0PO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | doub | 1.32Å | 1.35Å | Aromatic |
| N1 | C10 | sing | 1.33Å | 1.34Å | Aromatic |
| C2 | C3 | sing | 1.40Å | 1.39Å | Aromatic |
| C2 | C | sing | 1.48Å | 1.44Å | |
| C3 | C4 | doub | 1.36Å | 1.40Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | C9 | sing | 1.41Å | 1.39Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | C6 | doub | 1.36Å | 1.38Å | Aromatic |
| C5 | C9 | sing | 1.40Å | 1.41Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | C7 | sing | 1.39Å | 1.37Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | C8 | doub | 1.36Å | 1.40Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C8 | C10 | sing | 1.41Å | 1.38Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C9 | C10 | doub | 1.42Å | 1.36Å | Aromatic |
| C | O1 | doub | 1.22Å | 1.26Å | |
| N | CA | sing | 1.46Å | 1.45Å | |
| N | H | sing | 0.97Å | 1.00Å | |
| CA | C1 | sing | 1.51Å | 1.50Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| C1 | O | doub | 1.21Å | 1.23Å | |
| CB | CG1 | sing | 1.53Å | 1.52Å | |
| CB | CG2 | sing | 1.53Å | 1.54Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| CG1 | HG11 | sing | 1.09Å | 1.10Å | |
| CG1 | HG12 | sing | 1.09Å | 1.10Å | |
| CG1 | HG13 | sing | 1.09Å | 1.10Å | |
| CG2 | HG21 | sing | 1.09Å | 1.10Å | |
| CG2 | HG22 | sing | 1.09Å | 1.10Å | |
| CG2 | HG23 | sing | 1.09Å | 1.10Å | |
| N2 | CA1 | sing | 1.46Å | 1.46Å | |
| N2 | H1 | sing | 0.97Å | 1.00Å | |
| CA1 | CC | sing | 1.53Å | 1.51Å | |
| CA1 | CB1 | sing | 1.53Å | 1.54Å | |
| CA1 | HA1 | sing | 1.09Å | 1.10Å | |
| CC | OXT | sing | 1.43Å | 1.43Å | |
| CC | CM | sing | 1.53Å | 1.51Å | |
| CC | HC | sing | 1.09Å | 1.10Å | |
| OXT | HOR | sing | 0.97Å | 0.95Å | |
| CB1 | CG | sing | 1.51Å | 1.51Å | |
| CB1 | HB2 | sing | 1.09Å | 1.10Å | |
| CB1 | HB3 | sing | 1.09Å | 1.10Å | |
| CG | CD1 | doub | 1.38Å | 1.39Å | Aromatic |
| CG | CD2 | sing | 1.38Å | 1.39Å | Aromatic |
| CD1 | CE1 | sing | 1.38Å | 1.40Å | Aromatic |
| CD1 | HD1 | sing | 1.08Å | 1.08Å | |
| CD2 | CE2 | doub | 1.38Å | 1.40Å | Aromatic |
| CD2 | HD2 | sing | 1.08Å | 1.08Å | |
| CE1 | CZ | doub | 1.38Å | 1.39Å | Aromatic |
| CE1 | HE1 | sing | 1.08Å | 1.08Å | |
| CE2 | CZ | sing | 1.38Å | 1.39Å | Aromatic |
| CE2 | HE2 | sing | 1.08Å | 1.08Å | |
| CZ | HZ | sing | 1.08Å | 1.08Å | |
| CM | HM1 | sing | 1.09Å | 1.10Å | |
| CM | HM2 | sing | 1.09Å | 1.10Å | |
| N11 | C21 | sing | 1.47Å | 1.49Å | |
