CHQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.46Å | 1.47Å | |
| N | CP | sing | 1.35Å | 1.40Å | |
| N | H | sing | 0.97Å | 1.02Å | |
| CA | C | sing | 1.51Å | 1.53Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CA | HA | sing | 1.09Å | 1.12Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| C | NP | sing | 1.34Å | 1.40Å | |
| CB | CG | sing | 1.51Å | 1.53Å | |
| CB | HBC1 | sing | 1.09Å | 1.11Å | |
| CB | HBC2 | sing | 1.09Å | 1.11Å | |
| ND1 | CE1 | sing | 1.35Å | 1.33Å | Aromatic |
| ND1 | CG | sing | 1.37Å | 1.33Å | Aromatic |
| ND1 | HD1 | sing | 0.97Å | 1.02Å | |
| CE1 | NE2 | doub | 1.30Å | 1.33Å | Aromatic |
| CE1 | HE1 | sing | 1.08Å | 1.10Å | |
| NE2 | CD2 | sing | 1.34Å | 1.33Å | Aromatic |
| CD2 | CG | doub | 1.35Å | 1.33Å | Aromatic |
| CD2 | HD2 | sing | 1.08Å | 1.10Å | |
| NP | CAP | sing | 1.47Å | 1.47Å | |
| NP | CDP | sing | 1.47Å | 1.48Å | |
| CAP | CP | sing | 1.51Å | 1.53Å | |
| CAP | CBP | sing | 1.54Å | 1.53Å | |
| CAP | HAP | sing | 1.09Å | 1.12Å | |
| CP | OP | doub | 1.21Å | 1.23Å | |
| CBP | CGP | sing | 1.55Å | 1.53Å | |
| CBP | HBP1 | sing | 1.09Å | 1.12Å | |
| CBP | HBP2 | sing | 1.09Å | 1.12Å | |
| CGP | CDP | sing | 1.55Å | 1.53Å | |
| CGP | HGP1 | sing | 1.09Å | 1.12Å | |
| CGP | HGP2 | sing | 1.09Å | 1.11Å | |
| CDP | HDP1 | sing | 1.09Å | 1.11Å | |
| CDP | HDP2 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | CP | 123.7° | 122.0° |
| CA | N | H | 118.1° | 119.0° |
| N | CA | C | 112.9° | 109.8° |
| N | CA | CB | 107.4° | 109.4° |
| N | CA | HA | 109.3° | 109.4° |
| CP | N | H | 118.1° | 119.0° |
| N | CP | CAP | 119.9° | 120.0° |
| N | CP | OP | 119.5° | 120.1° |
| C | CA | CB | 108.7° | 109.4° |
| C | CA | HA | 109.3° | 109.5° |
| CA | C | O | 119.0° | 121.2° |
| CA | C | NP | 122.9° | 117.6° |
| CB | CA | HA | 109.3° | 109.4° |
| CA | CB | CG | 113.6° | 109.5° |
| CA | CB | HBC1 | 110.7° | 109.5° |
| CA | CB | HBC2 | 110.7° | 109.5° |
| O | C | NP | 118.1° | 121.2° |
| C | NP | CAP | 120.9° | 124.2° |
| C | NP | CDP | 127.4° | 129.2° |
| CG | CB | HBC1 | 110.7° | 109.5° |
| CG | CB | HBC2 | 110.7° | 109.5° |
| CB | CG | ND1 | 124.8° | 126.6° |
| CB | CG | CD2 | 126.5° | 126.6° |
| HBC1 | CB | HBC2 | 99.6° | 109.5° |
