HS9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | H | sing | 1.01Å | 1.00Å | |
| N | CA | sing | 1.47Å | 1.49Å | |
| N | CM | sing | 1.47Å | 1.21Å | |
| CA | C | sing | 1.51Å | 1.54Å | |
| CA | CB | sing | 1.53Å | 1.57Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| C | NXT | sing | 1.35Å | 1.24Å | |
| CB | CG | sing | 1.51Å | 1.51Å | |
| CG | ND1 | sing | 1.34Å | 1.39Å | Aromatic |
| CG | CD2 | doub | 1.35Å | 1.36Å | Aromatic |
| ND1 | CE1 | doub | 1.31Å | 1.33Å | Aromatic |
| CD2 | NE2 | sing | 1.37Å | 1.38Å | Aromatic |
| CE1 | NE2 | sing | 1.35Å | 1.33Å | Aromatic |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CM | HM1C | sing | 1.09Å | 1.10Å | |
| CM | HM2C | sing | 1.09Å | 1.10Å | |
| CM | HM3C | sing | 1.09Å | 1.10Å | |
| CB | HB1C | sing | 1.09Å | 1.10Å | |
| CB | HB2C | sing | 1.09Å | 1.10Å | |
| NXT | HXT1 | sing | 0.97Å | 1.00Å | |
| NXT | HXT2 | sing | 0.97Å | 1.00Å | |
| CD2 | HD2 | sing | 1.08Å | 1.08Å | |
| CE1 | HE1 | sing | 1.08Å | 1.08Å | |
| NE2 | HE2 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| H | N | CA | 106.3° | 111.0° |
| H | N | CM | 106.4° | 111.0° |
| CA | N | CM | 119.1° | 111.0° |
| N | CA | C | 106.8° | 109.5° |
| N | CA | CB | 110.2° | 109.5° |
| N | CA | HA | 111.8° | 109.5° |
| N | CM | HM1C | 109.5° | 109.4° |
| N | CM | HM2C | 109.5° | 109.4° |
| N | CM | HM3C | 109.5° | 109.4° |
| C | CA | CB | 112.5° | 109.5° |
| CA | C | O | 121.9° | 120.0° |
| CA | C | NXT | 121.0° | 120.0° |
| C | CA | HA | 109.5° | 109.5° |
| CA | CB | CG | 115.4° | 109.5° |
| CB | CA | HA | 106.1° | 109.5° |
| CA | CB | HB1C | 107.6° | 109.5° |
| CA | CB | HB2C | 106.2° | 109.5° |
| O | C | NXT | 117.0° | 120.0° |
| C | NXT | HXT1 | 109.7° | 120.0° |
| C | NXT | HXT2 | 125.2° | 120.0° |
| CB | CG | ND1 | 123.4° | 126.0° |
| CB | CG | CD2 | 130.8° | 126.0° |
| CG | CB | HB1C | 107.5° | 109.4° |
| CG | CB | HB2C | 106.2° | 109.4° |
| ND1 | CG | CD2 | 105.8° | 108.0° |
| CG | ND1 | CE1 | 109.7° | 109.3° |
| CG | CD2 | NE2 | 107.3° | 106.8° |
| CG | CD2 | HD2 | 126.4° | 126.6° |
| ND1 | CE1 | NE2 | 108.2° | 108.7° |
| ND1 | CE1 | HE1 | 125.9° | 125.6° |
| CD2 | NE2 | CE1 | 109.1° | 107.2° |
| NE2 | CD2 | HD2 | 126.4° | 126.6° |
| CD2 | NE2 | HE2 | 125.4° | 126.5° |
| NE2 | CE1 | HE1 | 125.9° | 125.7° |
| CE1 | NE2 | HE2 | 125.5° | 126.3° |
| HM1C | CM | HM2C | 109.4° | 109.6° |
| HM1C | CM | HM3C | 109.5° | 109.5° |
| HM2C | CM | HM3C | 109.5° | 109.5° |
| HB1C | CB | HB2C | 114.2° | 109.5° |
| HXT1 | NXT | HXT2 | 125.1° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| H | N | CA | CM | 120.0° | 123.9° |
| H | N | CA | C | 177.2° | 38.9° |
| H | N | CA | CB | 60.3° | 81.1° |
| H | N | CA | HA | 57.4° | 159.0° |
| H | N | CM | HM1C | 136.1° | 56.0° |
