G3A
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O36 | C36 | doub | 1.22Å | 1.25Å | |
| C36 | N31 | sing | 1.40Å | 1.35Å | |
| C36 | C35 | sing | 1.44Å | 1.39Å | |
| N31 | C32 | sing | 1.42Å | 1.38Å | |
| N31 | HN31 | sing | 1.02Å | 1.00Å | |
| C32 | N32 | sing | 1.37Å | 1.34Å | |
| C32 | N33 | doub | 1.32Å | 1.35Å | |
| N32 | H321 | sing | 0.99Å | 1.00Å | |
| N32 | H322 | sing | 0.99Å | 1.00Å | |
| N33 | C34 | sing | 1.35Å | 1.36Å | |
| C35 | C34 | doub | 1.37Å | 1.40Å | Aromatic |
| C35 | N37 | sing | 1.36Å | 1.35Å | Aromatic |
| C34 | N39 | sing | 1.36Å | 1.32Å | Aromatic |
| N37 | C38 | doub | 1.32Å | 1.36Å | Aromatic |
| C38 | N39 | sing | 1.37Å | 1.35Å | Aromatic |
| C38 | H38 | sing | 1.08Å | 1.08Å | |
| N39 | C41 | sing | 1.46Å | 1.49Å | |
| C41 | C42 | sing | 1.52Å | 1.52Å | |
| C41 | O44 | sing | 1.44Å | 1.44Å | |
| C41 | H41 | sing | 1.10Å | 1.10Å | |
| O44 | C44 | sing | 1.45Å | 1.43Å | |
| C42 | O42 | sing | 1.41Å | 1.42Å | |
| C42 | C43 | sing | 1.52Å | 1.50Å | |
| C42 | H42 | sing | 1.10Å | 1.10Å | |
| O42 | HO42 | sing | 0.97Å | 0.95Å | |
| C43 | O43 | sing | 1.43Å | 1.43Å | |
| C43 | C44 | sing | 1.53Å | 1.52Å | |
| C43 | H43 | sing | 1.09Å | 1.10Å | |
| O43 | HO43 | sing | 0.97Å | 0.95Å | |
| C44 | C45 | sing | 1.52Å | 1.51Å | |
| C44 | H44 | sing | 1.10Å | 1.10Å | |
| C45 | O45 | sing | 1.42Å | 1.41Å | |
| C45 | H451 | sing | 1.09Å | 1.10Å | |
| C45 | H452 | sing | 1.09Å | 1.10Å | |
| O45 | PA | sing | 1.62Å | 1.62Å | |
| PA | O2A | doub | 1.50Å | 1.51Å | |
| PA | O1 | sing | 1.62Å | 1.59Å | |
| PA | O1A | sing | 1.62Å | 1.51Å | |
| O1A | HO1A | sing | 0.98Å | 0.95Å | |
| O1 | PB | sing | 1.61Å | 1.61Å | |
| PB | O3A | sing | 1.61Å | 1.61Å | |
| PB | O3B | doub | 1.50Å | 1.50Å | |
| PB | O2B | sing | 1.62Å | 1.50Å | |
| O2B | HO2B | sing | 0.98Å | 0.95Å | |
| O3A | PG | sing | 1.62Å | 1.61Å | |
| PG | O1G | doub | 1.50Å | 1.49Å | |
| PG | O25 | sing | 1.62Å | 1.61Å | |
| PG | O2G | sing | 1.62Å | 1.50Å | |
| O2G | HO2G | sing | 0.98Å | 0.95Å | |
| O25 | C25 | sing | 1.42Å | 1.44Å | |
| C25 | C24 | sing | 1.52Å | 1.53Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C24 | O24 | sing | 1.44Å | 1.44Å | |
| C24 | C23 | sing | 1.52Å | 1.53Å | |
| C24 | H24 | sing | 1.10Å | 1.10Å | |
| C23 | C22 | sing | 1.52Å | 1.51Å | |
| C23 | O23 | sing | 1.41Å | 1.43Å | |
| C23 | H23 | sing | 1.10Å | 1.10Å | |
| O23 | HO23 | sing | 0.97Å | 0.95Å | |
| C22 | C21 | sing | 1.53Å | 1.51Å | |
| C22 | O22 | sing | 1.43Å | 1.44Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| O22 | HO22 | sing | 0.97Å | 0.95Å | |