| CE1 | ND1 | CG | 104.7° | 107.2° |
| CE1 | ND1 | HD1 | 127.7° | 126.4° |
| ND1 | CE1 | NE2 | 112.8° | 108.7° |
| ND1 | CE1 | HE1 | 123.6° | 125.6° |
| CG | ND1 | HD1 | 127.6° | 126.5° |
| ND1 | CG | CD2 | 108.6° | 106.8° |
| NE2 | CE1 | HE1 | 123.6° | 125.7° |
| CE1 | NE2 | CD2 | 104.1° | 109.2° |
| NE2 | CD2 | CG | 109.8° | 108.0° |
| NE2 | CD2 | HD2 | 125.1° | 126.0° |
| CG | CD2 | HD2 | 125.1° | 126.0° |
| CAP | NP | CDP | 111.2° | 106.6° |
| NP | CAP | CP | 114.3° | 107.7° |
| NP | CAP | CBP | 99.6° | 106.8° |
| NP | CAP | HAP | 109.9° | 110.3° |
| NP | CDP | CGP | 102.1° | 103.0° |
| NP | CDP | HDP1 | 115.0° | 110.8° |
| NP | CDP | HDP2 | 115.0° | 110.7° |
| CP | CAP | CBP | 112.7° | 110.3° |
| CP | CAP | HAP | 109.9° | 111.2° |
| CAP | CP | OP | 120.5° | 120.0° |
| CBP | CAP | HAP | 109.9° | 110.6° |
| CAP | CBP | CGP | 99.7° | 105.1° |
| CAP | CBP | HBP1 | 116.0° | 110.5° |
| CAP | CBP | HBP2 | 116.0° | 110.2° |
| CGP | CBP | HBP1 | 116.0° | 110.3° |
| CGP | CBP | HBP2 | 116.0° | 110.4° |
| CBP | CGP | CDP | 102.8° | 103.0° |
| CBP | CGP | HGP1 | 114.8° | 110.7° |
| CBP | CGP | HGP2 | 114.8° | 110.7° |
| HBP1 | CBP | HBP2 | 94.5° | 110.2° |
| CDP | CGP | HGP1 | 114.7° | 110.7° |
| CDP | CGP | HGP2 | 114.7° | 110.7° |
| CGP | CDP | HDP1 | 115.0° | 110.7° |
| CGP | CDP | HDP2 | 115.0° | 110.7° |
| HGP1 | CGP | HGP2 | 95.7° | 110.8° |
| HDP1 | CDP | HDP2 | 95.4° | 110.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | CP | H | 180.0° | 179.9° |
| N | CA | C | CB | 119.0° | 120.0° |
| N | CA | C | HA | 121.8° | 120.1° |
| N | CA | CB | HA | 118.5° | 119.8° |
| N | CA | C | O | 167.3° | 147.9° |
| N | CA | C | NP | 13.9° | 32.1° |
| N | CA | CB | CG | 64.3° | 60.0° |
| N | CA | CB | HBC1 | 61.0° | 60.0° |
| N | CA | CB | HBC2 | 170.5° | 180.0° |
| CA | N | CP | CAP | 8.1° | 2.0° |
| CA | N | CP | OP | 174.8° | 178.2° |
| CP | N | CA | C | 10.6° | 34.8° |
| CP | N | CA | CB | 130.3° | 154.8° |
| CP | N | CA | HA | 111.2° | 85.4° |
| N | CP | CAP | NP | 24.0° | 31.7° |
| N | CP | CAP | OP | 177.0° | 179.8° |
| N | CP | CAP | CBP | 136.8° | 147.8° |
| N | CP | CAP | HAP | 100.2° | 89.2° |
| H | N | CA | C | 169.4° | 145.3° |
| H | N | CA | CB | 49.6° | 25.3° |
| H | N | CA | HA | 68.8° | 94.5° |
