012
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | O | doub | 1.21Å | 1.23Å | |
| C | N | sing | 1.35Å | 1.38Å | |
| C | C30 | sing | 1.51Å | 1.51Å | |
| N | CA | sing | 1.47Å | 1.47Å | |
| CA | CB | sing | 1.53Å | 1.55Å | |
| CA | C1 | sing | 1.53Å | 1.54Å | |
| CB | CG | sing | 1.51Å | 1.52Å | |
| CG | CD1 | doub | 1.38Å | 1.42Å | Aromatic |
| CG | CD2 | sing | 1.38Å | 1.41Å | Aromatic |
| CD1 | CE1 | sing | 1.38Å | 1.42Å | Aromatic |
| CD2 | CE2 | doub | 1.38Å | 1.42Å | Aromatic |
| CE1 | CZ | doub | 1.38Å | 1.40Å | Aromatic |
| CE2 | CZ | sing | 1.38Å | 1.41Å | Aromatic |
| C1 | OG | sing | 1.43Å | 1.41Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C2 | N2 | sing | 1.47Å | 1.48Å | |
| N2 | C20 | sing | 1.47Å | 1.49Å | |
| C20 | C21 | sing | 1.51Å | 1.51Å | |
| C21 | C22 | doub | 1.38Å | 1.42Å | Aromatic |
| C21 | C26 | sing | 1.38Å | 1.41Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.41Å | Aromatic |
| C23 | C24 | doub | 1.38Å | 1.41Å | Aromatic |
| C24 | C25 | sing | 1.39Å | 1.43Å | Aromatic |
| C25 | C26 | doub | 1.39Å | 1.42Å | Aromatic |
| C25 | N27 | sing | 1.40Å | 1.40Å | |
| N27 | C28 | sing | 1.47Å | 1.47Å | |
| N27 | C29 | sing | 1.47Å | 1.47Å | |
| C30 | N31 | sing | 1.47Å | 1.45Å | |
| C30 | C35 | sing | 1.54Å | 1.52Å | |
| N31 | C32 | sing | 1.34Å | 1.40Å | |
| C32 | O33 | doub | 1.22Å | 1.22Å | |
| C32 | N34 | sing | 1.34Å | 1.42Å | |
| N34 | C35 | sing | 1.47Å | 1.45Å | |
| N34 | C36 | sing | 1.47Å | 1.50Å | |
| C36 | C41 | sing | 1.51Å | 1.51Å | |
| C41 | C42 | doub | 1.38Å | 1.41Å | Aromatic |
| C41 | C46 | sing | 1.38Å | 1.42Å | Aromatic |
| C42 | C43 | sing | 1.39Å | 1.41Å | Aromatic |
| C43 | C44 | doub | 1.39Å | 1.42Å | Aromatic |
| C43 | O47 | sing | 1.36Å | 1.41Å | |
| C44 | C45 | sing | 1.38Å | 1.42Å | Aromatic |
| C45 | C46 | doub | 1.38Å | 1.41Å | Aromatic |
| O47 | C48 | sing | 1.43Å | 1.41Å | |
| N | HN | sing | 0.97Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| CB | HBA | sing | 1.09Å | 1.10Å | |
| CD1 | HD1 | sing | 1.08Å | 1.08Å | |
| CD2 | HD2 | sing | 1.08Å | 1.08Å | |
| CE1 | HE1 | sing | 1.08Å | 1.08Å | |
| CE2 | HE2 | sing | 1.08Å | 1.08Å | |
| CZ | HZ | sing | 1.08Å | 1.08Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| OG | HOG | sing | 0.97Å | 0.95Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| N2 | HN2 | sing | 1.01Å | 1.00Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C28 | H28B | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C29 | H29B | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| N31 | HN31 | sing | 0.97Å | 1.00Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H35A | sing | 1.09Å | 1.10Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H36A | sing | 1.09Å | 1.10Å | |