| O24 | C21 | sing | 1.44Å | 1.43Å | |
| C21 | N19 | sing | 1.46Å | 1.48Å | |
| C21 | H21 | sing | 1.10Å | 1.10Å | |
| N19 | C14 | sing | 1.37Å | 1.33Å | Aromatic |
| N19 | C18 | sing | 1.37Å | 1.35Å | Aromatic |
| C14 | C15 | doub | 1.39Å | 1.38Å | Aromatic |
| C14 | N13 | sing | 1.34Å | 1.35Å | Aromatic |
| N13 | C12 | doub | 1.35Å | 1.35Å | Aromatic |
| C12 | N11 | sing | 1.35Å | 1.34Å | Aromatic |
| C12 | H12 | sing | 1.09Å | 1.08Å | |
| N11 | C16 | doub | 1.36Å | 1.34Å | Aromatic |
| C18 | N17 | doub | 1.32Å | 1.35Å | Aromatic |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| N17 | C15 | sing | 1.37Å | 1.34Å | Aromatic |
| C15 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
| C16 | N16 | sing | 1.41Å | 1.25Å | |
| N16 | H161 | sing | 1.00Å | 1.00Å | |
| N16 | H162 | sing | 1.00Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O36 | C36 | N31 | 121.0° | 125.4° |
| O36 | C36 | C35 | 120.3° | 123.8° |
| N31 | C36 | C35 | 118.7° | 110.8° |
| C36 | N31 | C32 | 120.3° | 125.3° |
| C36 | N31 | HN31 | 119.9° | 117.4° |
| C36 | C35 | C34 | 119.4° | 119.2° |
| C36 | C35 | N37 | 133.2° | 128.7° |
| C32 | N31 | HN31 | 119.9° | 117.4° |
| N31 | C32 | N32 | 120.9° | 115.3° |
| N31 | C32 | N33 | 122.1° | 122.6° |
| N32 | C32 | N33 | 116.9° | 122.1° |
| C32 | N32 | H321 | 110.1° | 118.2° |
| C32 | N32 | H322 | 125.0° | 118.4° |
| C32 | N33 | C34 | 118.5° | 113.0° |
| H321 | N32 | H322 | 125.0° | 123.4° |
| N33 | C34 | C35 | 121.0° | 129.1° |
| N33 | C34 | N39 | 131.0° | 126.0° |
| C34 | C35 | N37 | 107.4° | 112.1° |
| C35 | C34 | N39 | 108.0° | 104.9° |
| C35 | N37 | C38 | 106.9° | 104.0° |
| C34 | N39 | C38 | 108.0° | 106.7° |
| C34 | N39 | C41 | 123.7° | 127.3° |
| N37 | C38 | N39 | 109.7° | 112.4° |
| N37 | C38 | H38 | 125.2° | 125.6° |
| N39 | C38 | H38 | 125.2° | 122.0° |
| C38 | N39 | C41 | 128.3° | 126.0° |
| N39 | C41 | C42 | 110.7° | 114.0° |
| N39 | C41 | O44 | 110.2° | 109.7° |
| N39 | C41 | H41 | 107.7° | 105.3° |
| C42 | C41 | O44 | 107.9° | 106.2° |
| C42 | C41 | H41 | 110.0° | 112.6° |
| C41 | C42 | O42 | 105.3° | 111.8° |
| C41 | C42 | C43 | 102.1° | 101.5° |
| C41 | C42 | H42 | 116.5° | 111.1° |
| O44 | C41 | H41 | 110.4° | 109.0° |
| C41 | O44 | C44 | 108.5° | 108.8° |
| O44 | C44 | C43 | 106.1° | 106.4° |
| O44 | C44 | C45 | 110.6° | 108.4° |
| O44 | C44 | H44 | 112.0° | 107.6° |
| O42 | C42 | C43 | 109.1° | 113.0° |
| O42 | C42 | H42 | 110.2° | 108.9° |
| C42 | O42 | HO42 | 109.5° | 107.3° |
| C43 | C42 | H42 | 113.0° | 110.4° |
| C42 | C43 | O43 | 111.9° | 109.5° |
| C42 | C43 | C44 | 102.8° | 102.3° |
| C42 | C43 | H43 | 113.7° | 113.8° |