| N11 | C61 | sing | 1.47Å | 1.48Å | |
| C21 | C31 | sing | 1.53Å | 1.51Å | |
| C21 | CD | sing | 1.51Å | 1.52Å | |
| C21 | H2 | sing | 1.09Å | 1.10Å | |
| C31 | C41 | sing | 1.53Å | 1.53Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H32 | sing | 1.09Å | 1.10Å | |
| C41 | C51 | sing | 1.53Å | 1.49Å | |
| C41 | H41 | sing | 1.09Å | 1.10Å | |
| C51 | C61 | sing | 1.53Å | 1.52Å | |
| C51 | H51 | sing | 1.09Å | 1.10Å | |
| C51 | H52 | sing | 1.09Å | 1.10Å | |
| C61 | H61 | sing | 1.09Å | 1.10Å | |
| C61 | H62 | sing | 1.09Å | 1.10Å | |
| CD | O2 | doub | 1.21Å | 1.26Å | |
| CD | N3 | sing | 1.35Å | 1.40Å | |
| N3 | C1' | sing | 1.46Å | 1.42Å | |
| N3 | HN | sing | 0.97Å | 1.00Å | |
| C1' | C2' | sing | 1.53Å | 1.52Å | |
| C1' | C3' | sing | 1.53Å | 1.50Å | |
| C1' | C4' | sing | 1.53Å | 1.53Å | |
| C2' | H2'1 | sing | 1.09Å | 1.10Å | |
| C2' | H2'2 | sing | 1.09Å | 1.10Å | |
| C2' | H2'3 | sing | 1.09Å | 1.10Å | |
| C3' | H3'1 | sing | 1.09Å | 1.10Å | |
| C3' | H3'2 | sing | 1.09Å | 1.10Å | |
| C3' | H3'3 | sing | 1.09Å | 1.10Å | |
| C4' | H4'1 | sing | 1.09Å | 1.10Å | |
| C4' | H4'2 | sing | 1.09Å | 1.10Å | |
| C4' | H4'3 | sing | 1.09Å | 1.10Å | |
| N12 | C22 | doub | 1.32Å | 1.35Å | Aromatic |
| N12 | C62 | sing | 1.32Å | 1.34Å | Aromatic |
| C22 | C32 | sing | 1.38Å | 1.41Å | Aromatic |
| C22 | H21 | sing | 1.08Å | 1.08Å | |
| C32 | C42 | doub | 1.39Å | 1.39Å | Aromatic |
| C32 | CE | sing | 1.51Å | 1.48Å | |
| C42 | C52 | sing | 1.39Å | 1.40Å | Aromatic |
| C42 | H42 | sing | 1.08Å | 1.08Å | |
| C52 | C62 | doub | 1.38Å | 1.41Å | Aromatic |
| C52 | H53 | sing | 1.08Å | 1.08Å | |
| C62 | H63 | sing | 1.08Å | 1.08Å | |
| CE | S | sing | 1.81Å | 1.84Å | |
| CE | H11 | sing | 1.09Å | 1.10Å | |
| CE | H2A | sing | 1.09Å | 1.10Å | |
| C | N | sing | 1.35Å | 1.36Å | |
| C1 | N2 | sing | 1.35Å | 1.33Å | |
| CM | N11 | sing | 1.47Å | 1.44Å | |
| C41 | S | sing | 1.81Å | 1.81Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | C10 | 126.6° | 121.3° |
| N1 | C2 | C3 | 115.2° | 121.5° |
| N1 | C2 | C | 122.2° | 119.2° |
| N1 | C10 | C8 | 121.3° | 121.0° |
| N1 | C10 | C9 | 118.8° | 120.0° |
| C3 | C2 | C | 122.4° | 119.2° |
| C2 | C3 | C4 | 120.4° | 119.8° |
| C2 | C3 | H3 | 119.8° | 120.1° |
| C2 | C | O1 | 124.7° | 120.0° |
| C2 | C | N | 114.1° | 120.0° |
| C4 | C3 | H3 | 119.8° | 120.1° |
| C3 | C4 | C9 | 120.2° | 118.2° |
| C3 | C4 | H4 | 119.9° | 120.9° |