| C42 | H42 | sing | 1.08Å | 1.08Å | |
| C44 | H44 | sing | 1.08Å | 1.08Å | |
| C45 | H45 | sing | 1.08Å | 1.08Å | |
| C46 | H46 | sing | 1.08Å | 1.08Å | |
| C48 | H48 | sing | 1.09Å | 1.10Å | |
| C48 | H48A | sing | 1.09Å | 1.10Å | |
| C48 | H48B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | N | 127.2° | 120.0° |
| O | C | C30 | 120.6° | 120.0° |
| N | C | C30 | 112.2° | 120.0° |
| C | N | CA | 125.1° | 120.0° |
| C | N | HN | 117.4° | 120.0° |
| C | C30 | N31 | 112.1° | 110.6° |
| C | C30 | C35 | 112.6° | 110.5° |
| C | C30 | H30 | 104.2° | 110.5° |
| N | CA | CB | 108.3° | 109.5° |
| N | CA | C1 | 109.9° | 109.5° |
| CA | N | HN | 117.5° | 120.0° |
| N | CA | HA | 110.9° | 109.5° |
| CB | CA | C1 | 112.1° | 109.5° |
| CA | CB | CG | 111.7° | 109.5° |
| CB | CA | HA | 108.6° | 109.5° |
| CA | CB | HB | 108.8° | 109.5° |
| CA | CB | HBA | 108.2° | 109.4° |
| CA | C1 | OG | 108.7° | 109.5° |
| CA | C1 | C2 | 111.0° | 109.5° |
| C1 | CA | HA | 107.0° | 109.5° |
| CA | C1 | H1 | 109.0° | 109.5° |
| CB | CG | CD1 | 120.6° | 120.0° |
| CB | CG | CD2 | 121.1° | 120.1° |
| CG | CB | HB | 108.7° | 109.5° |
| CG | CB | HBA | 108.2° | 109.5° |
| CD1 | CG | CD2 | 118.3° | 120.0° |
| CG | CD1 | CE1 | 120.6° | 120.0° |
| CG | CD1 | HD1 | 119.7° | 120.0° |
| CG | CD2 | CE2 | 120.9° | 120.0° |
| CG | CD2 | HD2 | 119.5° | 120.0° |
| CD1 | CE1 | CZ | 120.4° | 120.0° |
| CE1 | CD1 | HD1 | 119.7° | 120.0° |
| CD1 | CE1 | HE1 | 119.8° | 120.0° |
| CD2 | CE2 | CZ | 120.2° | 120.0° |
| CE2 | CD2 | HD2 | 119.6° | 120.0° |
| CD2 | CE2 | HE2 | 119.9° | 120.0° |
| CE1 | CZ | CE2 | 119.5° | 120.0° |
| CZ | CE1 | HE1 | 119.8° | 120.0° |
| CE1 | CZ | HZ | 120.2° | 120.0° |
| CZ | CE2 | HE2 | 119.9° | 120.0° |
| CE2 | CZ | HZ | 120.3° | 120.0° |
| OG | C1 | C2 | 109.6° | 109.5° |
| OG | C1 | H1 | 110.4° | 109.4° |
| C1 | OG | HOG | 109.5° | 114.0° |
| C1 | C2 | N2 | 112.5° | 109.5° |
| C2 | C1 | H1 | 108.2° | 109.5° |
| C1 | C2 | H2 | 108.5° | 109.5° |
| C1 | C2 | H2A | 107.8° | 109.5° |
| C2 | N2 | C20 | 115.6° | 111.0° |
| N2 | C2 | H2 | 108.4° | 109.5° |
| N2 | C2 | H2A | 107.8° | 109.4° |
| C2 | N2 | HN2 | 107.5° | 110.9° |
| N2 | C20 | C21 | 111.4° | 109.5° |
| C20 | N2 | HN2 | 107.5° | 111.0° |
