9FB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C61 | CA | sing | 1.54Å | 1.52Å | |
| C61 | C62 | sing | 1.55Å | 1.54Å | |
| N | CA | sing | 1.47Å | 1.47Å | |
| CA | C63 | sing | 1.54Å | 1.52Å | |
| C62 | C66 | sing | 1.55Å | 1.53Å | |
| C63 | C66 | sing | 1.54Å | 1.54Å | |
| C63 | C | sing | 1.51Å | 1.51Å | |
| O | C | doub | 1.21Å | 1.22Å | |
| C | OXT | sing | 1.34Å | 1.33Å | |
| C63 | H1 | sing | 1.09Å | 1.10Å | |
| C66 | H6 | sing | 1.09Å | 1.10Å | |
| C66 | H3 | sing | 1.09Å | 1.10Å | |
| C62 | H4 | sing | 1.09Å | 1.10Å | |
| C62 | H5 | sing | 1.09Å | 1.10Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| C61 | H7 | sing | 1.09Å | 1.10Å | |
| C61 | H8 | sing | 1.09Å | 1.10Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | C61 | C62 | 106.9° | 104.3° |
| C61 | CA | N | 115.7° | 110.1° |
| C61 | CA | C63 | 101.8° | 106.6° |
| C61 | CA | HA | 109.9° | 110.0° |
| CA | C61 | H7 | 110.1° | 110.5° |
| CA | C61 | H8 | 110.1° | 110.5° |
| C61 | C62 | C66 | 108.7° | 102.7° |
| C61 | C62 | H4 | 109.7° | 110.7° |
| C61 | C62 | H5 | 109.6° | 110.9° |
| C62 | C61 | H7 | 110.1° | 110.5° |
| C62 | C61 | H8 | 110.1° | 110.5° |
| N | CA | C63 | 108.3° | 110.0° |
| N | CA | HA | 110.6° | 110.0° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.4° | 110.9° |
| CA | C63 | C66 | 112.0° | 106.5° |
| CA | C63 | C | 117.0° | 110.0° |
| CA | C63 | H1 | 98.0° | 110.1° |
| C63 | CA | HA | 110.0° | 110.0° |
| C62 | C66 | C63 | 102.4° | 104.2° |
| C62 | C66 | H6 | 111.2° | 110.5° |
| C62 | C66 | H3 | 111.2° | 110.6° |
| C66 | C62 | H4 | 109.6° | 110.7° |
| C66 | C62 | H5 | 109.7° | 110.8° |
| C66 | C63 | C | 125.3° | 110.1° |
| C66 | C63 | H1 | 97.9° | 110.0° |
| C63 | C66 | H6 | 111.2° | 110.5° |
| C63 | C66 | H3 | 111.2° | 110.5° |
| C63 | C | O | 118.2° | 120.0° |
| C63 | C | OXT | 117.2° | 120.0° |
| C | C63 | H1 | 98.0° | 110.1° |
| O | C | OXT | 124.6° | 120.0° |
| C | OXT | HXT | 109.5° | 117.0° |
| H6 | C66 | H3 | 109.5° | 110.4° |
| H4 | C62 | H5 | 109.5° | 110.7° |
| H7 | C61 | H8 | 109.4° | 110.5° |
| H | N | H2 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | C61 | C62 | H7 | 119.6° | 118.7° |
| CA | C61 | C62 | H8 | 119.6° | 118.7° |
| C61 | CA | N | C63 | 113.5° | 117.2° |
| C61 | CA | N | HA | 125.9° | 121.4° |
| C61 | CA | C63 | HA | 116.6° | 119.3° |
| CA | C61 | C62 | C66 | 22.6° | 37.9° |
| C61 | CA | C63 | C66 | 25.5° | 0.0° |
| C61 | CA | C63 | C | 179.7° | 119.3° |
| C61 | CA | C63 | H1 | 76.4° | 119.3° |
| CA | C61 | C62 | H4 | 97.2° | 80.3° |
| CA | C61 | C62 | H5 | 142.5° | 156.3° |
| CA | C61 | H7 | H8 | 121.2° | 122.6° |
| C61 | CA | N | H | 180.0° | 69.5° |
| C61 | CA | N | H2 | 60.0° | 54.4° |
| C62 | C61 | CA | N | 88.8° | 142.9° |