| C9 | C4 | H4 | 119.9° | 120.9° |
| C4 | C9 | C5 | 121.5° | 121.3° |
| C4 | C9 | C10 | 118.7° | 119.1° |
| C6 | C5 | C9 | 121.1° | 119.7° |
| C6 | C5 | H5 | 119.5° | 120.2° |
| C5 | C6 | C7 | 118.5° | 120.9° |
| C5 | C6 | H6 | 120.8° | 119.5° |
| C9 | C5 | H5 | 119.5° | 120.1° |
| C5 | C9 | C10 | 119.8° | 119.6° |
| C7 | C6 | H6 | 120.8° | 119.5° |
| C6 | C7 | C8 | 120.9° | 121.1° |
| C6 | C7 | H7 | 119.6° | 119.5° |
| C8 | C7 | H7 | 119.6° | 119.4° |
| C7 | C8 | C10 | 119.8° | 119.8° |
| C7 | C8 | H8 | 120.1° | 120.1° |
| C10 | C8 | H8 | 120.1° | 120.1° |
| C8 | C10 | C9 | 119.9° | 119.0° |
| O1 | C | N | 121.2° | 120.0° |
| CA | N | H | 117.1° | 120.0° |
| N | CA | C1 | 105.7° | 109.5° |
| N | CA | CB | 115.4° | 109.5° |
| N | CA | HA | 110.1° | 109.5° |
| CA | N | C | 125.9° | 120.0° |
| H | N | C | 117.1° | 120.0° |
| C1 | CA | CB | 114.7° | 109.5° |
| C1 | CA | HA | 110.8° | 109.5° |
| CA | C1 | O | 121.7° | 120.0° |
| CA | C1 | N2 | 116.3° | 120.0° |
| CB | CA | HA | 100.1° | 109.4° |
| CA | CB | CG1 | 110.7° | 109.5° |
| CA | CB | CG2 | 109.8° | 109.5° |
| CA | CB | HB | 108.9° | 109.4° |
| O | C1 | N2 | 121.9° | 120.0° |
| CG1 | CB | CG2 | 110.9° | 109.5° |
| CG1 | CB | HB | 107.7° | 109.5° |
| CB | CG1 | HG11 | 109.5° | 109.5° |
| CB | CG1 | HG12 | 109.4° | 109.5° |
| CB | CG1 | HG13 | 109.4° | 109.5° |
| CG2 | CB | HB | 108.7° | 109.5° |
| CB | CG2 | HG21 | 109.5° | 109.5° |
| CB | CG2 | HG22 | 109.5° | 109.5° |
| CB | CG2 | HG23 | 109.5° | 109.4° |
| HG11 | CG1 | HG12 | 109.4° | 109.5° |
| HG11 | CG1 | HG13 | 109.5° | 109.5° |
| HG12 | CG1 | HG13 | 109.5° | 109.5° |
| HG21 | CG2 | HG22 | 109.4° | 109.5° |
| HG21 | CG2 | HG23 | 109.4° | 109.4° |
| HG22 | CG2 | HG23 | 109.5° | 109.5° |
| CA1 | N2 | H1 | 120.1° | 120.1° |
| N2 | CA1 | CC | 109.1° | 109.5° |
| N2 | CA1 | CB1 | 109.2° | 109.4° |
| N2 | CA1 | HA1 | 112.1° | 109.5° |
| CA1 | N2 | C1 | 119.7° | 120.0° |
| H1 | N2 | C1 | 120.1° | 119.9° |
| CC | CA1 | CB1 | 115.3° | 109.5° |
| CC | CA1 | HA1 | 105.6° | 109.5° |
| CA1 | CC | OXT | 111.3° | 109.5° |
| CA1 | CC | CM | 116.0° | 109.5° |
| CA1 | CC | HC | 102.7° | 109.5° |
| CB1 | CA1 | HA1 | 105.5° | 109.5° |
| CA1 | CB1 | CG | 112.0° | 109.5° |
| CA1 | CB1 | HB2 | 108.6° | 109.5° |
| CA1 | CB1 | HB3 | 108.6° | 109.4° |
| OXT | CC | CM | 106.8° | 109.5° |
| OXT | CC | HC | 112.6° | 109.4° |
| CC | OXT | HOR | 109.5° | 114.0° |
| CM | CC | HC | 107.6° | 109.4° |
