 118.5° | 120.1° |
N | CA | CB | CG1 | 54.7° | 60.0° |
N | CA | CB | CG2 | 176.9° | 180.0° |
N | CA | CB | CG3 | 64.4° | 60.0° |
N | CA | C | O | 49.4° | 20.0° |
N | CA | C | OXT | 129.1° | 160.0° |
H | N | CA | CB | 180.0° | 60.0° |
H | N | CA | C | 55.1° | 60.0° |
H | N | CA | HA | 63.0° | 179.9° |
H2 | N | CA | CB | 60.0° | 64.0° |
H2 | N | CA | C | 64.9° | 176.0° |
H2 | N | CA | HA | 177.0° | 56.0° |
CB | CA | C | HA | 117.0° | 120.0° |
CA | CB | CG1 | CG2 | 122.0° | 120.0° |
CA | CB | CG1 | CG3 | 119.8° | 120.1° |
CA | CB | CG2 | CG3 | 119.7° | 120.0° |
CA | CB | CG1 | HG11 | 180.0° | 59.9° |
CA | CB | CG1 | HG12 | 60.0° | 180.0° |
CA | CB | CG1 | HG13 | 60.0° | 60.0° |
CA | CB | CG2 | HG21 | 180.0° | 60.0° |
CA | CB | CG2 | HG22 | 60.0° | 180.0° |
CA | CB | CG2 | HG23 | 60.0° | 60.0° |
CA | CB | CG3 | HG31 | 180.0° | 60.0° |
CA | CB | CG3 | HG32 | 60.0° | 180.0° |
CA | CB | CG3 | HG33 | 60.0° | 59.9° |
CB | CA | C | O | 75.2° | 100.0° |
CB | CA | C | OXT | 106.3° | 80.0° |
C | CA | CB | CG1 | 69.1° | 59.9° |
C | CA | CB | CG2 | 53.1° | 60.0° |
C | CA | CB | CG3 | 171.8° | 180.0° |
CA | C | O | OXT | 178.4° | 180.0° |
CA | C | OXT | HXT | 178.4° | 180.0° |
HA | CA | CB | CG1 | 173.0° | 180.0° |
HA | CA | CB | CG2 | 64.8° | 60.0° |
HA | CA | CB | CG3 | 53.9° | 60.0° |
HA | CA | C | O | 167.9° | 140.0° |
HA | CA | C | OXT | 10.6° | 40.0° |
CG1 | CB | CG2 | CG3 | 118.5° | 119.9° |
CB | CG1 | HG11 | HG12 | 120.0° | 120.0° |
CB | CG1 | HG11 | HG13 | 120.0° | 119.9° |
CB | CG1 | HG12 | HG13 | 120.0° | 120.0° |
CG1 | CB | CG2 | HG21 | 58.2° | 180.0° |
CG1 | CB | CG2 | HG22 | 61.8° | 60.0° |
CG1 | CB | CG2 | HG23 | 178.2° | 60.0° |
CG1 | CB | CG3 | HG31 | 60.0° | 60.1° |
CG1 | CB | CG3 | HG32 | 180.0° | 59.9° |
CG1 | CB | CG3 | HG33 | 60.0° | 180.0° |
CG2 | CB | CG1 | HG11 | 58.0° | 60.1° |
CG2 | CB | CG1 | HG12 | 178.0° | 60.0° |
CG2 | CB | CG1 | HG13 | 62.0° | 180.0° |
CB | CG2 | HG21 | HG22 | 120.0° | 120.1° |
CB | CG2 | HG21 | HG23 | 120.0° | 120.0° |
CB | CG2 | HG22 | HG23 | 120.0° | 120.0° |
CG2 | CB | CG3 | HG31 | 59.9° | 180.0° |
CG2 | CB | CG3 | HG32 | 60.1° | 60.0° |
CG2 | CB | CG3 | HG33 | 179.9° | 60.1° |
CG3 | CB | CG1 | HG11 | 60.2° | 180.0° |
CG3 | CB | CG1 | HG12 | 59.8° | 59.9° |
CG3 | CB | CG1 | HG13 | 179.8° | 60.1° |
CG3 | CB | CG2 | HG21 | 60.3° | 60.1° |
CG3 | CB | CG2 | HG22 | 179.7° | 60.0° |
CG3 | CB | CG2 | HG23 | 59.7° | 180.0° |
CB | CG3 | HG31 | HG32 | 120.0° | 120.0° |
CB | CG3 | HG31 | HG33 | 120.0° | 120.0° |
CB | CG3 | HG32 | HG33 | 120.0° | 120.0° |
HG11 | CG1 | HG12 | HG13 | 120.0° | 120.1° |
HG21 | CG2 | HG22 | HG23 | 120.0° | 120.0° |
HG31 | CG3 | HG32 | HG33 | 120.0° | 120.0° |
O | C | OXT | HXT | 0.0° | 0.0° |