| O43 | C43 | C44 | 113.4° | 108.8° |
| O43 | C43 | H43 | 103.2° | 107.8° |
| C43 | O43 | HO43 | 109.5° | 106.4° |
| C44 | C43 | H43 | 112.3° | 114.5° |
| C43 | C44 | C45 | 112.5° | 113.0° |
| C43 | C44 | H44 | 110.2° | 111.9° |
| C45 | C44 | H44 | 105.6° | 109.3° |
| C44 | C45 | O45 | 109.0° | 109.0° |
| C44 | C45 | H451 | 109.6° | 110.5° |
| C44 | C45 | H452 | 109.7° | 110.6° |
| O45 | C45 | H451 | 109.6° | 108.8° |
| O45 | C45 | H452 | 109.7° | 108.8° |
| C45 | O45 | PA | 119.4° | 118.6° |
| H451 | C45 | H452 | 109.1° | 109.1° |
| O45 | PA | O2A | 100.4° | 115.7° |
| O45 | PA | O1 | 106.0° | 101.6° |
| O45 | PA | O1A | 113.6° | 103.9° |
| O2A | PA | O1 | 110.4° | 115.6° |
| O2A | PA | O1A | 119.6° | 114.8° |
| O1 | PA | O1A | 106.1° | 103.4° |
| PA | O1 | PB | 124.7° | 132.2° |
| PA | O1A | HO1A | 109.5° | 118.9° |
| O1 | PB | O3A | 101.8° | 103.9° |
| O1 | PB | O3B | 100.4° | 114.6° |
| O1 | PB | O2B | 114.6° | 103.5° |
| O3A | PB | O3B | 108.5° | 115.2° |
| O3A | PB | O2B | 112.3° | 103.4° |
| PB | O3A | PG | 124.0° | 130.9° |
| O3B | PB | O2B | 117.5° | 114.7° |
| PB | O2B | HO2B | 109.5° | 119.0° |
| O3A | PG | O1G | 104.7° | 116.0° |
| O3A | PG | O25 | 102.9° | 101.6° |
| O3A | PG | O2G | 106.9° | 103.7° |
| O1G | PG | O25 | 110.5° | 115.7° |
| O1G | PG | O2G | 118.7° | 114.6° |
| O25 | PG | O2G | 111.6° | 103.3° |
| PG | O25 | C25 | 123.5° | 118.4° |
| PG | O2G | HO2G | 109.5° | 118.9° |
| O25 | C25 | C24 | 110.6° | 109.0° |
| O25 | C25 | H251 | 109.1° | 108.8° |
| O25 | C25 | H252 | 108.8° | 108.7° |
| C24 | C25 | H251 | 109.1° | 110.6° |
| C24 | C25 | H252 | 108.8° | 110.5° |
| C25 | C24 | O24 | 109.8° | 109.7° |
| C25 | C24 | C23 | 114.7° | 113.5° |
| C25 | C24 | H24 | 104.2° | 108.7° |
| H251 | C25 | H252 | 110.4° | 109.1° |
| O24 | C24 | C23 | 104.6° | 105.2° |
| O24 | C24 | H24 | 114.4° | 108.3° |
| C24 | O24 | C21 | 110.6° | 108.3° |
| C23 | C24 | H24 | 109.4° | 111.3° |
| C24 | C23 | C22 | 103.9° | 102.3° |
| C24 | C23 | O23 | 112.3° | 112.1° |
| C24 | C23 | H23 | 111.7° | 110.2° |
| C22 | C23 | O23 | 110.4° | 113.5° |
| C22 | C23 | H23 | 113.5° | 109.6° |
| C23 | C22 | C21 | 103.4° | 102.8° |
| C23 | C22 | O22 | 111.0° | 111.3° |
| C23 | C22 | H22 | 111.4° | 112.7° |
| O23 | C23 | H23 | 105.3° | 109.0° |
| C23 | O23 | HO23 | 109.5° | 106.4° |
| C21 | C22 | O22 | 106.4° | 109.2° |
| C21 | C22 | H22 | 115.7° | 114.0° |
| C22 | C21 | O24 | 107.2° | 107.6° |
| C22 | C21 | N19 | 111.0° | 113.6° |
| C22 | C21 | H21 | 109.8° | 112.6° |
| O22 | C22 | H22 | 108.7° | 106.9° |
| C22 | O22 | HO22 | 109.5° | 107.3° |