| N2 | C20 | H20 | 108.8° | 109.5° |
| N2 | C20 | H20A | 108.4° | 109.5° |
| C20 | C21 | C22 | 121.2° | 120.0° |
| C20 | C21 | C26 | 119.4° | 120.0° |
| C21 | C20 | H20 | 108.8° | 109.5° |
| C21 | C20 | H20A | 108.4° | 109.5° |
| C22 | C21 | C26 | 119.4° | 120.1° |
| C21 | C22 | C23 | 120.3° | 120.2° |
| C21 | C22 | H22 | 119.9° | 119.9° |
| C21 | C26 | C25 | 121.5° | 119.9° |
| C21 | C26 | H26 | 119.2° | 120.0° |
| C22 | C23 | C24 | 119.9° | 120.1° |
| C23 | C22 | H22 | 119.8° | 119.9° |
| C22 | C23 | H23 | 120.1° | 120.0° |
| C23 | C24 | C25 | 120.7° | 119.9° |
| C24 | C23 | H23 | 120.0° | 119.9° |
| C23 | C24 | H24 | 119.6° | 120.0° |
| C24 | C25 | C26 | 118.2° | 119.9° |
| C24 | C25 | N27 | 121.3° | 120.1° |
| C25 | C24 | H24 | 119.6° | 120.1° |
| C26 | C25 | N27 | 120.5° | 120.0° |
| C25 | C26 | H26 | 119.3° | 120.0° |
| C25 | N27 | C28 | 120.7° | 120.0° |
| C25 | N27 | C29 | 121.1° | 120.0° |
| C28 | N27 | C29 | 118.2° | 120.0° |
| N27 | C28 | H28 | 109.5° | 109.4° |
| N27 | C28 | H28A | 109.5° | 109.5° |
| N27 | C28 | H28B | 109.5° | 109.5° |
| N27 | C29 | H29 | 109.5° | 109.4° |
| N27 | C29 | H29A | 109.5° | 109.5° |
| N27 | C29 | H29B | 109.4° | 109.5° |
| N31 | C30 | C35 | 105.1° | 103.8° |
| C30 | N31 | C32 | 99.6° | 109.2° |
| N31 | C30 | H30 | 111.8° | 110.6° |
| C30 | N31 | HN31 | 130.2° | 125.3° |
| C30 | C35 | N34 | 101.9° | 103.9° |
| C35 | C30 | H30 | 111.3° | 110.7° |
| C30 | C35 | H35 | 112.0° | 110.6° |
| C30 | C35 | H35A | 113.7° | 110.5° |
| N31 | C32 | O33 | 119.9° | 123.1° |
| N31 | C32 | N34 | 117.3° | 113.9° |
| C32 | N31 | HN31 | 130.2° | 125.5° |
| O33 | C32 | N34 | 122.8° | 123.0° |
| C32 | N34 | C35 | 100.6° | 109.2° |
| C32 | N34 | C36 | 116.1° | 125.4° |
| C35 | N34 | C36 | 117.6° | 125.4° |
| N34 | C35 | H35 | 112.1° | 110.5° |
| N34 | C35 | H35A | 113.6° | 110.6° |
| N34 | C36 | C41 | 119.8° | 109.5° |
| N34 | C36 | H36 | 106.2° | 109.5° |
| N34 | C36 | H36A | 103.8° | 109.5° |
| C36 | C41 | C42 | 120.6° | 120.0° |
| C36 | C41 | C46 | 120.4° | 120.0° |
| C41 | C36 | H36 | 106.1° | 109.5° |
| C41 | C36 | H36A | 103.8° | 109.5° |
| C42 | C41 | C46 | 118.9° | 120.1° |
| C41 | C42 | C43 | 121.6° | 119.9° |
| C41 | C42 | H42 | 119.2° | 120.0° |
| C41 | C46 | C45 | 120.3° | 120.1° |
| C41 | C46 | H46 | 119.8° | 120.0° |
| C42 | C43 | C44 | 118.9° | 119.9° |
| C42 | C43 | O47 | 117.6° | 120.0° |
| C43 | C42 | H42 | 119.2° | 120.0° |
| C44 | C43 | O47 | 123.5° | 120.1° |
