HIC
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 | 1.02Å | |
| N | H2 | sing | 1.01Å | 1.02Å | |
| CA | C | sing | 1.51Å | 1.53Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CA | HA | sing | 1.09Å | 1.11Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| C | OXT | sing | 1.34Å | 1.32Å | |
| CB | CG | sing | 1.51Å | 1.50Å | |
| CB | HB2 | sing | 1.09Å | 1.12Å | |
| CB | HB3 | sing | 1.09Å | 1.11Å | |
| CG | ND1 | sing | 1.34Å | 1.37Å | Aromatic |
| CG | CD2 | doub | 1.35Å | 1.35Å | Aromatic |
| ND1 | CE1 | doub | 1.31Å | 1.32Å | Aromatic |
| CD2 | NE2 | sing | 1.37Å | 1.39Å | Aromatic |
| CD2 | HD2 | sing | 1.08Å | 1.10Å | |
| CE1 | NE2 | sing | 1.35Å | 1.33Å | Aromatic |
| CE1 | HE1 | sing | 1.08Å | 1.10Å | |
| NE2 | CZ | sing | 1.47Å | 1.45Å | |
| CZ | HZ1 | sing | 1.09Å | 1.11Å | |
| CZ | HZ2 | sing | 1.09Å | 1.12Å | |
| CZ | HZ3 | sing | 1.09Å | 1.11Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 112.0° | 106.7° |
| CA | N | H2 | 111.3° | 106.7° |
| N | CA | C | 112.0° | 109.5° |
| N | CA | CB | 110.5° | 109.5° |
| N | CA | HA | 107.3° | 109.4° |
| H | N | H2 | 111.3° | 106.7° |
| C | CA | CB | 110.1° | 109.5° |
| C | CA | HA | 107.6° | 109.4° |
| CA | C | O | 121.2° | 119.9° |
| CA | C | OXT | 116.6° | 120.1° |
| CB | CA | HA | 109.3° | 109.5° |
| CA | CB | CG | 113.9° | 109.5° |
| CA | CB | HB2 | 110.5° | 109.5° |
| CA | CB | HB3 | 110.5° | 109.5° |
| O | C | OXT | 122.2° | 119.9° |
| C | OXT | HXT | 116.6° | 120.0° |
| CG | CB | HB2 | 110.6° | 109.5° |
| CG | CB | HB3 | 110.6° | 109.5° |
| CB | CG | ND1 | 123.3° | 126.0° |
| CB | CG | CD2 | 131.2° | 126.0° |
| HB2 | CB | HB3 | 99.8° | 109.4° |
| ND1 | CG | CD2 | 105.5° | 108.0° |
| CG | ND1 | CE1 | 109.7° | 109.2° |
| CG | CD2 | NE2 | 108.8° | 106.8° |
| CG | CD2 | HD2 | 124.5° | 126.6° |
| ND1 | CE1 | NE2 | 109.5° | 108.7° |
| ND1 | CE1 | HE1 | 124.7° | 125.7° |
| NE2 | CD2 | HD2 | 126.7° | 126.6° |
| CD2 | NE2 | CE1 | 106.5° | 107.2° |
| CD2 | NE2 | CZ | 124.7° | 126.4° |
| NE2 | CE1 | HE1 | 125.8° | 125.6° |
| CE1 | NE2 | CZ | 128.8° | 126.4° |
| NE2 | CZ | HZ1 | 124.7° | 109.4° |
| NE2 | CZ | HZ2 | 106.8° | 109.5° |
| NE2 | CZ | HZ3 | 106.8° | 109.5° |
| HZ1 | CZ | HZ2 | 106.9° | 109.5° |
| HZ1 | CZ | HZ3 | 106.9° | 109.5° |
| HZ2 | CZ | HZ3 | 102.8° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 125.3° | 113.8° |
| N | CA | C | CB | 123.3° | 120.1° |
| N | CA | C | HA | 117.6° | 119.9° |
| N | CA | CB | HA | 117.8° | 120.0° |
| N | CA | C | O | 145.8° | 30.0° |
| N | CA | C | OXT | 36.1° | 150.0° |