| O24 | C21 | N19 | 109.1° | 109.5° |
| O24 | C21 | H21 | 111.7° | 108.3° |
| N19 | C21 | H21 | 108.0° | 105.2° |
| C21 | N19 | C14 | 123.6° | 126.9° |
| C21 | N19 | C18 | 128.9° | 126.2° |
| C14 | N19 | C18 | 107.6° | 106.9° |
| N19 | C14 | C15 | 107.2° | 105.2° |
| N19 | C14 | N13 | 133.4° | 127.5° |
| N19 | C18 | N17 | 110.3° | 112.3° |
| N19 | C18 | H18 | 124.9° | 122.2° |
| C15 | C14 | N13 | 119.3° | 127.2° |
| C14 | C15 | N17 | 109.2° | 110.7° |
| C14 | C15 | C16 | 120.6° | 116.9° |
| C14 | N13 | C12 | 119.5° | 110.4° |
| N13 | C12 | N11 | 121.3° | 128.9° |
| N13 | C12 | H12 | 119.3° | 115.6° |
| N11 | C12 | H12 | 119.4° | 115.5° |
| C12 | N11 | C16 | 122.2° | 117.5° |
| N11 | C16 | C15 | 117.1° | 119.1° |
| N11 | C16 | N16 | 119.2° | 120.2° |
| N17 | C18 | H18 | 124.9° | 125.6° |
| C18 | N17 | C15 | 105.7° | 104.8° |
| N17 | C15 | C16 | 130.2° | 132.4° |
| C15 | C16 | N16 | 123.7° | 120.7° |
| C16 | N16 | H161 | 109.2° | 119.4° |
| C16 | N16 | H162 | 125.4° | 119.4° |
| H161 | N16 | H162 | 125.4° | 120.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O36 | C36 | N31 | C35 | 178.9° | 180.0° |
| O36 | C36 | N31 | C32 | 179.9° | 180.0° |
| O36 | C36 | N31 | HN31 | 0.1° | 0.0° |
| O36 | C36 | C35 | C34 | 179.7° | 180.0° |
| O36 | C36 | C35 | N37 | 0.3° | 0.0° |
| C36 | N31 | C32 | HN31 | 180.0° | 180.0° |
| C36 | N31 | C32 | N32 | 179.3° | 180.0° |
| C36 | N31 | C32 | N33 | 0.5° | 0.0° |
| N31 | C36 | C35 | C34 | 1.4° | 0.0° |
| N31 | C36 | C35 | N37 | 179.2° | 180.0° |
| C35 | C36 | N31 | C32 | 1.0° | 0.0° |
| C35 | C36 | N31 | HN31 | 179.0° | 180.0° |
| C36 | C35 | C34 | N33 | 0.3° | 0.1° |
| C36 | C35 | C34 | N37 | 179.6° | 180.0° |
| C36 | C35 | C34 | N39 | 179.8° | 180.0° |
| C36 | C35 | N37 | C38 | 178.8° | 180.0° |
| N31 | C32 | N32 | N33 | 178.8° | 179.9° |
| N31 | C32 | N32 | H321 | 180.0° | 144.1° |
| N31 | C32 | N32 | H322 | 0.0° | 35.9° |
| N31 | C32 | N33 | C34 | 1.6° | 0.1° |
| HN31 | N31 | C32 | N32 | 0.7° | 0.1° |
| HN31 | N31 | C32 | N33 | 179.5° | 180.0° |
| C32 | N32 | H321 | H322 | 180.0° | 180.0° |
| N32 | C32 | N33 | C34 | 179.6° | 180.0° |
| N33 | C32 | N32 | H321 | 1.1° | 36.0° |
| N33 | C32 | N32 | H322 | 178.9° | 144.0° |
| C32 | N33 | C34 | C35 | 1.2° | 0.1° |
| C32 | N33 | C34 | N39 | 178.7° | 180.0° |
| N33 | C34 | C35 | N39 | 179.9° | 180.0° |
| N33 | C34 | C35 | N37 | 179.8° | 180.0° |
| N33 | C34 | N39 | C38 | 179.1° | 180.0° |
| N33 | C34 | N39 | C41 | 0.7° | 0.1° |
| C34 | C35 | N37 | C38 | 0.6° | 0.0° |
| C35 | C34 | N39 | C38 | 1.1° | 0.0° |
| C35 | C34 | N39 | C41 | 179.1° | 180.0° |
