ZZD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.46Å | |
| CA | CB | sing | 1.53Å | 1.54Å | |
| CA | C | sing | 1.51Å | 1.55Å | |
| CB | SG | sing | 1.81Å | 1.85Å | |
| C | O | doub | 1.21Å | 1.25Å | |
| C | OXT | sing | 1.34Å | 1.25Å | |
| SG | CAZ | sing | 1.81Å | 1.85Å | |
| CAM | CAG | sing | 1.38Å | 1.40Å | Aromatic |
| CAM | CAV | doub | 1.38Å | 1.40Å | Aromatic |
| CAG | CAD | doub | 1.38Å | 1.40Å | Aromatic |
| CAD | CAH | sing | 1.38Å | 1.40Å | Aromatic |
| CAH | CAN | doub | 1.38Å | 1.40Å | Aromatic |
| CAN | CAV | sing | 1.38Å | 1.39Å | Aromatic |
| CAV | CAZ | sing | 1.51Å | 1.56Å | |
| CAZ | CAX | sing | 1.51Å | 1.52Å | |
| CAZ | CAW | sing | 1.51Å | 1.54Å | |
| CAX | CAQ | sing | 1.38Å | 1.39Å | Aromatic |
| CAX | CAR | doub | 1.38Å | 1.40Å | Aromatic |
| CAQ | CAK | doub | 1.38Å | 1.39Å | Aromatic |
| CAK | CAF | sing | 1.38Å | 1.40Å | Aromatic |
| CAF | CAL | doub | 1.38Å | 1.40Å | Aromatic |
| CAL | CAR | sing | 1.38Å | 1.39Å | Aromatic |
| CAW | CAO | sing | 1.38Å | 1.39Å | Aromatic |
| CAW | CAP | doub | 1.38Å | 1.39Å | Aromatic |
| CAO | CAI | doub | 1.38Å | 1.39Å | Aromatic |
| CAI | CAE | sing | 1.38Å | 1.39Å | Aromatic |
| CAE | CAJ | doub | 1.38Å | 1.39Å | Aromatic |
| CAJ | CAP | sing | 1.38Å | 1.39Å | Aromatic |
| N | HN1 | sing | 1.01Å | 1.00Å | |
| N | HN2 | sing | 1.01Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | HB1C | sing | 1.09Å | 1.10Å | |
| CB | HB2C | sing | 1.09Å | 1.10Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å | |
| CAM | HAM | sing | 1.08Å | 1.08Å | |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAD | HAD | sing | 1.08Å | 1.08Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAN | HAN | sing | 1.08Å | 1.08Å | |
| CAQ | HAQ | sing | 1.08Å | 1.08Å | |
| CAR | HAR | sing | 1.08Å | 1.08Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAL | HAL | sing | 1.08Å | 1.08Å | |
| CAO | HAO | sing | 1.08Å | 1.08Å | |
| CAP | HAP | sing | 1.08Å | 1.08Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N | CA | CB | 108.1° | 109.4° |
| N | CA | C | 108.2° | 109.5° |
| CA | N | HN1 | 109.5° | 111.0° |
| CA | N | HN2 | 109.5° | 111.0° |
| N | CA | HA | 111.9° | 109.5° |
| CB | CA | C | 111.4° | 109.4° |
| CA | CB | SG | 113.7° | 109.5° |
| CB | CA | HA | 108.7° | 109.5° |