| N | CA | CB | CG | 61.8° | 60.0° |
| N | CA | CB | HB2 | 63.4° | 180.0° |
| N | CA | CB | HB3 | 172.9° | 60.1° |
| H | N | CA | C | 179.9° | 173.8° |
| H | N | CA | CB | 56.9° | 53.7° |
| H | N | CA | HA | 62.1° | 66.2° |
| H2 | N | CA | C | 54.7° | 60.0° |
| H2 | N | CA | CB | 68.5° | 60.0° |
| H2 | N | CA | HA | 172.5° | 180.0° |
| C | CA | CB | HA | 118.0° | 119.9° |
| CA | C | O | OXT | 178.0° | 180.0° |
| C | CA | CB | CG | 173.9° | 179.9° |
| C | CA | CB | HB2 | 60.8° | 59.9° |
| C | CA | CB | HB3 | 48.7° | 60.0° |
| CA | C | OXT | HXT | 179.9° | 180.0° |
| CB | CA | C | O | 22.4° | 90.1° |
| CB | CA | C | OXT | 159.5° | 89.9° |
| CA | CB | CG | HB2 | 125.2° | 120.0° |
| CA | CB | CG | HB3 | 125.2° | 120.0° |
| CA | CB | HB2 | HB3 | 116.4° | 120.0° |
| CA | CB | CG | ND1 | 63.6° | 60.1° |
| CA | CB | CG | CD2 | 116.4° | 120.3° |
| HA | CA | C | O | 96.6° | 150.0° |
| HA | CA | C | OXT | 81.5° | 30.0° |
| HA | CA | CB | CG | 56.0° | 60.0° |
| HA | CA | CB | HB2 | 178.8° | 60.0° |
| HA | CA | CB | HB3 | 69.3° | 180.0° |
| O | C | OXT | HXT | 1.9° | 0.0° |
| CG | CB | HB2 | HB3 | 116.5° | 120.0° |
| CB | CG | ND1 | CD2 | 180.0° | 179.7° |
| CB | CG | ND1 | CE1 | 179.9° | 180.0° |
| CB | CG | CD2 | NE2 | 179.9° | 179.9° |
| CB | CG | CD2 | HD2 | 0.2° | 0.3° |
| HB2 | CB | CG | ND1 | 171.2° | 59.9° |
| HB2 | CB | CG | CD2 | 8.9° | 119.7° |
| HB3 | CB | CG | ND1 | 61.6° | 179.9° |
| HB3 | CB | CG | CD2 | 118.4° | 0.3° |
| ND1 | CG | CD2 | NE2 | 0.1° | 0.5° |
| ND1 | CG | CD2 | HD2 | 179.8° | 179.9° |
| CG | ND1 | CE1 | NE2 | 0.1° | 0.0° |
| CG | ND1 | CE1 | HE1 | 179.9° | 180.0° |
| CD2 | CG | ND1 | CE1 | 0.2° | 0.3° |
| CG | CD2 | NE2 | HD2 | 179.9° | 179.6° |
| CG | CD2 | NE2 | CE1 | 0.1° | 0.4° |
| CG | CD2 | NE2 | CZ | 180.0° | 179.9° |
| ND1 | CE1 | NE2 | CD2 | 0.1° | 0.2° |
| ND1 | CE1 | NE2 | HE1 | 179.9° | 180.0° |
| ND1 | CE1 | NE2 | CZ | 179.9° | 180.0° |
| CD2 | NE2 | CE1 | CZ | 180.0° | 179.7° |
| CD2 | NE2 | CE1 | HE1 | 180.0° | 179.7° |
| CD2 | NE2 | CZ | HZ1 | 180.0° | 90.3° |
| CD2 | NE2 | CZ | HZ2 | 54.7° | 29.7° |
| CD2 | NE2 | CZ | HZ3 | 54.7° | 149.7° |
| HD2 | CD2 | NE2 | CE1 | 179.9° | 179.9° |
| HD2 | CD2 | NE2 | CZ | 0.1° | 0.2° |
| CE1 | NE2 | CZ | HZ1 | 0.0° | 90.1° |
| CE1 | NE2 | CZ | HZ2 | 125.2° | 150.0° |
| CE1 | NE2 | CZ | HZ3 | 125.3° | 29.9° |
| HE1 | CE1 | NE2 | CZ | 0.0° | 0.0° |
| NE2 | CZ | HZ1 | HZ2 | 125.2° | 120.0° |
| NE2 | CZ | HZ1 | HZ3 | 125.2° | 120.0° |
| NE2 | CZ | HZ2 | HZ3 | 112.2° | 120.0° |
| HZ1 | CZ | HZ2 | HZ3 | 112.3° | 120.0° |