| C43 | C44 | C45 | 120.3° | 120.0° |
| C43 | C44 | H44 | 119.8° | 120.0° |
| C43 | O47 | C48 | 114.7° | 117.0° |
| C44 | C45 | C46 | 119.9° | 120.0° |
| C45 | C44 | H44 | 119.9° | 120.0° |
| C44 | C45 | H45 | 120.0° | 120.0° |
| C46 | C45 | H45 | 120.0° | 120.0° |
| C45 | C46 | H46 | 119.8° | 119.9° |
| O47 | C48 | H48 | 109.5° | 109.4° |
| O47 | C48 | H48A | 109.4° | 109.4° |
| O47 | C48 | H48B | 109.5° | 109.5° |
| HB | CB | HBA | 111.2° | 109.5° |
| H2 | C2 | H2A | 111.9° | 109.4° |
| H20 | C20 | H20A | 111.0° | 109.5° |
| H28 | C28 | H28A | 109.5° | 109.5° |
| H28 | C28 | H28B | 109.4° | 109.4° |
| H28A | C28 | H28B | 109.5° | 109.5° |
| H29 | C29 | H29A | 109.4° | 109.5° |
| H29 | C29 | H29B | 109.5° | 109.5° |
| H29A | C29 | H29B | 109.5° | 109.5° |
| H35 | C35 | H35A | 103.8° | 110.6° |
| H36 | C36 | H36A | 118.0° | 109.5° |
| H48 | C48 | H48A | 109.5° | 109.4° |
| H48 | C48 | H48B | 109.4° | 109.6° |
| H48A | C48 | H48B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | N | C30 | 178.6° | 179.7° |
| O | C | N | CA | 0.0° | 0.0° |
| O | C | C30 | N31 | 160.7° | 18.5° |
| O | C | C30 | C35 | 81.1° | 95.9° |
| O | C | N | HN | 180.0° | 180.0° |
| O | C | C30 | H30 | 39.6° | 141.3° |
| C | N | CA | HN | 180.0° | 180.0° |
| C | N | CA | CB | 106.0° | 85.0° |
| C | N | CA | C1 | 131.2° | 155.0° |
| N | C | C30 | N31 | 20.6° | 161.2° |
| N | C | C30 | C35 | 97.6° | 84.4° |
| C | N | CA | HA | 13.1° | 35.0° |
| N | C | C30 | H30 | 141.7° | 38.5° |
| C30 | C | N | CA | 178.6° | 179.7° |
| C | C30 | N31 | C35 | 122.6° | 118.6° |
| C | C30 | N31 | H30 | 116.6° | 122.7° |
| C | C30 | C35 | H30 | 116.5° | 122.7° |
| C | C30 | N31 | C32 | 151.9° | 118.6° |
| C | C30 | C35 | N34 | 162.7° | 118.6° |
| C30 | C | N | HN | 1.4° | 0.3° |
| C | C30 | N31 | HN31 | 28.1° | 61.5° |
| C | C30 | C35 | H35 | 42.6° | 0.0° |
| C | C30 | C35 | H35A | 74.7° | 122.8° |
| N | CA | CB | C1 | 121.4° | 120.0° |
| N | CA | CB | HA | 120.5° | 120.0° |
| N | CA | C1 | HA | 120.5° | 120.0° |
| N | CA | CB | CG | 56.3° | 65.0° |
| N | CA | C1 | OG | 179.8° | 65.0° |
| N | CA | C1 | C2 | 59.3° | 175.0° |
| N | CA | CB | HB | 63.7° | 55.0° |
| N | CA | CB | HBA | 175.4° | 175.0° |
| N | CA | C1 | H1 | 59.8° | 55.0° |
| CB | CA | C1 | HA | 119.0° | 120.0° |
| CA | CB | CG | HB | 120.0° | 120.0° |
| CA | CB | CG | HBA | 119.0° | 119.9° |
| CA | CB | CG | CD1 | 111.3° | 90.0° |
| CA | CB | CG | CD2 | 67.9° | 90.3° |
| CB | CA | C1 | OG | 59.7° | 55.0° |
| CB | CA | C1 | C2 | 179.8° | 65.0° |