| N37 | C35 | C34 | N39 | 0.3° | 0.0° |
| C35 | N37 | C38 | N39 | 1.3° | 0.0° |
| C35 | N37 | C38 | H38 | 178.7° | 180.0° |
| C34 | N39 | C38 | N37 | 1.5° | 0.0° |
| C34 | N39 | C38 | C41 | 179.8° | 179.9° |
| C34 | N39 | C38 | H38 | 178.5° | 180.0° |
| C34 | N39 | C41 | C42 | 112.2° | 85.9° |
| C34 | N39 | C41 | O44 | 128.5° | 32.9° |
| C34 | N39 | C41 | H41 | 8.0° | 150.1° |
| N37 | C38 | N39 | H38 | 180.0° | 180.0° |
| N37 | C38 | N39 | C41 | 178.7° | 179.9° |
| C38 | N39 | C41 | C42 | 67.5° | 94.0° |
| C38 | N39 | C41 | O44 | 51.8° | 147.1° |
| C38 | N39 | C41 | H41 | 172.2° | 30.0° |
| H38 | C38 | N39 | C41 | 1.3° | 0.0° |
| N39 | C41 | C42 | O44 | 120.6° | 120.9° |
| N39 | C41 | C42 | H41 | 118.9° | 119.9° |
| N39 | C41 | O44 | H41 | 118.8° | 114.8° |
| N39 | C41 | O44 | C44 | 116.5° | 140.6° |
| N39 | C41 | C42 | O42 | 150.0° | 84.1° |
| N39 | C41 | C42 | C43 | 96.0° | 155.2° |
| N39 | C41 | C42 | H42 | 27.6° | 37.9° |
| C42 | C41 | O44 | H41 | 120.2° | 121.6° |
| C42 | C41 | O44 | C44 | 4.4° | 16.9° |
| C41 | C42 | O42 | C43 | 109.0° | 113.8° |
| C41 | C42 | O42 | H42 | 126.4° | 123.2° |
| C41 | C42 | C43 | H42 | 125.9° | 117.9° |
| C41 | C42 | O42 | HO42 | 93.5° | 51.5° |
| C41 | C42 | C43 | O43 | 155.9° | 77.8° |
| C41 | C42 | C43 | C44 | 34.0° | 37.5° |
| C41 | C42 | C43 | H43 | 87.6° | 161.5° |
| O44 | C41 | C42 | O42 | 89.3° | 155.0° |
| O44 | C41 | C42 | C43 | 24.6° | 34.3° |
| O44 | C41 | C42 | H42 | 148.2° | 83.0° |
| C41 | O44 | C44 | C43 | 17.7° | 7.5° |
| C41 | O44 | C44 | C45 | 140.0° | 114.3° |
| C41 | O44 | C44 | H44 | 102.5° | 127.6° |
| H41 | C41 | O44 | C44 | 124.6° | 104.6° |
| H41 | C41 | C42 | O42 | 31.2° | 35.9° |
| H41 | C41 | C42 | C43 | 145.1° | 84.9° |
| H41 | C41 | C42 | H42 | 91.3° | 157.8° |
| O44 | C44 | C43 | C42 | 32.8° | 28.7° |
| O44 | C44 | C43 | O43 | 153.8° | 87.1° |
| O44 | C44 | C43 | C45 | 121.1° | 118.9° |
| O44 | C44 | C43 | H44 | 121.5° | 117.2° |
| O44 | C44 | C43 | H43 | 89.7° | 152.3° |
| O44 | C44 | C45 | H44 | 121.4° | 117.0° |
| O44 | C44 | C45 | O45 | 65.1° | 61.8° |
| O44 | C44 | C45 | H451 | 54.9° | 57.7° |
| O44 | C44 | C45 | H452 | 174.7° | 178.6° |
| O42 | C42 | C43 | H42 | 123.0° | 122.2° |
| O42 | C42 | C43 | O43 | 44.9° | 42.1° |
| O42 | C42 | C43 | C44 | 77.1° | 157.4° |
| O42 | C42 | C43 | H43 | 161.3° | 78.6° |
| C43 | C42 | O42 | HO42 | 15.4° | 62.2° |
| C42 | C43 | O43 | C44 | 115.7° | 111.1° |
| C42 | C43 | O43 | H43 | 122.6° | 124.3° |
| C42 | C43 | C44 | H43 | 122.5° | 123.6° |
| C42 | C43 | O43 | HO43 | 175.7° | 100.8° |
| C42 | C43 | C44 | C45 | 153.9° | 90.2° |