| CC | CM | HM1 | 109.8° | 109.5° |
| CC | CM | HM2 | 109.9° | 109.5° |
| CC | CM | N11 | 108.3° | 109.5° |
| CG | CB1 | HB2 | 108.6° | 109.5° |
| CG | CB1 | HB3 | 108.6° | 109.5° |
| CB1 | CG | CD1 | 122.4° | 120.0° |
| CB1 | CG | CD2 | 120.2° | 120.0° |
| HB2 | CB1 | HB3 | 110.3° | 109.5° |
| CD1 | CG | CD2 | 117.4° | 120.0° |
| CG | CD1 | CE1 | 121.2° | 120.0° |
| CG | CD1 | HD1 | 119.4° | 120.0° |
| CG | CD2 | CE2 | 122.1° | 120.0° |
| CG | CD2 | HD2 | 119.0° | 120.1° |
| CE1 | CD1 | HD1 | 119.4° | 120.0° |
| CD1 | CE1 | CZ | 120.6° | 120.0° |
| CD1 | CE1 | HE1 | 119.7° | 119.9° |
| CE2 | CD2 | HD2 | 118.9° | 119.9° |
| CD2 | CE2 | CZ | 119.7° | 120.0° |
| CD2 | CE2 | HE2 | 120.1° | 120.0° |
| CZ | CE1 | HE1 | 119.7° | 120.1° |
| CE1 | CZ | CE2 | 118.8° | 120.0° |
| CE1 | CZ | HZ | 120.6° | 120.0° |
| CZ | CE2 | HE2 | 120.2° | 119.9° |
| CE2 | CZ | HZ | 120.6° | 120.0° |
| HM1 | CM | HM2 | 109.1° | 109.4° |
| HM1 | CM | N11 | 109.9° | 109.5° |
| HM2 | CM | N11 | 109.9° | 109.4° |
| C21 | N11 | C61 | 113.7° | 111.2° |
| N11 | C21 | C31 | 109.1° | 109.5° |
| N11 | C21 | CD | 113.6° | 109.5° |
| N11 | C21 | H2 | 107.6° | 109.5° |
| C21 | N11 | CM | 110.8° | 111.0° |
| N11 | C61 | C51 | 109.5° | 109.5° |
| N11 | C61 | H61 | 109.5° | 109.5° |
| N11 | C61 | H62 | 109.5° | 109.5° |
| C61 | N11 | CM | 116.8° | 111.0° |
| C31 | C21 | CD | 111.4° | 109.4° |
| C31 | C21 | H2 | 110.0° | 109.5° |
| C21 | C31 | C41 | 119.2° | 109.2° |
| C21 | C31 | H31 | 106.3° | 109.5° |
| C21 | C31 | H32 | 106.3° | 109.5° |
| CD | C21 | H2 | 105.1° | 109.5° |
| C21 | CD | O2 | 117.2° | 120.0° |
| C21 | CD | N3 | 111.2° | 120.0° |
| C41 | C31 | H31 | 106.4° | 109.5° |
| C41 | C31 | H32 | 106.4° | 109.5° |
| C31 | C41 | C51 | 110.6° | 109.1° |
| C31 | C41 | H41 | 115.0° | 109.5° |
| C31 | C41 | S | 104.6° | 109.5° |
| H31 | C31 | H32 | 112.4° | 109.5° |
| C51 | C41 | H41 | 101.6° | 109.6° |
| C41 | C51 | C61 | 105.9° | 109.3° |
| C41 | C51 | H51 | 110.7° | 109.5° |
| C41 | C51 | H52 | 110.7° | 109.5° |
| C51 | C41 | S | 117.3° | 109.5° |
| H41 | C41 | S | 108.0° | 109.6° |
| C61 | C51 | H51 | 110.7° | 109.5° |
| C61 | C51 | H52 | 110.7° | 109.5° |
| C51 | C61 | H61 | 109.5° | 109.5° |
| C51 | C61 | H62 | 109.5° | 109.5° |
| H51 | C51 | H52 | 108.3° | 109.5° |
| H61 | C61 | H62 | 109.5° | 109.4° |
| O2 | CD | N3 | 131.6° | 120.0° |
| CD | N3 | C1' | 124.8° | 120.0° |
| CD | N3 | HN | 117.6° | 120.0° |