| CB | CA | N | HN | 74.0° | 95.0° |
| CA | CB | HB | HBA | 119.1° | 120.0° |
| CB | CA | C1 | H1 | 60.7° | 175.0° |
| C1 | CA | CB | CG | 177.7° | 175.0° |
| CA | C1 | OG | C2 | 121.4° | 120.0° |
| CA | C1 | OG | H1 | 119.5° | 120.0° |
| CA | C1 | C2 | H1 | 119.5° | 120.0° |
| CA | C1 | C2 | N2 | 160.2° | 175.0° |
| C1 | CA | N | HN | 48.8° | 25.0° |
| C1 | CA | CB | HB | 57.7° | 65.0° |
| C1 | CA | CB | HBA | 63.2° | 55.0° |
| CA | C1 | OG | HOG | 136.8° | 60.0° |
| CA | C1 | C2 | H2 | 79.8° | 54.9° |
| CA | C1 | C2 | H2A | 41.5° | 65.0° |
| CB | CG | CD1 | CD2 | 179.3° | 179.7° |
| CB | CG | CD1 | CE1 | 179.3° | 180.0° |
| CB | CG | CD2 | CE2 | 179.2° | 180.0° |
| CG | CB | CA | HA | 64.2° | 55.0° |
| CG | CB | HB | HBA | 119.1° | 120.0° |
| CB | CG | CD1 | HD1 | 0.7° | 0.0° |
| CB | CG | CD2 | HD2 | 0.8° | 0.0° |
| CG | CD1 | CE1 | HD1 | 180.0° | 180.0° |
| CD1 | CG | CD2 | CE2 | 0.0° | 0.3° |
| CG | CD1 | CE1 | CZ | 0.2° | 0.0° |
| CD1 | CG | CB | HB | 8.7° | 30.0° |
| CD1 | CG | CB | HBA | 129.6° | 150.0° |
| CD1 | CG | CD2 | HD2 | 180.0° | 179.7° |
| CG | CD1 | CE1 | HE1 | 179.8° | 180.0° |
| CD2 | CG | CD1 | CE1 | 0.1° | 0.3° |
| CG | CD2 | CE2 | HD2 | 180.0° | 180.0° |
| CG | CD2 | CE2 | CZ | 0.0° | 0.1° |
| CD2 | CG | CB | HB | 172.1° | 149.7° |
| CD2 | CG | CB | HBA | 51.2° | 29.7° |
| CD2 | CG | CD1 | HD1 | 179.9° | 179.7° |
| CG | CD2 | CE2 | HE2 | 179.9° | 180.0° |
| CD1 | CE1 | CZ | HE1 | 180.0° | 180.0° |
| CD1 | CE1 | CZ | CE2 | 0.2° | 0.2° |
| CD1 | CE1 | CZ | HZ | 179.8° | 180.0° |
| CD2 | CE2 | CZ | CE1 | 0.1° | 0.2° |
| CD2 | CE2 | CZ | HE2 | 180.0° | 179.9° |
| CD2 | CE2 | CZ | HZ | 179.9° | 180.0° |
| CE1 | CZ | CE2 | HZ | 180.0° | 179.8° |
| CZ | CE1 | CD1 | HD1 | 179.8° | 180.0° |
| CE1 | CZ | CE2 | HE2 | 179.9° | 179.7° |
| CZ | CE2 | CD2 | HD2 | 180.0° | 180.0° |
| CE2 | CZ | CE1 | HE1 | 179.8° | 179.8° |
| OG | C1 | C2 | H1 | 120.4° | 120.0° |
| OG | C1 | C2 | N2 | 40.2° | 65.0° |
| OG | C1 | CA | HA | 59.4° | 175.0° |
| OG | C1 | C2 | H2 | 160.1° | 175.0° |
| OG | C1 | C2 | H2A | 78.5° | 55.0° |
| C1 | C2 | N2 | H2 | 120.0° | 120.1° |
| C1 | C2 | N2 | H2A | 118.7° | 120.0° |
| C1 | C2 | N2 | C20 | 158.8° | 180.0° |
| C2 | C1 | CA | HA | 61.2° | 55.0° |
| C2 | C1 | OG | HOG | 15.4° | 60.1° |
| C1 | C2 | H2 | H2A | 118.8° | 120.0° |
| C1 | C2 | N2 | HN2 | 38.7° | 56.0° |
| C2 | N2 | C20 | HN2 | 120.0° | 123.9° |
| C2 | N2 | C20 | C21 | 64.8° | 180.0° |
| N2 | C2 | C1 | H1 | 80.3° | 55.0° |