| C42 | C43 | C44 | H44 | 88.6° | 146.0° |
| H42 | C42 | O42 | HO42 | 140.1° | 174.7° |
| H42 | C42 | C43 | O43 | 78.2° | 164.3° |
| H42 | C42 | C43 | C44 | 159.9° | 80.3° |
| H42 | C42 | C43 | H43 | 38.3° | 43.6° |
| O43 | C43 | C44 | H43 | 116.5° | 120.6° |
| O43 | C43 | C44 | C45 | 85.1° | 154.0° |
| O43 | C43 | C44 | H44 | 32.4° | 30.1° |
| C44 | C43 | O43 | HO43 | 68.5° | 10.2° |
| C43 | C44 | C45 | H44 | 120.2° | 125.3° |
| C43 | C44 | C45 | O45 | 53.4° | 179.5° |
| C43 | C44 | C45 | H451 | 173.3° | 60.1° |
| C43 | C44 | C45 | H452 | 66.8° | 60.9° |
| H43 | C43 | O43 | HO43 | 53.1° | 134.9° |
| H43 | C43 | C44 | C45 | 31.4° | 33.4° |
| H43 | C43 | C44 | H44 | 148.9° | 90.5° |
| C44 | C45 | O45 | H451 | 120.0° | 120.6° |
| C44 | C45 | O45 | H452 | 120.2° | 120.7° |
| C44 | C45 | H451 | H452 | 120.2° | 121.8° |
| C44 | C45 | O45 | PA | 176.7° | 150.0° |
| H44 | C44 | C45 | O45 | 173.5° | 55.2° |
| H44 | C44 | C45 | H451 | 66.5° | 174.7° |
| H44 | C44 | C45 | H452 | 53.3° | 64.4° |
| O45 | C45 | H451 | H452 | 120.2° | 118.6° |
| C45 | O45 | PA | O2A | 95.9° | 180.0° |
| C45 | O45 | PA | O1 | 149.2° | 54.0° |
| C45 | O45 | PA | O1A | 33.1° | 53.2° |
| H451 | C45 | O45 | PA | 63.4° | 89.4° |
| H452 | C45 | O45 | PA | 56.5° | 29.4° |
| O45 | PA | O2A | O1 | 111.6° | 118.6° |
| O45 | PA | O2A | O1A | 124.9° | 121.1° |
| O45 | PA | O1 | O1A | 121.0° | 107.6° |
| O45 | PA | O1A | HO1A | 165.5° | 79.6° |
| O45 | PA | O1 | PB | 76.9° | 173.9° |
| O2A | PA | O1 | O1A | 131.0° | 126.4° |
| O2A | PA | O1A | HO1A | 76.2° | 47.7° |
| O2A | PA | O1 | PB | 175.2° | 60.0° |
| O1 | PA | O1A | HO1A | 49.4° | 174.5° |
| PA | O1 | PB | O3A | 59.6° | 173.5° |
| PA | O1 | PB | O3B | 171.2° | 60.0° |
| PA | O1 | PB | O2B | 62.0° | 65.7° |
| O1A | PA | O1 | PB | 44.1° | 66.4° |
| O1 | PB | O3A | O3B | 105.3° | 126.2° |
| O1 | PB | O3A | O2B | 123.1° | 107.8° |
| O1 | PB | O3B | O2B | 124.9° | 119.5° |
| O1 | PB | O2B | HO2B | 91.7° | 172.9° |
| O1 | PB | O3A | PG | 152.8° | 173.8° |
| O3A | PB | O3B | O2B | 128.8° | 119.9° |
| O3A | PB | O2B | HO2B | 152.7° | 79.0° |
| PB | O3A | PG | O1G | 165.4° | 60.0° |
| PB | O3A | PG | O25 | 79.1° | 173.6° |
| PB | O3A | PG | O2G | 38.6° | 66.6° |
| O3B | PB | O2B | HO2B | 25.8° | 47.3° |
| O3B | PB | O3A | PG | 47.5° | 59.9° |
| O2B | PB | O3A | PG | 84.2° | 66.0° |
| O3A | PG | O1G | O25 | 110.1° | 118.9° |
| O3A | PG | O1G | O2G | 119.1° | 120.9° |
| O3A | PG | O25 | O2G | 114.3° | 107.3° |
| O3A | PG | O2G | HO2G | 12.8° | 175.7° |
| O3A | PG | O25 | C25 | 96.9° | 53.4° |
| O1G | PG | O25 | O2G | 134.4° | 126.1° |