| CA | CB | HB1C | 108.0° | 109.5° |
| CA | CB | HB2C | 107.1° | 109.4° |
| CA | C | O | 117.6° | 120.0° |
| CA | C | OXT | 117.6° | 120.0° |
| C | CA | HA | 108.6° | 109.5° |
| CB | SG | CAZ | 105.9° | 103.0° |
| SG | CB | HB1C | 108.1° | 109.5° |
| SG | CB | HB2C | 107.1° | 109.4° |
| O | C | OXT | 124.8° | 120.0° |
| C | OXT | HXT | 109.5° | 117.0° |
| SG | CAZ | CAV | 113.3° | 109.5° |
| SG | CAZ | CAX | 100.8° | 109.5° |
| SG | CAZ | CAW | 108.7° | 109.5° |
| CAG | CAM | CAV | 120.6° | 120.0° |
| CAM | CAG | CAD | 120.0° | 120.0° |
| CAG | CAM | HAM | 119.7° | 120.0° |
| CAM | CAG | HAG | 120.0° | 120.0° |
| CAM | CAV | CAN | 118.4° | 120.0° |
| CAM | CAV | CAZ | 121.5° | 120.0° |
| CAV | CAM | HAM | 119.7° | 120.0° |
| CAG | CAD | CAH | 119.8° | 120.0° |
| CAD | CAG | HAG | 120.0° | 120.0° |
| CAG | CAD | HAD | 120.1° | 120.0° |
| CAD | CAH | CAN | 119.5° | 120.0° |
| CAH | CAD | HAD | 120.1° | 120.0° |
| CAD | CAH | HAH | 120.2° | 120.0° |
| CAH | CAN | CAV | 121.5° | 120.0° |
| CAN | CAH | HAH | 120.3° | 120.0° |
| CAH | CAN | HAN | 119.2° | 120.0° |
| CAN | CAV | CAZ | 120.0° | 120.0° |
| CAV | CAN | HAN | 119.2° | 120.0° |
| CAV | CAZ | CAX | 113.9° | 109.5° |
| CAV | CAZ | CAW | 104.7° | 109.5° |
| CAX | CAZ | CAW | 115.6° | 109.4° |
| CAZ | CAX | CAQ | 118.0° | 120.0° |
| CAZ | CAX | CAR | 120.8° | 120.0° |
| CAZ | CAW | CAO | 119.6° | 120.0° |
| CAZ | CAW | CAP | 121.4° | 120.0° |
| CAQ | CAX | CAR | 120.3° | 120.0° |
| CAX | CAQ | CAK | 119.5° | 120.0° |
| CAX | CAQ | HAQ | 120.2° | 120.0° |
| CAX | CAR | CAL | 119.6° | 120.0° |
| CAX | CAR | HAR | 120.2° | 120.0° |
| CAQ | CAK | CAF | 120.6° | 120.0° |
| CAK | CAQ | HAQ | 120.3° | 120.0° |
| CAQ | CAK | HAK | 119.7° | 120.0° |
| CAK | CAF | CAL | 119.0° | 120.0° |
| CAF | CAK | HAK | 119.7° | 120.0° |
| CAK | CAF | HAF | 120.5° | 120.0° |
| CAF | CAL | CAR | 120.6° | 120.0° |
| CAL | CAF | HAF | 120.5° | 120.0° |
| CAF | CAL | HAL | 119.7° | 120.0° |
| CAL | CAR | HAR | 120.2° | 119.9° |
| CAR | CAL | HAL | 119.7° | 120.0° |
| CAO | CAW | CAP | 118.9° | 120.0° |
| CAW | CAO | CAI | 121.0° | 120.0° |
| CAW | CAO | HAO | 119.5° | 120.0° |
| CAW | CAP | CAJ | 120.5° | 120.0° |
| CAW | CAP | HAP | 119.7° | 120.0° |
| CAO | CAI | CAE | 119.7° | 120.0° |