| C62 | C61 | CA | C63 | 28.3° | 23.6° |
| C61 | C62 | C66 | H4 | 119.9° | 118.2° |
| C61 | C62 | C66 | H5 | 119.9° | 118.5° |
| C61 | C62 | C66 | C63 | 6.5° | 37.9° |
| C61 | C62 | C66 | H6 | 125.4° | 156.6° |
| C61 | C62 | C66 | H3 | 112.3° | 80.8° |
| C61 | C62 | H4 | H5 | 120.3° | 123.5° |
| C62 | C61 | CA | HA | 145.0° | 95.7° |
| C62 | C61 | H7 | H8 | 121.2° | 122.6° |
| N | CA | C63 | HA | 121.0° | 121.3° |
| N | CA | C63 | C66 | 97.0° | 119.4° |
| N | CA | C63 | C | 57.9° | 0.1° |
| N | CA | C63 | H1 | 161.2° | 121.3° |
| N | CA | C61 | H7 | 30.8° | 98.4° |
| N | CA | C61 | H8 | 151.6° | 24.2° |
| CA | N | H | H2 | 120.0° | 123.9° |
| CA | C63 | C66 | C62 | 12.1° | 23.6° |
| CA | C63 | C66 | C | 152.4° | 119.2° |
| CA | C63 | C66 | H1 | 101.9° | 119.3° |
| CA | C63 | C | H1 | 103.2° | 121.5° |
| CA | C63 | C | O | 23.6° | 88.9° |
| CA | C63 | C | OXT | 156.3° | 90.9° |
| CA | C63 | C66 | H6 | 106.8° | 142.3° |
| CA | C63 | C66 | H3 | 131.0° | 95.2° |
| C63 | CA | C61 | H7 | 147.9° | 142.3° |
| C63 | CA | C61 | H8 | 91.3° | 95.1° |
| C63 | CA | N | H | 66.5° | 173.3° |
| C63 | CA | N | H2 | 173.5° | 62.8° |
| C62 | C66 | C63 | H6 | 118.9° | 118.7° |
| C62 | C66 | C63 | H3 | 118.9° | 118.8° |
| C62 | C66 | C63 | C | 164.5° | 142.8° |
| C62 | C66 | C63 | H1 | 89.8° | 95.7° |
| C62 | C66 | H6 | H3 | 123.3° | 122.7° |
| C66 | C62 | H4 | H5 | 120.4° | 123.3° |
| C66 | C62 | C61 | H7 | 142.2° | 156.6° |
| C66 | C62 | C61 | H8 | 97.0° | 80.8° |
| C66 | C63 | C | H1 | 105.6° | 121.4° |
| C66 | C63 | C | O | 127.5° | 28.2° |
| C66 | C63 | C | OXT | 52.5° | 152.0° |
| C63 | C66 | H6 | H3 | 123.2° | 122.5° |
| C63 | C66 | C62 | H4 | 113.3° | 80.3° |
| C63 | C66 | C62 | H5 | 126.4° | 156.4° |
| C66 | C63 | CA | HA | 142.0° | 119.3° |
| C63 | C | O | OXT | 179.9° | 179.8° |
| C | C63 | C66 | H6 | 45.6° | 98.5° |
| C | C63 | C66 | H3 | 76.6° | 24.0° |
| C | C63 | CA | HA | 63.1° | 121.4° |
| C63 | C | OXT | HXT | 179.9° | 179.8° |
| O | C | C63 | H1 | 126.9° | 149.6° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| OXT | C | C63 | H1 | 53.1° | 30.6° |
| H1 | C63 | C66 | H6 | 151.3° | 23.0° |
| H1 | C63 | C66 | H3 | 29.1° | 145.5° |
| H1 | C63 | CA | HA | 40.2° | 0.0° |
| H6 | C66 | C62 | H4 | 5.5° | 38.4° |
| H6 | C66 | C62 | H5 | 114.7° | 84.9° |
| H3 | C66 | C62 | H4 | 127.8° | 161.0° |
| H3 | C66 | C62 | H5 | 7.6° | 37.7° |
| H4 | C62 | C61 | H7 | 22.4° | 38.4° |
| H4 | C62 | C61 | H8 | 143.2° | 161.0° |
| H5 | C62 | C61 | H7 | 97.9° | 85.0° |
| H5 | C62 | C61 | H8 | 22.9° | 37.6° |
| HA | CA | C61 | H7 | 95.4° | 23.0° |
| HA | CA | C61 | H8 | 25.4° | 145.6° |
| HA | CA | N | H | 54.2° | 52.0° |
| HA | CA | N | H2 | 65.9° | 175.9° |