| O1G | PG | O2G | HO2G | 130.8° | 48.2° |
| O1G | PG | O25 | C25 | 151.8° | 179.9° |
| O25 | PG | O2G | HO2G | 99.0° | 78.6° |
| PG | O25 | C25 | C24 | 164.1° | 180.0° |
| PG | O25 | C25 | H251 | 44.1° | 59.4° |
| PG | O25 | C25 | H252 | 76.4° | 59.4° |
| O2G | PG | O25 | C25 | 17.4° | 53.9° |
| O25 | C25 | C24 | H251 | 120.0° | 119.6° |
| O25 | C25 | C24 | H252 | 119.5° | 119.5° |
| O25 | C25 | H251 | H252 | 119.5° | 118.5° |
| O25 | C25 | C24 | O24 | 63.7° | 62.2° |
| O25 | C25 | C24 | C23 | 53.8° | 179.5° |
| O25 | C25 | C24 | H24 | 173.4° | 56.0° |
| C24 | C25 | H251 | H252 | 119.5° | 121.8° |
| C25 | C24 | O24 | C23 | 123.6° | 122.4° |
| C25 | C24 | O24 | H24 | 116.7° | 118.5° |
| C25 | C24 | C23 | H24 | 116.7° | 123.0° |
| C25 | C24 | C23 | C22 | 150.3° | 157.1° |
| C25 | C24 | C23 | O23 | 90.4° | 81.0° |
| C25 | C24 | C23 | H23 | 27.6° | 40.6° |
| C25 | C24 | O24 | C21 | 140.4° | 148.9° |
| H251 | C25 | C24 | O24 | 176.3° | 57.5° |
| H251 | C25 | C24 | C23 | 66.2° | 59.9° |
| H251 | C25 | C24 | H24 | 53.4° | 175.7° |
| H252 | C25 | C24 | O24 | 55.8° | 178.4° |
| H252 | C25 | C24 | C23 | 173.3° | 61.0° |
| H252 | C25 | C24 | H24 | 67.1° | 63.4° |
| O24 | C24 | C23 | H24 | 123.0° | 117.0° |
| O24 | C24 | C23 | C22 | 29.9° | 37.1° |
| O24 | C24 | C23 | O23 | 149.2° | 159.0° |
| O24 | C24 | C23 | H23 | 92.8° | 79.3° |
| C24 | O24 | C21 | C22 | 3.0° | 5.1° |
| C24 | O24 | C21 | N19 | 117.3° | 129.0° |
| C24 | O24 | C21 | H21 | 123.4° | 116.9° |
| C24 | C23 | C22 | O23 | 120.6° | 120.9° |
| C24 | C23 | C22 | H23 | 121.5° | 116.9° |
| C24 | C23 | O23 | H23 | 121.7° | 122.3° |
| C24 | C23 | O23 | HO23 | 164.3° | 173.4° |
| C24 | C23 | C22 | C21 | 31.2° | 32.8° |
| C24 | C23 | C22 | O22 | 82.6° | 84.0° |
| C24 | C23 | C22 | H22 | 156.1° | 156.0° |
| C23 | C24 | O24 | C21 | 16.9° | 26.4° |
| H24 | C24 | C23 | C22 | 93.1° | 79.9° |
| H24 | C24 | C23 | O23 | 26.2° | 42.0° |
| H24 | C24 | C23 | H23 | 144.2° | 163.6° |
| H24 | C24 | O24 | C21 | 102.8° | 92.7° |
| C22 | C23 | O23 | H23 | 122.9° | 122.4° |
| C22 | C23 | O23 | HO23 | 48.9° | 71.4° |
| C23 | C22 | C21 | O22 | 117.0° | 118.2° |
| C23 | C22 | C21 | H22 | 122.1° | 122.3° |
| C23 | C22 | O22 | H22 | 122.9° | 123.4° |
| C23 | C22 | O22 | HO22 | 161.7° | 77.5° |
| C23 | C22 | C21 | O24 | 21.7° | 18.1° |
| C23 | C22 | C21 | N19 | 97.4° | 103.2° |
| C23 | C22 | C21 | H21 | 143.3° | 137.3° |
| O23 | C23 | C22 | C21 | 151.8° | 153.8° |
| O23 | C23 | C22 | O22 | 38.0° | 37.0° |
| O23 | C23 | C22 | H22 | 83.3° | 83.1° |
| H23 | C23 | O23 | HO23 | 74.0° | 51.0° |
| H23 | C23 | C22 | C21 | 90.3° | 84.1° |