| CAI | CAO | HAO | 119.5° | 120.0° |
| CAO | CAI | HAI | 120.1° | 120.0° |
| CAI | CAE | CAJ | 119.7° | 120.0° |
| CAE | CAI | HAI | 120.2° | 120.0° |
| CAI | CAE | HAE | 120.1° | 120.0° |
| CAE | CAJ | CAP | 120.1° | 120.0° |
| CAJ | CAE | HAE | 120.1° | 120.0° |
| CAE | CAJ | HAJ | 120.0° | 120.0° |
| CAJ | CAP | HAP | 119.7° | 120.0° |
| CAP | CAJ | HAJ | 119.9° | 120.0° |
| HN1 | N | HN2 | 109.5° | 111.0° |
| HB1C | CB | HB2C | 112.9° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | CA | CB | C | 118.8° | 119.9° |
| N | CA | CB | HA | 121.6° | 120.0° |
| N | CA | C | HA | 121.6° | 120.0° |
| N | CA | CB | SG | 65.3° | 60.0° |
| N | CA | C | O | 177.6° | 19.9° |
| N | CA | C | OXT | 3.1° | 160.0° |
| CA | N | HN1 | HN2 | 120.0° | 123.9° |
| N | CA | CB | HB1C | 54.7° | 60.0° |
| N | CA | CB | HB2C | 176.5° | 180.0° |
| CB | CA | C | HA | 119.7° | 120.0° |
| CA | CB | SG | HB1C | 120.0° | 120.1° |
| CA | CB | SG | HB2C | 118.1° | 120.0° |
| CB | CA | C | O | 63.7° | 100.0° |
| CB | CA | C | OXT | 115.6° | 80.1° |
| CA | CB | SG | CAZ | 164.8° | 178.2° |
| CB | CA | N | HN1 | 165.1° | 176.1° |
| CB | CA | N | HN2 | 74.9° | 60.0° |
| CA | CB | HB1C | HB2C | 118.2° | 120.0° |
| C | CA | CB | SG | 175.9° | 180.0° |
| CA | C | O | OXT | 179.2° | 179.9° |
| C | CA | N | HN1 | 74.1° | 64.0° |
| C | CA | N | HN2 | 45.9° | 60.0° |
| C | CA | CB | HB1C | 64.1° | 60.0° |
| C | CA | CB | HB2C | 57.8° | 60.1° |
| CA | C | OXT | HXT | 179.2° | 180.0° |
| CB | SG | CAZ | CAV | 177.4° | 54.0° |
| CB | SG | CAZ | CAX | 55.3° | 66.0° |
| CB | SG | CAZ | CAW | 66.6° | 174.0° |
| SG | CB | CA | HA | 56.3° | 60.0° |
| SG | CB | HB1C | HB2C | 118.3° | 120.0° |
| O | C | CA | HA | 56.0° | 140.0° |
| O | C | OXT | HXT | 0.0° | 0.1° |
| OXT | C | CA | HA | 124.8° | 39.9° |
| SG | CAZ | CAV | CAM | 161.5° | 64.4° |
| SG | CAZ | CAV | CAN | 22.5° | 115.6° |
| SG | CAZ | CAV | CAX | 114.5° | 120.0° |
| SG | CAZ | CAV | CAW | 118.3° | 120.0° |
| SG | CAZ | CAX | CAW | 117.0° | 120.0° |
| SG | CAZ | CAX | CAQ | 70.5° | 0.6° |
| SG | CAZ | CAX | CAR | 98.6° | 179.2° |
| SG | CAZ | CAW | CAO | 8.6° | 30.1° |
| SG | CAZ | CAW | CAP | 175.1° | 149.6° |
| CAZ | SG | CB | HB1C | 75.2° | 58.1° |
| CAZ | SG | CB | HB2C | 46.7° | 61.8° |