| H | N | CP | CAP | 171.9° | 178.0° |
| H | N | CP | OP | 5.1° | 1.8° |
| C | CA | CB | HA | 119.1° | 119.9° |
| CA | C | O | NP | 178.9° | 179.9° |
| C | CA | CB | CG | 58.1° | 179.7° |
| C | CA | CB | HBC1 | 176.6° | 60.3° |
| C | CA | CB | HBC2 | 67.1° | 59.7° |
| CA | C | NP | CAP | 2.4° | 2.6° |
| CA | C | NP | CDP | 168.8° | 175.9° |
| CB | CA | C | O | 48.2° | 27.9° |
| CB | CA | C | NP | 132.9° | 152.2° |
| CA | CB | CG | HBC1 | 125.3° | 120.0° |
| CA | CB | CG | HBC2 | 125.2° | 120.0° |
| CA | CB | HBC1 | HBC2 | 116.6° | 120.0° |
| CA | CB | CG | ND1 | 143.1° | 90.0° |
| CA | CB | CG | CD2 | 35.6° | 90.3° |
| HA | CA | C | O | 70.9° | 91.9° |
| HA | CA | C | NP | 108.0° | 88.0° |
| HA | CA | CB | CG | 177.3° | 59.9° |
| HA | CA | CB | HBC1 | 57.4° | 179.8° |
| HA | CA | CB | HBC2 | 52.0° | 60.2° |
| O | C | NP | CAP | 176.5° | 177.3° |
| O | C | NP | CDP | 12.4° | 4.2° |
| C | NP | CAP | CDP | 172.4° | 178.8° |
| C | NP | CAP | CP | 20.9° | 34.4° |
| C | NP | CAP | CBP | 141.3° | 152.8° |
| C | NP | CAP | HAP | 103.3° | 87.1° |
| C | NP | CDP | CGP | 169.4° | 139.6° |
| C | NP | CDP | HDP1 | 44.1° | 102.0° |
| C | NP | CDP | HDP2 | 65.3° | 21.2° |
| CG | CB | HBC1 | HBC2 | 116.6° | 120.0° |
| CB | CG | ND1 | CE1 | 178.5° | 180.0° |
| CB | CG | ND1 | CD2 | 178.8° | 179.7° |
| CB | CG | ND1 | HD1 | 1.4° | 0.0° |
| CB | CG | CD2 | NE2 | 178.5° | 179.9° |
| CB | CG | CD2 | HD2 | 1.5° | 0.4° |
| HBC1 | CB | CG | ND1 | 91.7° | 30.0° |
| HBC1 | CB | CG | CD2 | 89.7° | 149.7° |
| HBC2 | CB | CG | ND1 | 17.8° | 150.0° |
| HBC2 | CB | CG | CD2 | 160.8° | 29.7° |
| CE1 | ND1 | CG | HD1 | 180.0° | 180.0° |
| ND1 | CE1 | NE2 | HE1 | 180.0° | 180.0° |
| ND1 | CE1 | NE2 | CD2 | 0.0° | 0.2° |
| CE1 | ND1 | CG | CD2 | 0.3° | 0.3° |
| CG | ND1 | CE1 | NE2 | 0.2° | 0.1° |
| CG | ND1 | CE1 | HE1 | 179.8° | 179.9° |
| ND1 | CG | CD2 | NE2 | 0.3° | 0.4° |
| ND1 | CG | CD2 | HD2 | 179.7° | 179.9° |
| HD1 | ND1 | CE1 | NE2 | 179.8° | 179.9° |
| HD1 | ND1 | CE1 | HE1 | 0.2° | 0.1° |
| HD1 | ND1 | CG | CD2 | 179.7° | 179.7° |
| CE1 | NE2 | CD2 | CG | 0.2° | 0.4° |
| CE1 | NE2 | CD2 | HD2 | 179.8° | 179.9° |
| HE1 | CE1 | NE2 | CD2 | 180.0° | 179.8° |
| NE2 | CD2 | CG | HD2 | 180.0° | 179.6° |
| NP | CAP | CP | CBP | 112.8° | 116.1° |
