3EB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | O | sing | 1.34Å | 1.29Å | |
| C | CA | sing | 1.51Å | 1.50Å | |
| C | OXT | doub | 1.21Å | 1.24Å | |
| CA | C2 | sing | 1.53Å | 1.54Å | |
| OAB | CAL | doub | 1.22Å | 1.25Å | |
| OAD | CAL | sing | 1.35Å | 1.29Å | |
| CAE | CAF | sing | 1.38Å | 1.39Å | Aromatic |
| CAE | CAG | doub | 1.38Å | 1.39Å | Aromatic |
| CAF | CAH | doub | 1.38Å | 1.38Å | Aromatic |
| CAG | CAM | sing | 1.38Å | 1.39Å | Aromatic |
| CAG | C2 | sing | 1.51Å | 1.52Å | |
| CAH | CAN | sing | 1.40Å | 1.39Å | Aromatic |
| CAL | CAN | sing | 1.48Å | 1.50Å | |
| CAM | CAN | doub | 1.40Å | 1.39Å | Aromatic |
| O | H | sing | 0.97Å | 0.95Å | |
| CA | HA1C | sing | 1.09Å | 1.10Å | |
| CA | HA2C | sing | 1.09Å | 1.10Å | |
| C2 | H21C | sing | 1.09Å | 1.10Å | |
| C2 | H22C | sing | 1.09Å | 1.10Å | |
| OAD | HAD | sing | 0.97Å | 0.95Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAM | HAM | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | CA | 115.4° | 120.0° |
| O | C | OXT | 122.2° | 120.0° |
| C | O | H | 109.5° | 117.1° |
| CA | C | OXT | 122.4° | 120.0° |
| C | CA | C2 | 112.3° | 109.4° |
| C | CA | HA1C | 108.8° | 109.4° |
| C | CA | HA2C | 108.8° | 109.5° |
| CA | C2 | CAG | 116.1° | 109.4° |
| C2 | CA | HA1C | 108.7° | 109.5° |
| C2 | CA | HA2C | 108.7° | 109.5° |
| CA | C2 | H21C | 107.8° | 109.5° |
| CA | C2 | H22C | 107.8° | 109.5° |
| OAB | CAL | OAD | 121.9° | 120.0° |
| OAB | CAL | CAN | 120.6° | 120.0° |
| OAD | CAL | CAN | 117.4° | 120.0° |
| CAL | OAD | HAD | 109.5° | 117.0° |
| CAF | CAE | CAG | 120.6° | 120.3° |
| CAE | CAF | CAH | 120.4° | 120.1° |
| CAF | CAE | HAE | 119.7° | 119.8° |
| CAE | CAF | HAF | 119.8° | 120.0° |
| CAE | CAG | CAM | 118.3° | 120.2° |
| CAE | CAG | C2 | 122.1° | 119.9° |
| CAG | CAE | HAE | 119.7° | 119.9° |
| CAF | CAH | CAN | 120.2° | 119.8° |
| CAH | CAF | HAF | 119.8° | 119.9° |
| CAF | CAH | HAH | 119.9° | 120.1° |
| CAM | CAG | C2 | 119.6° | 119.9° |
| CAG | CAM | CAN | 121.6° | 119.8° |
| CAG | CAM | HAM | 119.2° | 120.1° |
| CAG | C2 | H21C | 107.8° | 109.4° |
| CAG | C2 | H22C | 107.8° | 109.4° |
| CAH | CAN | CAL | 121.0° | 120.1° |
| CAH | CAN | CAM | 118.9° | 119.7° |
| CAN | CAH | HAH | 119.9° | 120.1° |
| CAL | CAN | CAM | 120.1° | 120.2° |
| CAN | CAM | HAM | 119.2° | 120.1° |
| HA1C | CA | HA2C | 109.5° | 109.6° |
| H21C | C2 | H22C | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | CA | OXT | 177.9° | 179.7° |
| O | C | CA | C2 | 140.3° | 180.0° |
| O | C | CA | HA1C | 99.3° | 60.1° |
| O | C | CA | HA2C | 19.9° | 60.0° |
| C | CA | C2 | HA1C | 120.4° | 119.9° |
| C | CA | C2 | HA2C | 120.4° | 120.0° |