| CAG | CAM | CAV | HAM | 180.0° | 179.7° |
| CAM | CAG | CAD | HAG | 180.0° | 179.9° |
| CAM | CAG | CAD | CAH | 2.4° | 0.0° |
| CAG | CAM | CAV | CAN | 2.1° | 0.0° |
| CAG | CAM | CAV | CAZ | 178.2° | 180.0° |
| CAM | CAG | CAD | HAD | 177.6° | 180.0° |
| CAV | CAM | CAG | CAD | 2.9° | 0.0° |
| CAM | CAV | CAN | CAH | 0.9° | 0.1° |
| CAM | CAV | CAN | CAZ | 176.1° | 180.0° |
| CAM | CAV | CAZ | CAX | 47.0° | 175.6° |
| CAM | CAV | CAZ | CAW | 80.1° | 55.6° |
| CAV | CAM | CAG | HAG | 177.1° | 180.0° |
| CAM | CAV | CAN | HAN | 179.1° | 180.0° |
| CAG | CAD | CAH | HAD | 180.0° | 179.9° |
| CAG | CAD | CAH | CAN | 1.2° | 0.0° |
| CAD | CAG | CAM | HAM | 177.1° | 179.7° |
| CAG | CAD | CAH | HAH | 178.8° | 179.9° |
| CAD | CAH | CAN | HAH | 180.0° | 179.9° |
| CAD | CAH | CAN | CAV | 0.5° | 0.1° |
| CAH | CAD | CAG | HAG | 177.6° | 180.0° |
| CAD | CAH | CAN | HAN | 179.6° | 180.0° |
| CAH | CAN | CAV | HAN | 180.0° | 180.0° |
| CAH | CAN | CAV | CAZ | 177.0° | 180.0° |
| CAN | CAH | CAD | HAD | 178.8° | 179.9° |
| CAN | CAV | CAZ | CAX | 137.0° | 4.4° |
| CAN | CAV | CAZ | CAW | 95.8° | 124.3° |
| CAN | CAV | CAM | HAM | 177.9° | 179.8° |
| CAV | CAN | CAH | HAH | 179.5° | 179.9° |
| CAV | CAZ | CAX | CAW | 121.3° | 120.0° |
| CAV | CAZ | CAX | CAQ | 51.2° | 119.5° |
| CAV | CAZ | CAX | CAR | 139.7° | 60.8° |
| CAV | CAZ | CAW | CAO | 112.7° | 150.1° |
| CAV | CAZ | CAW | CAP | 63.5° | 29.6° |
| CAZ | CAV | CAM | HAM | 1.8° | 0.3° |
| CAZ | CAV | CAN | HAN | 3.0° | 0.0° |
| CAZ | CAX | CAQ | CAR | 169.2° | 179.8° |
| CAZ | CAX | CAQ | CAK | 176.7° | 180.0° |
| CAZ | CAX | CAR | CAL | 173.8° | 179.8° |
| CAX | CAZ | CAW | CAO | 121.1° | 89.9° |
| CAX | CAZ | CAW | CAP | 62.7° | 90.4° |
| CAZ | CAX | CAQ | HAQ | 3.3° | 0.1° |
| CAZ | CAX | CAR | HAR | 6.2° | 0.0° |
| CAW | CAZ | CAX | CAQ | 172.5° | 120.6° |
| CAW | CAZ | CAX | CAR | 18.4° | 59.2° |
| CAZ | CAW | CAO | CAP | 176.3° | 179.7° |
| CAZ | CAW | CAO | CAI | 178.5° | 180.0° |
| CAZ | CAW | CAP | CAJ | 177.0° | 179.8° |
| CAZ | CAW | CAO | HAO | 1.5° | 0.0° |
| CAZ | CAW | CAP | HAP | 3.0° | 0.1° |
| CAX | CAQ | CAK | HAQ | 180.0° | 180.0° |
| CAX | CAQ | CAK | CAF | 6.8° | 0.0° |
| CAQ | CAX | CAR | CAL | 4.9° | 0.4° |
| CAQ | CAX | CAR | HAR | 175.1° | 179.8° |