| NP | CAP | CP | HAP | 124.2° | 120.9° |
| NP | CAP | CBP | HAP | 115.4° | 120.0° |
| NP | CAP | CP | OP | 159.0° | 148.1° |
| NP | CAP | CBP | CGP | 46.4° | 2.1° |
| NP | CAP | CBP | HBP1 | 171.7° | 121.0° |
| NP | CAP | CBP | HBP2 | 78.8° | 116.9° |
| CAP | NP | CDP | CGP | 2.4° | 39.2° |
| CAP | NP | CDP | HDP1 | 127.7° | 79.2° |
| CAP | NP | CDP | HDP2 | 122.9° | 157.6° |
| CDP | NP | CAP | CP | 151.6° | 144.4° |
| CDP | NP | CAP | CBP | 31.1° | 26.0° |
| CDP | NP | CAP | HAP | 84.3° | 94.1° |
| NP | CDP | CGP | CBP | 27.6° | 36.6° |
| NP | CDP | CGP | HDP1 | 125.2° | 118.4° |
| NP | CDP | CGP | HDP2 | 125.3° | 118.4° |
| NP | CDP | CGP | HGP1 | 152.8° | 155.0° |
| NP | CDP | CGP | HGP2 | 97.7° | 81.7° |
| NP | CDP | HDP1 | HDP2 | 120.9° | 123.2° |
| CP | CAP | CBP | HAP | 123.0° | 123.3° |
| CP | CAP | CBP | CGP | 168.1° | 118.8° |
| CP | CAP | CBP | HBP1 | 66.7° | 122.3° |
| CP | CAP | CBP | HBP2 | 42.8° | 0.2° |
| CBP | CAP | CP | OP | 46.2° | 31.9° |
| CAP | CBP | CGP | HBP1 | 125.2° | 119.1° |
| CAP | CBP | CGP | HBP2 | 125.2° | 118.9° |
| CAP | CBP | HBP1 | HBP2 | 121.8° | 122.1° |
| CAP | CBP | CGP | CDP | 46.6° | 20.9° |
| CAP | CBP | CGP | HGP1 | 171.8° | 139.3° |
| CAP | CBP | CGP | HGP2 | 78.7° | 97.4° |
| HAP | CAP | CP | OP | 76.8° | 91.0° |
| HAP | CAP | CBP | CGP | 68.9° | 117.9° |
| HAP | CAP | CBP | HBP1 | 56.3° | 1.0° |
| HAP | CAP | CBP | HBP2 | 165.8° | 123.1° |
| CGP | CBP | HBP1 | HBP2 | 121.8° | 122.1° |
| CBP | CGP | CDP | HGP1 | 125.3° | 118.4° |
| CBP | CGP | CDP | HGP2 | 125.3° | 118.3° |
| CBP | CGP | HGP1 | HGP2 | 120.6° | 123.2° |
| CBP | CGP | CDP | HDP1 | 97.7° | 81.8° |
| CBP | CGP | CDP | HDP2 | 152.8° | 155.0° |
| HBP1 | CBP | CGP | CDP | 171.8° | 98.2° |
| HBP1 | CBP | CGP | HGP1 | 62.9° | 20.2° |
| HBP1 | CBP | CGP | HGP2 | 46.5° | 143.5° |
| HBP2 | CBP | CGP | CDP | 78.7° | 139.8° |
| HBP2 | CBP | CGP | HGP1 | 46.6° | 101.8° |
| HBP2 | CBP | CGP | HGP2 | 156.1° | 21.4° |
| CDP | CGP | HGP1 | HGP2 | 120.6° | 123.2° |
| CGP | CDP | HDP1 | HDP2 | 120.9° | 123.1° |
| HGP1 | CGP | CDP | HDP1 | 27.6° | 36.6° |
| HGP1 | CGP | CDP | HDP2 | 81.9° | 86.6° |
| HGP2 | CGP | CDP | HDP1 | 137.0° | 159.8° |
| HGP2 | CGP | CDP | HDP2 | 27.6° | 36.7° |
