MFH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | N2 | sing | 1.46Å | 1.47Å | |
| C2 | CA | sing | 1.53Å | 1.52Å | |
| N2 | C | sing | 1.35Å | 1.33Å | |
| CB | CA | sing | 1.53Å | 1.53Å | |
| CB | CG | sing | 1.51Å | 1.40Å | |
| CA | N | sing | 1.47Å | 1.47Å | |
| C | O | doub | 1.22Å | 1.23Å | |
| CG | CD2 | doub | 1.38Å | 1.39Å | Aromatic |
| CG | CD1 | sing | 1.38Å | 1.39Å | Aromatic |
| CD2 | CE1 | sing | 1.38Å | 1.39Å | Aromatic |
| CD1 | CE2 | doub | 1.38Å | 1.39Å | Aromatic |
| CE1 | CZ | doub | 1.39Å | 1.39Å | Aromatic |
| CE2 | CZ | sing | 1.39Å | 1.39Å | Aromatic |
| CZ | OH | sing | 1.36Å | 1.36Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å | |
| N2 | H7 | sing | 0.97Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | H9 | sing | 1.09Å | 1.10Å | |
| CB | H10 | sing | 1.09Å | 1.10Å | |
| CD1 | H11 | sing | 1.08Å | 1.08Å | |
| CD2 | H12 | sing | 1.08Å | 1.08Å | |
| CE1 | H13 | sing | 1.08Å | 1.08Å | |
| CE2 | H14 | sing | 1.08Å | 1.08Å | |
| OH | H15 | sing | 0.97Å | 0.95Å | |
| C | OXT | sing | 1.35Å | 1.34Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | C2 | CA | 107.2° | 109.5° |
| C2 | N2 | C | 120.3° | 120.0° |
| N2 | C2 | H5 | 110.1° | 109.5° |
| N2 | C2 | H6 | 110.0° | 109.4° |
| C2 | N2 | H7 | 119.8° | 120.0° |
| C2 | CA | CB | 109.3° | 109.5° |
| C2 | CA | N | 106.4° | 109.4° |
| CA | C2 | H5 | 110.0° | 109.5° |
| CA | C2 | H6 | 110.1° | 109.5° |
| C2 | CA | HA | 109.6° | 109.5° |
| N2 | C | O | 124.0° | 120.0° |
| C | N2 | H7 | 119.9° | 120.0° |
| N2 | C | OXT | 117.2° | 120.0° |
| CA | CB | CG | 111.9° | 109.5° |
| CB | CA | N | 111.7° | 109.5° |
| CB | CA | HA | 109.4° | 109.5° |
| CA | CB | H9 | 108.8° | 109.5° |
| CA | CB | H10 | 108.9° | 109.5° |
| CB | CG | CD2 | 122.1° | 119.9° |
| CB | CG | CD1 | 118.4° | 120.0° |
| CG | CB | H9 | 108.9° | 109.5° |
| CG | CB | H10 | 108.9° | 109.5° |
| CA | N | H2 | 109.5° | 111.0° |
| CA | N | H | 109.4° | 111.0° |
| N | CA | HA | 110.3° | 109.5° |
| O | C | OXT | 118.8° | 120.0° |
| CD2 | CG | CD1 | 119.4° | 120.1° |
| CG | CD2 | CE1 | 120.2° | 120.0° |
| CG | CD2 | H12 | 119.9° | 120.0° |
| CG | CD1 | CE2 | 120.4° | 120.1° |
| CG | CD1 | H11 | 119.8° | 120.0° |
| CD2 | CE1 | CZ | 120.0° | 119.9° |
| CE1 | CD2 | H12 | 119.9° | 120.0° |
| CD2 | CE1 | H13 | 120.0° | 120.0° |
| CD1 | CE2 | CZ | 119.9° | 119.9° |
| CE2 | CD1 | H11 | 119.8° | 119.9° |
| CD1 | CE2 | H14 | 120.0° | 120.1° |
| CE1 | CZ | CE2 | 119.9° | 119.9° |
| CE1 | CZ | OH | 120.1° | 120.0° |
| CZ | CE1 | H13 | 120.0° | 120.1° |
| CE2 | CZ | OH | 120.0° | 120.0° |
| CZ | CE2 | H14 | 120.0° | 120.0° |
| CZ | OH | H15 | 109.5° | 114.1° |
| H2 | N | H | 109.5° | 111.1° |
| H5 | C2 | H6 | 109.4° | 109.4° |
| H9 | CB | H10 | 109.5° | 109.4° |
| C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | C2 | CA | H5 | 119.7° | 120.1° |
| N2 | C2 | CA | H6 | 119.6° | 119.9° |
| C2 | N2 | C | H7 | 180.0° | 179.9° |
| N2 | C2 | CA | CB | 170.9° | 175.0° |
| N2 | C2 | CA | N | 50.2° | 55.1° |
| C2 | N2 | C | O | 5.0° | 0.1° |
| N2 | C2 | H5 | H6 | 121.0° | 119.9° |
| N2 | C2 | CA | HA | 69.1° | 65.0° |
| C2 | N2 | C | OXT | 178.7° | 179.8° |
| CA | C2 | N2 | C | 91.2° | 180.0° |
