CHG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.48Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| C1 | CA | sing | 1.53Å | 1.41Å | |
| CA | C | sing | 1.51Å | 1.55Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| O | C | doub | 1.21Å | 1.27Å | |
| C | OXT | sing | 1.34Å | 1.49Å | |
| C6 | C1 | sing | 1.53Å | 1.44Å | |
| C2 | C1 | sing | 1.53Å | 1.50Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | C2 | sing | 1.53Å | 1.46Å | |
| C2 | H2B | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C4 | C3 | sing | 1.53Å | 1.46Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C4 | C5 | sing | 1.53Å | 1.46Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C5 | C6 | sing | 1.53Å | 1.43Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| 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° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | C1 | 109.8° | 109.5° |
| N | CA | C | 109.6° | 109.5° |
| N | CA | HA | 108.7° | 109.5° |
| H | N | H2 | 109.5° | 111.1° |
| C1 | CA | C | 108.1° | 109.5° |
| C1 | CA | HA | 110.2° | 109.4° |
| CA | C1 | C6 | 108.9° | 109.5° |
| CA | C1 | C2 | 110.8° | 109.5° |
| CA | C1 | H1 | 110.3° | 109.5° |
| C | CA | HA | 110.4° | 109.5° |
| CA | C | O | 124.4° | 120.0° |
| CA | C | OXT | 113.9° | 120.0° |
| O | C | OXT | 120.6° | 120.0° |
| C | OXT | HXT | 109.5° | 117.0° |
| C6 | C1 | C2 | 112.9° | 109.5° |
| C6 | C1 | H1 | 108.0° | 109.5° |
| C1 | C6 | C5 | 111.7° | 109.5° |
| C1 | C6 | H6 | 108.7° | 109.5° |
| C1 | C6 | H6A | 108.2° | 109.5° |
| C2 | C1 | H1 | 106.0° | 109.4° |
| C1 | C2 | C3 | 109.3° | 109.5° |
| C1 | C2 | H2B | 109.5° | 109.5° |
| C1 | C2 | H2A | 109.6° | 109.4° |
| C3 | C2 | H2B | 109.5° | 109.5° |
| C3 | C2 | H2A | 109.6° | 109.5° |
| C2 | C3 | C4 | 109.4° | 109.5° |
| C2 | C3 | H3 | 109.5° | 109.4° |
| C2 | C3 | H3A | 109.6° | 109.5° |
| H2B | C2 | H2A | 109.3° | 109.5° |
| C4 | C3 | H3 | 109.5° | 109.5° |
| C4 | C3 | H3A | 109.5° | 109.5° |
| C3 | C4 | C5 | 106.7° | 109.5° |
| C3 | C4 | H4 | 110.4° | 109.5° |
| C3 | C4 | H4A | 111.0° | 109.4° |
| H3 | C3 | H3A | 109.4° | 109.4° |
| C5 | C4 | H4 | 110.4° | 109.5° |
| C5 | C4 | H4A | 111.0° | 109.4° |
| C4 | C5 | C6 | 108.0° | 109.5° |
| C4 | C5 | H5 | 110.0° | 109.4° |
| C4 | C5 | H5A | 110.3° | 109.4° |
| H4 | C4 | H4A | 107.4° | 109.5° |
| C6 | C5 | H5 | 110.0° | 109.5° |
| C6 | C5 | H5A | 110.3° | 109.5° |
| C5 | C6 | H6 | 108.7° | 109.5° |
| C5 | C6 | H6A | 108.2° | 109.5° |
| H5 | C5 | H5A | 108.4° | 109.5° |
| H6 | C6 | H6A | 111.2° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 120.0° | 124.0° |
| N | CA | C1 | C | 119.6° | 120.0° |
| N | CA | C1 | HA | 119.7° | 120.0° |
| N | CA | C | HA | 119.7° | 120.0° |
| N | CA | C | O | 87.0° | 20.0° |
| N | CA | C | OXT | 81.2° | 160.0° |
| N | CA | C1 | C6 | 49.1° | 60.0° |
| N | CA | C1 | C2 | 75.6° | 60.0° |
| N | CA | C1 | H1 | 167.4° | 180.0° |
| H | N | CA | C1 | 166.5° | 176.0° |
| H | N | CA | C | 74.9° | 64.0° |
| H | N | CA | HA | 45.9° | 56.1° |
| H2 | N | CA | C1 | 73.5° | 60.0° |
| H2 | N | CA | C | 45.2° | 60.1° |
| H2 | N | CA | HA | 165.9° | 179.9° |
| C1 | CA | C | HA | 120.6° | 120.0° |
| C1 | CA | C | O | 32.6° | 100.0° |
| C1 | CA | C | OXT | 159.1° | 80.0° |
| CA | C1 | C6 | C2 | 123.4° | 120.0° |
| CA | C1 | C6 | H1 | 119.7° | 120.0° |
| CA | C1 | C2 | H1 | 119.6° | 120.0° |
| CA | C1 | C2 | C3 | 171.3° | 180.0° |