| C1' | N3 | HN | 117.6° | 120.0° |
| N3 | C1' | C2' | 108.4° | 109.4° |
| N3 | C1' | C3' | 109.8° | 109.5° |
| N3 | C1' | C4' | 112.0° | 109.5° |
| C2' | C1' | C3' | 109.4° | 109.5° |
| C2' | C1' | C4' | 106.8° | 109.5° |
| C1' | C2' | H2'1 | 109.5° | 109.5° |
| C1' | C2' | H2'2 | 109.5° | 109.5° |
| C1' | C2' | H2'3 | 109.4° | 109.5° |
| C3' | C1' | C4' | 110.2° | 109.5° |
| C1' | C3' | H3'1 | 109.5° | 109.4° |
| C1' | C3' | H3'2 | 109.5° | 109.5° |
| C1' | C3' | H3'3 | 109.5° | 109.4° |
| C1' | C4' | H4'1 | 109.5° | 109.5° |
| C1' | C4' | H4'2 | 109.5° | 109.5° |
| C1' | C4' | H4'3 | 109.5° | 109.5° |
| H2'1 | C2' | H2'2 | 109.4° | 109.4° |
| H2'1 | C2' | H2'3 | 109.5° | 109.5° |
| H2'2 | C2' | H2'3 | 109.5° | 109.4° |
| H3'1 | C3' | H3'2 | 109.5° | 109.5° |
| H3'1 | C3' | H3'3 | 109.4° | 109.4° |
| H3'2 | C3' | H3'3 | 109.5° | 109.5° |
| H4'1 | C4' | H4'2 | 109.4° | 109.4° |
| H4'1 | C4' | H4'3 | 109.5° | 109.5° |
| H4'2 | C4' | H4'3 | 109.5° | 109.5° |
| C22 | N12 | C62 | 119.9° | 121.7° |
| N12 | C22 | C32 | 120.6° | 120.8° |
| N12 | C22 | H21 | 119.7° | 119.6° |
| N12 | C62 | C52 | 121.9° | 120.8° |
| N12 | C62 | H63 | 119.1° | 119.7° |
| C32 | C22 | H21 | 119.7° | 119.6° |
| C22 | C32 | C42 | 120.4° | 119.2° |
| C22 | C32 | CE | 117.1° | 120.4° |
| C42 | C32 | CE | 122.0° | 120.4° |
| C32 | C42 | C52 | 117.7° | 118.4° |
| C32 | C42 | H42 | 121.2° | 120.8° |
| C32 | CE | S | 104.3° | 109.5° |
| C32 | CE | H11 | 111.3° | 109.4° |
| C32 | CE | H2A | 111.2° | 109.5° |
| C52 | C42 | H42 | 121.1° | 120.7° |
| C42 | C52 | C62 | 119.4° | 119.1° |
| C42 | C52 | H53 | 120.3° | 120.4° |
| C62 | C52 | H53 | 120.3° | 120.4° |
| C52 | C62 | H63 | 119.0° | 119.6° |
| S | CE | H11 | 111.2° | 109.5° |
| S | CE | H2A | 111.2° | 109.5° |
| CE | S | C41 | 107.3° | 103.0° |
| H11 | CE | H2A | 107.7° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C2 | C3 | C | 174.4° | 180.0° |
| N1 | C2 | C3 | C4 | 2.5° | 0.0° |
| N1 | C2 | C3 | H3 | 177.5° | 180.0° |
| C2 | N1 | C10 | C8 | 179.9° | 180.0° |
| C2 | N1 | C10 | C9 | 0.3° | 0.0° |
| N1 | C2 | C | O1 | 174.3° | 180.0° |
| N1 | C2 | C | N | 7.7° | 0.0° |
| C10 | N1 | C2 | C3 | 1.3° | 0.0° |
| C10 | N1 | C2 | C | 175.8° | 180.0° |
| N1 | C10 | C9 | C4 | 0.3° | 0.0° |
| N1 | C10 | C9 | C5 | 179.0° | 180.0° |
| N1 | C10 | C8 | C7 | 177.0° | 180.0° |
| N1 | C10 | C8 | C9 | 179.8° | 180.0° |
| N1 | C10 | C8 | H8 | 3.0° | 0.0° |