| N2 | C2 | H2 | H2A | 118.7° | 119.9° |
| C2 | N2 | C20 | H20 | 175.2° | 60.0° |
| C2 | N2 | C20 | H20A | 54.4° | 60.0° |
| N2 | C20 | C21 | H20 | 120.0° | 120.0° |
| N2 | C20 | C21 | H20A | 119.2° | 120.0° |
| N2 | C20 | C21 | C22 | 110.3° | 90.0° |
| N2 | C20 | C21 | C26 | 69.0° | 90.3° |
| C20 | N2 | C2 | H2 | 81.3° | 59.9° |
| C20 | N2 | C2 | H2A | 40.1° | 60.0° |
| N2 | C20 | H20 | H20A | 119.2° | 120.0° |
| C20 | C21 | C22 | C26 | 179.2° | 179.7° |
| C20 | C21 | C22 | C23 | 179.2° | 180.0° |
| C20 | C21 | C26 | C25 | 179.2° | 179.8° |
| C21 | C20 | N2 | HN2 | 55.3° | 56.1° |
| C21 | C20 | H20 | H20A | 119.2° | 120.0° |
| C20 | C21 | C22 | H22 | 0.9° | 0.1° |
| C20 | C21 | C26 | H26 | 0.8° | 0.0° |
| C21 | C22 | C23 | H22 | 180.0° | 179.9° |
| C21 | C22 | C23 | C24 | 0.0° | 0.1° |
| C22 | C21 | C26 | C25 | 0.1° | 0.5° |
| C22 | C21 | C20 | H20 | 129.7° | 30.0° |
| C22 | C21 | C20 | H20A | 8.9° | 149.9° |
| C21 | C22 | C23 | H23 | 180.0° | 179.9° |
| C22 | C21 | C26 | H26 | 179.9° | 179.7° |
| C26 | C21 | C22 | C23 | 0.1° | 0.3° |
| C21 | C26 | C25 | C24 | 0.0° | 0.5° |
| C21 | C26 | C25 | H26 | 180.0° | 179.8° |
| C21 | C26 | C25 | N27 | 179.9° | 179.7° |
| C26 | C21 | C20 | H20 | 51.0° | 149.7° |
| C26 | C21 | C20 | H20A | 171.8° | 29.8° |
| C26 | C21 | C22 | H22 | 179.9° | 179.8° |
| C22 | C23 | C24 | H23 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.1° | 0.1° |
| C22 | C23 | C24 | H24 | 179.9° | 180.0° |
| C23 | C24 | C25 | H24 | 180.0° | 179.9° |
| C23 | C24 | C25 | C26 | 0.1° | 0.3° |
| C23 | C24 | C25 | N27 | 180.0° | 179.9° |
| C24 | C23 | C22 | H22 | 180.0° | 180.0° |
| C24 | C25 | C26 | N27 | 179.8° | 179.8° |
| C24 | C25 | N27 | C28 | 11.2° | 0.0° |
| C24 | C25 | N27 | C29 | 168.8° | 180.0° |
| C25 | C24 | C23 | H23 | 179.9° | 180.0° |
| C24 | C25 | C26 | H26 | 180.0° | 179.7° |
| C26 | C25 | N27 | C28 | 168.7° | 179.8° |
| C26 | C25 | N27 | C29 | 11.4° | 0.1° |
| C26 | C25 | C24 | H24 | 179.9° | 179.8° |
| C25 | N27 | C28 | C29 | 180.0° | 180.0° |
| N27 | C25 | C24 | H24 | 0.1° | 0.0° |
| N27 | C25 | C26 | H26 | 0.2° | 0.1° |
| C25 | N27 | C28 | H28 | 109.7° | 89.9° |
| C25 | N27 | C28 | H28A | 10.3° | 150.0° |
| C25 | N27 | C28 | H28B | 130.3° | 30.0° |
| C25 | N27 | C29 | H29 | 77.7° | 60.0° |
| C25 | N27 | C29 | H29A | 162.3° | 179.9° |
| C25 | N27 | C29 | H29B | 42.3° | 59.9° |
| N27 | C28 | H28 | H28A | 120.0° | 120.0° |
| N27 | C28 | H28 | H28B | 120.0° | 120.0° |
| N27 | C28 | H28A | H28B | 120.0° | 120.0° |