| CA | C1 | C2 | H2B | 68.7° | 60.0° |
| CA | C1 | C2 | H2A | 51.2° | 60.0° |
| CA | C1 | C6 | C5 | 175.0° | 180.0° |
| CA | C1 | C6 | H6 | 55.0° | 60.0° |
| CA | C1 | C6 | H6A | 66.0° | 60.0° |
| CA | C | O | OXT | 167.5° | 180.0° |
| C | CA | C1 | C6 | 70.4° | 60.0° |
| C | CA | C1 | C2 | 164.8° | 180.0° |
| C | CA | C1 | H1 | 47.8° | 60.0° |
| CA | C | OXT | HXT | 168.8° | 180.0° |
| HA | CA | C | O | 153.2° | 140.0° |
| HA | CA | C | OXT | 38.5° | 40.0° |
| HA | CA | C1 | C6 | 168.8° | 180.0° |
| HA | CA | C1 | C2 | 44.1° | 60.0° |
| HA | CA | C1 | H1 | 72.9° | 60.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| C6 | C1 | C2 | H1 | 118.0° | 120.0° |
| C6 | C1 | C2 | C3 | 48.9° | 60.0° |
| C6 | C1 | C2 | H2B | 168.9° | 180.0° |
| C6 | C1 | C2 | H2A | 71.2° | 60.0° |
| C1 | C6 | C5 | C4 | 60.6° | 60.0° |
| C1 | C6 | C5 | H6 | 120.0° | 120.0° |
| C1 | C6 | C5 | H6A | 119.0° | 120.0° |
| C1 | C6 | C5 | H5 | 59.4° | 60.0° |
| C1 | C6 | C5 | H5A | 178.8° | 180.0° |
| C1 | C6 | H6 | H6A | 119.1° | 120.0° |
| C1 | C2 | C3 | H2B | 120.0° | 120.0° |
| C1 | C2 | C3 | H2A | 120.1° | 119.9° |
| C1 | C2 | H2B | H2A | 120.1° | 119.9° |
| C1 | C2 | C3 | C4 | 56.6° | 59.9° |
| C1 | C2 | C3 | H3 | 63.4° | 60.1° |
| C1 | C2 | C3 | H3A | 176.6° | 180.0° |
| C2 | C1 | C6 | C5 | 51.6° | 60.0° |
| C2 | C1 | C6 | H6 | 68.5° | 60.0° |
| C2 | C1 | C6 | H6A | 170.6° | 180.0° |
| H1 | C1 | C2 | C3 | 69.1° | 60.0° |
| H1 | C1 | C2 | H2B | 50.9° | 60.1° |
| H1 | C1 | C2 | H2A | 170.8° | 180.0° |
| H1 | C1 | C6 | C5 | 65.3° | 60.0° |
| H1 | C1 | C6 | H6 | 174.7° | 179.9° |
| H1 | C1 | C6 | H6A | 53.7° | 60.0° |
| C3 | C2 | H2B | H2A | 120.1° | 120.1° |
| C2 | C3 | C4 | H3 | 120.0° | 120.0° |
| C2 | C3 | C4 | H3A | 120.1° | 120.0° |
| C2 | C3 | H3 | H3A | 120.1° | 119.9° |
| C2 | C3 | C4 | C5 | 66.9° | 59.9° |
| C2 | C3 | C4 | H4 | 173.1° | 180.0° |
| C2 | C3 | C4 | H4A | 54.2° | 60.0° |
| H2B | C2 | C3 | C4 | 176.6° | 180.0° |
| H2B | C2 | C3 | H3 | 56.6° | 59.9° |
| H2B | C2 | C3 | H3A | 63.3° | 60.0° |
| H2A | C2 | C3 | C4 | 63.5° | 60.0° |
| H2A | C2 | C3 | H3 | 176.5° | 180.0° |
| H2A | C2 | C3 | H3A | 56.6° | 60.1° |
| C4 | C3 | H3 | H3A | 120.0° | 120.0° |
| C3 | C4 | C5 | H4 | 120.0° | 120.1° |
| C3 | C4 | C5 | H4A | 121.1° | 119.9° |
| C3 | C4 | H4 | H4A | 121.1° | 120.0° |
| C3 | C4 | C5 | C6 | 67.7° | 60.0° |
| C3 | C4 | C5 | H5 | 52.3° | 60.1° |
| C3 | C4 | C5 | H5A | 171.8° | 180.0° |
| H3 | C3 | C4 | C5 | 53.1° | 60.0° |
| H3 | C3 | C4 | H4 | 66.9° | 60.1° |
| H3 | C3 | C4 | H4A | 174.2° | 180.0° |
| H3A | C3 | C4 | C5 | 173.0° | 180.0° |
| H3A | C3 | C4 | H4 | 53.0° | 59.9° |
| H3A | C3 | C4 | H4A | 65.9° | 60.1° |
| C5 | C4 | H4 | H4A | 121.1° | 120.0° |
| C4 | C5 | C6 | H5 | 120.0° | 120.0° |
| C4 | C5 | C6 | H5A | 120.6° | 120.0° |
| C4 | C5 | H5 | H5A | 120.6° | 119.9° |
| C4 | C5 | C6 | H6 | 59.4° | 60.0° |
| C4 | C5 | C6 | H6A | 179.6° | 180.0° |
| H4 | C4 | C5 | C6 | 172.4° | 180.0° |
| H4 | C4 | C5 | H5 | 67.6° | 60.0° |
| H4 | C4 | C5 | H5A | 51.8° | 60.0° |
| H4A | C4 | C5 | C6 | 53.4° | 60.0° |
| H4A | C4 | C5 | H5 | 173.4° | 180.0° |
| H4A | C4 | C5 | H5A | 67.1° | 60.1° |
| C6 | C5 | H5 | H5A | 120.6° | 120.0° |
| C5 | C6 | H6 | H6A | 119.1° | 120.0° |
| H5 | C5 | C6 | H6 | 179.4° | 180.0° |
| H5 | C5 | C6 | H6A | 59.6° | 60.0° |
| H5A | C5 | C6 | H6 | 61.2° | 60.0° |
| H5A | C5 | C6 | H6A | 59.8° | 60.0° |