| C2 | C3 | C4 | H3 | 180.0° | 180.0° |
| C2 | C3 | C4 | C9 | 2.7° | 0.0° |
| C2 | C3 | C4 | H4 | 177.3° | 179.9° |
| C3 | C2 | C | O1 | 11.7° | 0.0° |
| C3 | C2 | C | N | 166.3° | 180.0° |
| C | C2 | C3 | C4 | 176.9° | 180.0° |
| C | C2 | C3 | H3 | 3.1° | 0.0° |
| C2 | C | O1 | N | 177.9° | 180.0° |
| C2 | C | N | CA | 176.9° | 180.0° |
| C2 | C | N | H | 3.1° | 0.0° |
| C3 | C4 | C9 | H4 | 180.0° | 179.9° |
| C3 | C4 | C9 | C5 | 179.8° | 180.0° |
| C3 | C4 | C9 | C10 | 1.6° | 0.0° |
| H3 | C3 | C4 | C9 | 177.3° | 180.0° |
| H3 | C3 | C4 | H4 | 2.7° | 0.1° |
| C4 | C9 | C5 | C6 | 178.3° | 180.0° |
| C4 | C9 | C5 | C10 | 178.6° | 180.0° |
| C4 | C9 | C5 | H5 | 1.7° | 0.0° |
| C4 | C9 | C10 | C8 | 179.9° | 180.0° |
| H4 | C4 | C9 | C5 | 0.2° | 0.1° |
| H4 | C4 | C9 | C10 | 178.5° | 179.9° |
| C6 | C5 | C9 | H5 | 180.0° | 180.0° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 2.2° | 0.0° |
| C5 | C6 | C7 | H7 | 177.8° | 180.0° |
| C6 | C5 | C9 | C10 | 0.3° | 0.0° |
| C9 | C5 | C6 | C7 | 0.2° | 0.0° |
| C9 | C5 | C6 | H6 | 179.8° | 180.0° |
| C5 | C9 | C10 | C8 | 1.2° | 0.0° |
| H5 | C5 | C6 | C7 | 179.8° | 180.0° |
| H5 | C5 | C6 | H6 | 0.2° | 0.0° |
| H5 | C5 | C9 | C10 | 179.7° | 180.0° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | C10 | 3.7° | 0.0° |
| C6 | C7 | C8 | H8 | 176.3° | 180.0° |
| H6 | C6 | C7 | C8 | 177.8° | 180.0° |
| H6 | C6 | C7 | H7 | 2.2° | 0.0° |
| C7 | C8 | C10 | H8 | 180.0° | 179.9° |
| C7 | C8 | C10 | C9 | 3.2° | 0.0° |
| H7 | C7 | C8 | C10 | 176.3° | 180.0° |
| H7 | C7 | C8 | H8 | 3.7° | 0.0° |
| H8 | C8 | C10 | C9 | 176.8° | 180.0° |
| O1 | C | N | CA | 1.1° | 0.0° |
| O1 | C | N | H | 178.9° | 180.0° |
| CA | N | H | C | 180.0° | 180.0° |
| N | CA | C1 | CB | 128.3° | 120.0° |
| N | CA | C1 | HA | 119.3° | 120.0° |
| N | CA | CB | HA | 118.1° | 120.0° |
| N | CA | C1 | O | 83.7° | 13.5° |
| N | CA | CB | CG1 | 173.2° | 64.3° |
| N | CA | CB | CG2 | 64.0° | 55.7° |
| N | CA | CB | HB | 54.9° | 175.6° |
| N | CA | C1 | N2 | 91.5° | 166.5° |
| H | N | CA | C1 | 57.6° | 25.0° |
| H | N | CA | CB | 70.2° | 95.0° |
| H | N | CA | HA | 177.4° | 145.1° |
| C1 | CA | CB | HA | 118.6° | 120.0° |
| CA | C1 | O | N2 | 174.9° | 180.0° |
| C1 | CA | CB | CG1 | 50.0° | 175.6° |
| C1 | CA | CB | CG2 | 172.7° | 64.3° |
| C1 | CA | CB | HB | 68.3° | 55.6° |
| CA | C1 | N2 | CA1 | 179.8° | 176.1° |
| CA | C1 | N2 | H1 | 0.2° | 3.9° |
| C1 | CA | N | C | 122.3° | 155.0° |