| C28 | N27 | C29 | H29 | 102.3° | 120.0° |
| C28 | N27 | C29 | H29A | 17.7° | 0.0° |
| C28 | N27 | C29 | H29B | 137.8° | 120.0° |
| C29 | N27 | C28 | H28 | 70.3° | 90.0° |
| C29 | N27 | C28 | H28A | 169.7° | 30.0° |
| C29 | N27 | C28 | H28B | 49.7° | 150.1° |
| N27 | C29 | H29 | H29A | 120.0° | 120.0° |
| N27 | C29 | H29 | H29B | 120.0° | 120.0° |
| N27 | C29 | H29A | H29B | 120.0° | 120.0° |
| N31 | C30 | C35 | H30 | 121.2° | 118.7° |
| C30 | N31 | C32 | HN31 | 180.0° | 179.9° |
| C30 | N31 | C32 | O33 | 170.4° | 180.0° |
| C30 | N31 | C32 | N34 | 9.0° | 0.0° |
| N31 | C30 | C35 | N34 | 40.4° | 0.0° |
| N31 | C30 | C35 | H35 | 79.6° | 118.6° |
| N31 | C30 | C35 | H35A | 163.1° | 118.6° |
| C35 | C30 | N31 | C32 | 29.3° | 0.0° |
| C30 | C35 | N34 | C32 | 32.3° | 0.0° |
| C30 | C35 | N34 | H35 | 120.0° | 118.7° |
| C30 | C35 | N34 | H35A | 122.7° | 118.6° |
| C30 | C35 | N34 | C36 | 159.3° | 180.0° |
| C35 | C30 | N31 | HN31 | 150.7° | 180.0° |
| C30 | C35 | H35 | H35A | 123.1° | 122.8° |
| N31 | C32 | O33 | N34 | 179.4° | 180.0° |
| N31 | C32 | N34 | C35 | 15.9° | 0.0° |
| N31 | C32 | N34 | C36 | 144.0° | 180.0° |
| C32 | N31 | C30 | H30 | 91.6° | 118.7° |
| O33 | C32 | N34 | C35 | 164.7° | 180.0° |
| O33 | C32 | N34 | C36 | 36.6° | 0.0° |
| O33 | C32 | N31 | HN31 | 9.6° | 0.1° |
| C32 | N34 | C35 | C36 | 127.1° | 180.0° |
| C32 | N34 | C36 | C41 | 77.7° | 90.0° |
| N34 | C32 | N31 | HN31 | 171.0° | 180.0° |
| C32 | N34 | C35 | H35 | 87.7° | 118.7° |
| C32 | N34 | C35 | H35A | 155.0° | 118.6° |
| C32 | N34 | C36 | H36 | 162.3° | 150.0° |
| C32 | N34 | C36 | H36A | 37.3° | 30.0° |
| C35 | N34 | C36 | C41 | 41.4° | 90.0° |
| N34 | C35 | C30 | H30 | 80.8° | 118.7° |
| N34 | C35 | H35 | H35A | 123.0° | 122.8° |
| C35 | N34 | C36 | H36 | 78.6° | 30.0° |
| C35 | N34 | C36 | H36A | 156.4° | 150.0° |
| N34 | C36 | C41 | H36 | 120.0° | 120.0° |
| N34 | C36 | C41 | H36A | 115.0° | 120.0° |
| N34 | C36 | C41 | C42 | 72.3° | 90.0° |
| N34 | C36 | C41 | C46 | 108.4° | 90.2° |
| C36 | N34 | C35 | H35 | 39.4° | 61.4° |
| C36 | N34 | C35 | H35A | 78.0° | 61.4° |
| N34 | C36 | H36 | H36A | 115.8° | 120.0° |
| C36 | C41 | C42 | C46 | 179.3° | 179.8° |
| C36 | C41 | C42 | C43 | 179.5° | 180.0° |
| C36 | C41 | C46 | C45 | 179.5° | 179.7° |
| C41 | C36 | H36 | H36A | 115.7° | 120.0° |
| C36 | C41 | C42 | H42 | 0.5° | 0.0° |
| C36 | C41 | C46 | H46 | 0.5° | 0.0° |
| C41 | C42 | C43 | H42 | 180.0° | 180.0° |