| H23 | C23 | C22 | O22 | 156.0° | 159.1° |
| H23 | C23 | C22 | H22 | 34.6° | 39.0° |
| C21 | C22 | O22 | H22 | 125.2° | 123.8° |
| C21 | C22 | O22 | HO22 | 49.9° | 35.3° |
| C22 | C21 | O24 | N19 | 120.3° | 123.9° |
| C22 | C21 | O24 | H21 | 120.4° | 121.9° |
| C22 | C21 | N19 | H21 | 120.4° | 123.6° |
| C22 | C21 | N19 | C14 | 91.3° | 93.7° |
| C22 | C21 | N19 | C18 | 90.4° | 86.4° |
| O22 | C22 | C21 | O24 | 95.3° | 100.1° |
| O22 | C22 | C21 | N19 | 145.6° | 138.5° |
| O22 | C22 | C21 | H21 | 26.3° | 19.1° |
| H22 | C22 | O22 | HO22 | 75.3° | 159.1° |
| H22 | C22 | C21 | O24 | 143.8° | 140.4° |
| H22 | C22 | C21 | N19 | 24.7° | 19.0° |
| H22 | C22 | C21 | H21 | 94.6° | 100.4° |
| O24 | C21 | N19 | H21 | 121.6° | 116.1° |
| O24 | C21 | N19 | C14 | 150.7° | 146.0° |
| O24 | C21 | N19 | C18 | 27.5° | 33.9° |
| C21 | N19 | C14 | C18 | 178.6° | 179.9° |
| C21 | N19 | C14 | C15 | 178.8° | 180.0° |
| C21 | N19 | C14 | N13 | 1.5° | 0.2° |
| C21 | N19 | C18 | N17 | 179.1° | 180.0° |
| C21 | N19 | C18 | H18 | 0.8° | 0.0° |
| H21 | C21 | N19 | C14 | 29.1° | 29.9° |
| H21 | C21 | N19 | C18 | 149.2° | 150.0° |
| N19 | C14 | C15 | N13 | 179.7° | 179.9° |
| N19 | C14 | N13 | C12 | 179.8° | 179.9° |
| C14 | N19 | C18 | N17 | 0.6° | 0.0° |
| C14 | N19 | C18 | H18 | 179.3° | 179.9° |
| N19 | C14 | C15 | N17 | 0.2° | 0.0° |
| N19 | C14 | C15 | C16 | 179.9° | 180.0° |
| C18 | N19 | C14 | C15 | 0.2° | 0.0° |
| C18 | N19 | C14 | N13 | 179.9° | 179.9° |
| N19 | C18 | N17 | H18 | 180.0° | 180.0° |
| N19 | C18 | N17 | C15 | 0.8° | 0.0° |
| C15 | C14 | N13 | C12 | 0.2° | 0.1° |
| C14 | C15 | C16 | N11 | 0.1° | 0.0° |
| C14 | C15 | N17 | C18 | 0.6° | 0.0° |
| C14 | C15 | N17 | C16 | 179.6° | 180.0° |
| C14 | C15 | C16 | N16 | 179.7° | 180.0° |
| C14 | N13 | C12 | N11 | 0.2° | 0.0° |
| C14 | N13 | C12 | H12 | 179.8° | 179.9° |
| N13 | C14 | C15 | N17 | 179.4° | 179.9° |
| N13 | C14 | C15 | C16 | 0.2° | 0.1° |
| N13 | C12 | N11 | H12 | 180.0° | 179.9° |
| N13 | C12 | N11 | C16 | 0.2° | 0.0° |
| C12 | N11 | C16 | C15 | 0.1° | 0.0° |
| C12 | N11 | C16 | N16 | 179.7° | 180.0° |
| H12 | C12 | N11 | C16 | 179.8° | 179.9° |
| N11 | C16 | C15 | N17 | 179.4° | 180.0° |
| N11 | C16 | C15 | N16 | 179.6° | 180.0° |
| N11 | C16 | N16 | H161 | 0.2° | 109.4° |
| N11 | C16 | N16 | H162 | 179.8° | 76.8° |
| C18 | N17 | C15 | C16 | 179.8° | 180.0° |
| H18 | C18 | N17 | C15 | 179.2° | 179.9° |
| N17 | C15 | C16 | N16 | 0.2° | 0.0° |
| C15 | C16 | N16 | H161 | 179.8° | 70.6° |
| C15 | C16 | N16 | H162 | 0.2° | 103.2° |
| C16 | N16 | H161 | H162 | 180.0° | 173.7° |