| C | CA | C2 | CAG | 65.3° | 180.0° |
| CA | C | O | H | 177.9° | 179.9° |
| C | CA | HA1C | HA2C | 118.7° | 120.0° |
| C | CA | C2 | H21C | 55.7° | 60.0° |
| C | CA | C2 | H22C | 173.8° | 60.0° |
| OXT | C | CA | C2 | 41.8° | 0.3° |
| OXT | C | O | H | 0.0° | 0.2° |
| OXT | C | CA | HA1C | 78.6° | 120.3° |
| OXT | C | CA | HA2C | 162.3° | 119.7° |
| CA | C2 | CAG | CAE | 34.6° | 90.0° |
| CA | C2 | CAG | CAM | 147.6° | 90.0° |
| CA | C2 | CAG | H21C | 121.0° | 120.0° |
| CA | C2 | CAG | H22C | 121.0° | 120.0° |
| C2 | CA | HA1C | HA2C | 118.7° | 120.1° |
| CA | C2 | H21C | H22C | 117.0° | 120.1° |
| OAB | CAL | OAD | CAN | 176.1° | 180.0° |
| OAB | CAL | CAN | CAH | 165.6° | 180.0° |
| OAB | CAL | CAN | CAM | 14.0° | 0.0° |
| OAB | CAL | OAD | HAD | 0.0° | 0.1° |
| OAD | CAL | CAN | CAH | 10.6° | 0.0° |
| OAD | CAL | CAN | CAM | 169.8° | 179.9° |
| CAF | CAE | CAG | HAE | 180.0° | 179.7° |
| CAE | CAF | CAH | HAF | 180.0° | 179.9° |
| CAF | CAE | CAG | CAM | 0.5° | 0.0° |
| CAF | CAE | CAG | C2 | 177.3° | 180.0° |
| CAE | CAF | CAH | CAN | 2.0° | 0.0° |
| CAE | CAF | CAH | HAH | 178.0° | 179.9° |
| CAG | CAE | CAF | CAH | 0.4° | 0.0° |
| CAE | CAG | CAM | C2 | 177.9° | 180.0° |
| CAE | CAG | CAM | CAN | 0.1° | 0.1° |
| CAE | CAG | C2 | H21C | 155.6° | 30.0° |
| CAE | CAG | C2 | H22C | 86.4° | 150.0° |
| CAG | CAE | CAF | HAF | 179.6° | 180.0° |
| CAE | CAG | CAM | HAM | 179.9° | 180.0° |
| CAF | CAH | CAN | HAH | 180.0° | 180.0° |
| CAF | CAH | CAN | CAL | 176.9° | 180.0° |
| CAF | CAH | CAN | CAM | 2.7° | 0.0° |
| CAH | CAF | CAE | HAE | 179.6° | 179.7° |
| CAG | CAM | CAN | CAH | 1.8° | 0.1° |
| CAG | CAM | CAN | CAL | 177.8° | 180.0° |
| CAG | CAM | CAN | HAM | 180.0° | 180.0° |
| CAM | CAG | C2 | H21C | 26.7° | 150.0° |
| CAM | CAG | C2 | H22C | 91.4° | 29.9° |
| CAM | CAG | CAE | HAE | 179.4° | 179.7° |
| C2 | CAG | CAM | CAN | 178.0° | 180.0° |
| CAG | C2 | CA | HA1C | 174.3° | 60.1° |
| CAG | C2 | CA | HA2C | 55.2° | 60.0° |
| CAG | C2 | H21C | H22C | 117.0° | 120.0° |
| C2 | CAG | CAE | HAE | 2.8° | 0.3° |
| C2 | CAG | CAM | HAM | 2.0° | 0.0° |
| CAH | CAN | CAL | CAM | 179.5° | 179.9° |
| CAN | CAH | CAF | HAF | 177.9° | 180.0° |
| CAH | CAN | CAM | HAM | 178.3° | 180.0° |
| CAN | CAL | OAD | HAD | 176.1° | 180.0° |
| CAL | CAN | CAH | HAH | 3.1° | 0.1° |
| CAL | CAN | CAM | HAM | 2.2° | 0.0° |
| CAM | CAN | CAH | HAH | 177.3° | 180.0° |
| HA1C | CA | C2 | H21C | 64.8° | 180.0° |
| HA1C | CA | C2 | H22C | 53.3° | 59.9° |
| HA2C | CA | C2 | H21C | 176.1° | 59.9° |
| HA2C | CA | C2 | H22C | 65.8° | NaN° |
| HAE | CAE | CAF | HAF | 0.4° | 0.3° |
| HAF | CAF | CAH | HAH | 2.0° | 0.0° |