| C41 | C42 | C43 | C44 | 0.1° | 0.0° |
| C41 | C42 | C43 | O47 | 179.5° | 180.0° |
| C42 | C41 | C46 | C45 | 0.2° | 0.5° |
| C42 | C41 | C36 | H36 | 167.7° | 30.1° |
| C42 | C41 | C36 | H36A | 42.7° | 150.0° |
| C42 | C41 | C46 | H46 | 179.8° | 179.8° |
| C46 | C41 | C42 | C43 | 0.2° | 0.2° |
| C41 | C46 | C45 | C44 | 0.1° | 0.5° |
| C41 | C46 | C45 | H46 | 180.0° | 179.7° |
| C46 | C41 | C36 | H36 | 11.6° | 149.7° |
| C46 | C41 | C36 | H36A | 136.6° | 29.7° |
| C46 | C41 | C42 | H42 | 179.8° | 179.8° |
| C41 | C46 | C45 | H45 | 179.9° | 179.8° |
| C42 | C43 | C44 | O47 | 179.4° | 180.0° |
| C42 | C43 | C44 | C45 | 0.1° | 0.0° |
| C42 | C43 | O47 | C48 | 106.1° | 180.0° |
| C42 | C43 | C44 | H44 | 179.9° | 180.0° |
| C43 | C44 | C45 | H44 | 180.0° | 180.0° |
| C43 | C44 | C45 | C46 | 0.1° | 0.3° |
| C44 | C43 | O47 | C48 | 74.5° | 0.0° |
| C44 | C43 | C42 | H42 | 179.9° | 180.0° |
| C43 | C44 | C45 | H45 | 179.9° | 180.0° |
| O47 | C43 | C44 | C45 | 179.3° | 180.0° |
| O47 | C43 | C42 | H42 | 0.5° | 0.0° |
| O47 | C43 | C44 | H44 | 0.7° | 0.0° |
| C43 | O47 | C48 | H48 | 85.9° | 60.0° |
| C43 | O47 | C48 | H48A | 34.1° | 59.9° |
| C43 | O47 | C48 | H48B | 154.1° | 180.0° |
| C44 | C45 | C46 | H45 | 180.0° | 179.7° |
| C44 | C45 | C46 | H46 | 179.9° | 179.7° |
| C46 | C45 | C44 | H44 | 180.0° | 179.7° |
| O47 | C48 | H48 | H48A | 120.0° | 119.9° |
| O47 | C48 | H48 | H48B | 120.0° | 120.0° |
| O47 | C48 | H48A | H48B | 120.0° | 120.0° |
| HN | N | CA | HA | 166.9° | 145.0° |
| HA | CA | CB | HB | 175.8° | 175.0° |
| HA | CA | CB | HBA | 54.8° | 65.0° |
| HA | CA | C1 | H1 | 179.8° | 65.0° |
| HD1 | CD1 | CE1 | HE1 | 0.2° | 0.0° |
| HD2 | CD2 | CE2 | HE2 | 0.1° | 0.0° |
| HE1 | CE1 | CZ | HZ | 0.2° | 0.1° |
| HE2 | CE2 | CZ | HZ | 0.1° | 0.1° |
| H1 | C1 | OG | HOG | 103.7° | 179.9° |
| H1 | C1 | C2 | H2 | 39.7° | 65.1° |
| H1 | C1 | C2 | H2A | 161.1° | 175.0° |
| H2 | C2 | N2 | HN2 | 158.7° | 176.1° |
| H2A | C2 | N2 | HN2 | 80.0° | 64.0° |
| HN2 | N2 | C20 | H20 | 64.7° | 176.1° |
| HN2 | N2 | C20 | H20A | 174.4° | 63.9° |
| H22 | C22 | C23 | H23 | 0.0° | 0.0° |
| H23 | C23 | C24 | H24 | 0.1° | 0.1° |
| H28 | C28 | H28A | H28B | 120.0° | 120.0° |
| H29 | C29 | H29A | H29B | 120.0° | 120.0° |
| H30 | C30 | N31 | HN31 | 88.4° | 61.2° |
| H30 | C30 | C35 | H35 | 159.2° | 122.7° |
| H30 | C30 | C35 | H35A | 41.9° | 0.1° |
| H44 | C44 | C45 | H45 | 0.0° | 0.1° |
| H45 | C45 | C46 | H46 | 0.1° | 0.1° |
| H48 | C48 | H48A | H48B | 120.0° | 120.1° |