| H | N | CM | HM2C | 104.0° | 176.1° |
| H | N | CM | HM3C | 16.0° | 63.9° |
| N | CA | C | CB | 121.1° | 120.0° |
| N | CA | C | HA | 121.3° | 120.0° |
| N | CA | CB | HA | 121.2° | 120.0° |
| N | CA | C | O | 103.6° | 0.0° |
| N | CA | C | NXT | 73.5° | 180.0° |
| N | CA | CB | CG | 178.6° | 65.0° |
| CA | N | CM | HM1C | 104.0° | 179.9° |
| CA | N | CM | HM2C | 16.0° | 60.0° |
| CA | N | CM | HM3C | 136.0° | 60.0° |
| N | CA | CB | HB1C | 61.4° | 55.0° |
| N | CA | CB | HB2C | 61.3° | 175.0° |
| CM | N | CA | C | 62.7° | 85.0° |
| CM | N | CA | CB | 59.7° | 155.0° |
| CM | N | CA | HA | 177.4° | 35.0° |
| N | CM | HM1C | HM2C | 120.0° | 120.0° |
| N | CM | HM1C | HM3C | 120.0° | 119.9° |
| N | CM | HM2C | HM3C | 120.0° | 119.9° |
| C | CA | CB | HA | 119.7° | 120.0° |
| CA | C | O | NXT | 177.3° | 180.0° |
| C | CA | CB | CG | 59.5° | 175.0° |
| C | CA | CB | HB1C | 179.5° | 65.0° |
| C | CA | CB | HB2C | 57.8° | 55.0° |
| CA | C | NXT | HXT1 | 1.5° | 0.0° |
| CA | C | NXT | HXT2 | 178.5° | 180.0° |
| CB | CA | C | O | 17.5° | 120.0° |
| CB | CA | C | NXT | 165.4° | 60.0° |
| CA | CB | CG | HB1C | 120.0° | 120.0° |
| CA | CB | CG | HB2C | 117.3° | 120.0° |
| CA | CB | CG | ND1 | 33.6° | 54.9° |
| CA | CB | CG | CD2 | 146.1° | 124.7° |
| CA | CB | HB1C | HB2C | 117.6° | 120.0° |
| O | C | CA | HA | 135.1° | 120.0° |
| O | C | NXT | HXT1 | 178.8° | 180.0° |
| O | C | NXT | HXT2 | 1.3° | 0.0° |
| NXT | C | CA | HA | 47.7° | 60.0° |
| C | NXT | HXT1 | HXT2 | 180.0° | 180.0° |
| CB | CG | ND1 | CD2 | 179.7° | 179.7° |
| CB | CG | ND1 | CE1 | 179.7° | 180.0° |
| CB | CG | CD2 | NE2 | 179.9° | 180.0° |
| CG | CB | CA | HA | 60.2° | 55.0° |
| CG | CB | HB1C | HB2C | 117.6° | 120.0° |
| CB | CG | CD2 | HD2 | 0.1° | 0.1° |
| ND1 | CG | CD2 | NE2 | 0.2° | 0.3° |
| CG | ND1 | CE1 | NE2 | 0.4° | 0.2° |
| ND1 | CG | CB | HB1C | 86.4° | 174.9° |
| ND1 | CG | CB | HB2C | 150.9° | 65.1° |
| ND1 | CG | CD2 | HD2 | 179.8° | 179.8° |
| CG | ND1 | CE1 | HE1 | 179.6° | 180.0° |
| CD2 | CG | ND1 | CE1 | 0.1° | 0.3° |
| CG | CD2 | NE2 | HD2 | 180.0° | 179.9° |
| CG | CD2 | NE2 | CE1 | 0.5° | 0.2° |
| CD2 | CG | CB | HB1C | 93.9° | 4.7° |
| CD2 | CG | CB | HB2C | 28.7° | 115.3° |
| CG | CD2 | NE2 | HE2 | 179.5° | 180.0° |
| ND1 | CE1 | NE2 | CD2 | 0.5° | 0.0° |
| ND1 | CE1 | NE2 | HE1 | 180.0° | 179.9° |
| ND1 | CE1 | NE2 | HE2 | 179.5° | 179.8° |
| CD2 | NE2 | CE1 | HE2 | 180.0° | 179.8° |
| CD2 | NE2 | CE1 | HE1 | 179.5° | 179.8° |
| CE1 | NE2 | CD2 | HD2 | 179.6° | 179.9° |
| HA | CA | CB | HB1C | 59.8° | 175.0° |
| HA | CA | CB | HB2C | 177.5° | 65.0° |
| HM1C | CM | HM2C | HM3C | 120.0° | 120.1° |
| HD2 | CD2 | NE2 | HE2 | 0.5° | 0.1° |
| HE1 | CE1 | NE2 | HE2 | 0.5° | 0.1° |