| C2 | CA | CB | N | 117.5° | 119.9° |
| C2 | CA | CB | HA | 120.1° | 120.0° |
| C2 | CA | CB | CG | 177.6° | 175.0° |
| C2 | CA | N | HA | 118.8° | 120.0° |
| C2 | CA | N | H2 | 180.0° | 64.0° |
| C2 | CA | N | H | 60.0° | 60.0° |
| CA | C2 | H5 | H6 | 121.1° | 120.0° |
| CA | C2 | N2 | H7 | 88.8° | 0.1° |
| C2 | CA | CB | H9 | 62.0° | 64.9° |
| C2 | CA | CB | H10 | 57.3° | 55.0° |
| N2 | C | O | OXT | 176.3° | 179.7° |
| C | N2 | C2 | H5 | 149.1° | 59.9° |
| C | N2 | C2 | H6 | 28.5° | 60.0° |
| N2 | C | OXT | HXT | 176.5° | 179.7° |
| CA | CB | CG | H9 | 120.3° | 120.1° |
| CA | CB | CG | H10 | 120.4° | 120.0° |
| CB | CA | N | HA | 121.9° | 120.0° |
| CA | CB | CG | CD2 | 76.8° | 90.0° |
| CA | CB | CG | CD1 | 103.8° | 89.7° |
| CB | CA | N | H2 | 60.8° | 176.0° |
| CB | CA | N | H | 179.2° | 59.9° |
| CB | CA | C2 | H5 | 51.3° | 55.0° |
| CB | CA | C2 | H6 | 69.4° | 65.0° |
| CA | CB | H9 | H10 | 118.9° | 120.0° |
| CG | CB | CA | N | 64.9° | 65.1° |
| CB | CG | CD2 | CD1 | 179.4° | 179.7° |
| CB | CG | CD2 | CE1 | 180.0° | 179.9° |
| CB | CG | CD1 | CE2 | 179.8° | 180.0° |
| CG | CB | CA | HA | 57.5° | 55.0° |
| CG | CB | H9 | H10 | 118.9° | 120.0° |
| CB | CG | CD1 | H11 | 0.2° | 0.1° |
| CB | CG | CD2 | H12 | 0.0° | 0.0° |
| CA | N | H2 | H | 120.0° | 124.0° |
| N | CA | C2 | H5 | 69.5° | 65.0° |
| N | CA | C2 | H6 | 169.8° | 175.0° |
| N | CA | CB | H9 | 55.5° | 55.0° |
| N | CA | CB | H10 | 174.7° | 174.9° |
| O | C | N2 | H7 | 175.0° | 180.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| CG | CD2 | CE1 | H12 | 180.0° | 179.9° |
| CD2 | CG | CD1 | CE2 | 0.4° | 0.3° |
| CG | CD2 | CE1 | CZ | 0.5° | 0.0° |
| CD2 | CG | CB | H9 | 43.5° | 30.1° |
| CD2 | CG | CB | H10 | 162.8° | 150.0° |
| CD2 | CG | CD1 | H11 | 179.6° | 179.8° |
| CG | CD2 | CE1 | H13 | 179.5° | 180.0° |
| CD1 | CG | CD2 | CE1 | 0.6° | 0.3° |
| CG | CD1 | CE2 | H11 | 180.0° | 179.9° |
| CG | CD1 | CE2 | CZ | 0.1° | 0.1° |
| CD1 | CG | CB | H9 | 135.8° | 150.3° |
| CD1 | CG | CB | H10 | 16.5° | 30.4° |
| CD1 | CG | CD2 | H12 | 179.4° | 179.7° |
| CG | CD1 | CE2 | H14 | 179.9° | 179.9° |
| CD2 | CE1 | CZ | H13 | 180.0° | 179.9° |
| CD2 | CE1 | CZ | CE2 | 0.2° | 0.2° |
| CD2 | CE1 | CZ | OH | 179.6° | 180.0° |
| CD1 | CE2 | CZ | CE1 | 0.1° | 0.2° |
| CD1 | CE2 | CZ | H14 | 180.0° | 180.0° |
| CD1 | CE2 | CZ | OH | 179.8° | 180.0° |
| CE1 | CZ | CE2 | OH | 179.9° | 179.8° |
| CZ | CE1 | CD2 | H12 | 179.5° | 179.9° |
| CE1 | CZ | CE2 | H14 | 180.0° | 179.8° |
| CE1 | CZ | OH | H15 | 180.0° | 90.0° |
| CZ | CE2 | CD1 | H11 | 179.9° | 180.0° |
| CE2 | CZ | CE1 | H13 | 179.8° | 179.7° |
| CE2 | CZ | OH | H15 | 0.1° | 90.3° |
| OH | CZ | CE1 | H13 | 0.4° | 0.0° |
| OH | CZ | CE2 | H14 | 0.2° | 0.1° |
| H2 | N | CA | HA | 61.1° | 56.0° |
| H | N | CA | HA | 58.8° | 180.0° |
| H5 | C2 | N2 | H7 | 30.9° | 120.0° |
| H5 | C2 | CA | HA | 171.2° | 174.9° |
| H6 | C2 | N2 | H7 | 151.6° | 120.0° |
| H6 | C2 | CA | HA | 50.5° | 55.0° |
| H7 | N2 | C | OXT | 1.3° | 0.3° |
| HA | CA | CB | H9 | 177.9° | 175.1° |
| HA | CA | CB | H10 | 62.8° | 65.0° |
| H11 | CD1 | CE2 | H14 | 0.1° | 0.0° |
| H12 | CD2 | CE1 | H13 | 0.5° | 0.0° |