| CAX | CAQ | CAK | HAK | 173.2° | 180.0° |
| CAR | CAX | CAQ | CAK | 7.5° | 0.2° |
| CAX | CAR | CAL | CAF | 1.6° | 0.4° |
| CAX | CAR | CAL | HAR | 180.0° | 179.8° |
| CAR | CAX | CAQ | HAQ | 172.5° | 179.7° |
| CAX | CAR | CAL | HAL | 178.4° | 179.8° |
| CAQ | CAK | CAF | HAK | 180.0° | 180.0° |
| CAQ | CAK | CAF | CAL | 3.5° | 0.0° |
| CAQ | CAK | CAF | HAF | 176.5° | 180.0° |
| CAK | CAF | CAL | HAF | 180.0° | 180.0° |
| CAK | CAF | CAL | CAR | 0.9° | 0.2° |
| CAF | CAK | CAQ | HAQ | 173.2° | 179.9° |
| CAK | CAF | CAL | HAL | 179.1° | 180.0° |
| CAF | CAL | CAR | HAL | 180.0° | 179.8° |
| CAF | CAL | CAR | HAR | 178.4° | 179.8° |
| CAL | CAF | CAK | HAK | 176.5° | 180.0° |
| CAR | CAL | CAF | HAF | 179.1° | 179.8° |
| CAW | CAO | CAI | HAO | 180.0° | 180.0° |
| CAW | CAO | CAI | CAE | 1.3° | 0.0° |
| CAO | CAW | CAP | CAJ | 0.7° | 0.5° |
| CAO | CAW | CAP | HAP | 179.3° | 179.7° |
| CAW | CAO | CAI | HAI | 178.7° | 180.0° |
| CAP | CAW | CAO | CAI | 2.1° | 0.3° |
| CAW | CAP | CAJ | CAE | 1.5° | 0.5° |
| CAW | CAP | CAJ | HAP | 180.0° | 179.7° |
| CAP | CAW | CAO | HAO | 177.9° | 179.7° |
| CAW | CAP | CAJ | HAJ | 178.5° | 179.8° |
| CAO | CAI | CAE | HAI | 180.0° | 180.0° |
| CAO | CAI | CAE | CAJ | 1.0° | 0.0° |
| CAO | CAI | CAE | HAE | 179.0° | 180.0° |
| CAI | CAE | CAJ | HAE | 180.0° | 180.0° |
| CAI | CAE | CAJ | CAP | 2.4° | 0.2° |
| CAE | CAI | CAO | HAO | 178.7° | 180.0° |
| CAI | CAE | CAJ | HAJ | 177.6° | 180.0° |
| CAE | CAJ | CAP | HAJ | 180.0° | 179.8° |
| CAE | CAJ | CAP | HAP | 178.4° | 179.8° |
| CAJ | CAE | CAI | HAI | 179.0° | 180.0° |
| CAP | CAJ | CAE | HAE | 177.6° | 179.8° |
| HN1 | N | CA | HA | 45.5° | 56.1° |
| HN2 | N | CA | HA | 165.5° | 179.9° |
| HA | CA | CB | HB1C | 176.3° | 180.0° |
| HA | CA | CB | HB2C | 61.8° | 60.0° |
| HAM | CAM | CAG | HAG | 2.9° | 0.2° |
| HAG | CAG | CAD | HAD | 2.4° | 0.1° |
| HAD | CAD | CAH | HAH | 1.2° | 0.0° |
| HAH | CAH | CAN | HAN | 0.4° | 0.1° |
| HAQ | CAQ | CAK | HAK | 6.8° | 0.0° |
| HAR | CAR | CAL | HAL | 1.6° | 0.0° |
| HAK | CAK | CAF | HAF | 3.5° | 0.1° |
| HAF | CAF | CAL | HAL | 0.9° | 0.0° |
| HAO | CAO | CAI | HAI | 1.3° | 0.0° |
| HAP | CAP | CAJ | HAJ | 1.6° | 0.0° |
| HAI | CAI | CAE | HAE | 1.0° | 0.0° |
| HAE | CAE | CAJ | HAJ | 2.4° | 0.0° |