| CB | CA | C1 | O | 44.6° | 106.5° |
| CA | CB | CG1 | CG2 | 122.1° | 120.0° |
| CA | CB | CG1 | HB | 119.0° | 120.0° |
| CA | CB | CG2 | HB | 119.1° | 119.9° |
| CA | CB | CG1 | HG11 | 180.0° | 62.1° |
| CA | CB | CG1 | HG12 | 60.0° | 177.9° |
| CA | CB | CG1 | HG13 | 60.0° | 57.9° |
| CA | CB | CG2 | HG21 | 180.0° | 60.0° |
| CA | CB | CG2 | HG22 | 60.0° | 180.0° |
| CA | CB | CG2 | HG23 | 60.0° | 60.0° |
| CB | CA | N | C | 109.8° | 85.0° |
| CB | CA | C1 | N2 | 140.2° | 73.5° |
| HA | CA | C1 | O | 157.0° | 133.6° |
| HA | CA | CB | CG1 | 68.7° | 55.6° |
| HA | CA | CB | CG2 | 54.1° | 175.6° |
| HA | CA | CB | HB | 173.0° | 64.4° |
| HA | CA | N | C | 2.6° | 35.0° |
| HA | CA | C1 | N2 | 27.8° | 46.4° |
| O | C1 | N2 | CA1 | 4.6° | 3.9° |
| O | C1 | N2 | H1 | 175.4° | 176.1° |
| CG1 | CB | CG2 | HB | 118.3° | 120.1° |
| CB | CG1 | HG11 | HG12 | 120.0° | 120.0° |
| CB | CG1 | HG11 | HG13 | 120.0° | 120.0° |
| CB | CG1 | HG12 | HG13 | 120.0° | 120.0° |
| CG1 | CB | CG2 | HG21 | 57.3° | 180.0° |
| CG1 | CB | CG2 | HG22 | 62.7° | 60.0° |
| CG1 | CB | CG2 | HG23 | 177.3° | 60.0° |
| CG2 | CB | CG1 | HG11 | 57.9° | 57.9° |
| CG2 | CB | CG1 | HG12 | 177.9° | 62.1° |
| CG2 | CB | CG1 | HG13 | 62.1° | 177.8° |
| CB | CG2 | HG21 | HG22 | 120.0° | 120.1° |
| CB | CG2 | HG21 | HG23 | 120.0° | 120.0° |
| CB | CG2 | HG22 | HG23 | 120.0° | 120.0° |
| HB | CB | CG1 | HG11 | 61.0° | 177.9° |
| HB | CB | CG1 | HG12 | 59.0° | 57.9° |
| HB | CB | CG1 | HG13 | 179.0° | 62.1° |
| HB | CB | CG2 | HG21 | 60.9° | 60.0° |
| HB | CB | CG2 | HG22 | 179.1° | 60.0° |
| HB | CB | CG2 | HG23 | 59.0° | 180.0° |
| HG11 | CG1 | HG12 | HG13 | 120.0° | 120.0° |
| HG21 | CG2 | HG22 | HG23 | 119.9° | 119.9° |
| CA1 | N2 | H1 | C1 | 180.0° | 180.0° |
| N2 | CA1 | CC | CB1 | 123.2° | 120.0° |
| N2 | CA1 | CC | HA1 | 120.7° | 120.0° |
| N2 | CA1 | CB1 | HA1 | 120.7° | 120.0° |
| N2 | CA1 | CC | OXT | 73.0° | 65.0° |
| N2 | CA1 | CC | CM | 164.7° | 175.0° |
| N2 | CA1 | CC | HC | 47.7° | 55.0° |
| N2 | CA1 | CB1 | CG | 51.3° | 65.0° |
| N2 | CA1 | CB1 | HB2 | 68.7° | 55.0° |
| N2 | CA1 | CB1 | HB3 | 171.2° | 175.0° |
| H1 | N2 | CA1 | CC | 71.1° | 25.0° |
| H1 | N2 | CA1 | CB1 | 55.6° | 95.0° |
| H1 | N2 | CA1 | HA1 | 172.3° | 145.0° |
| CC | CA1 | CB1 | HA1 | 116.1° | 120.0° |
| CA1 | CC | OXT | CM | 127.5° | 120.0° |
| CA1 | CC | OXT | HC | 114.6° | 120.0° |
| CA1 | CC | CM | HC | 114.2° | 120.0° |
| CA1 | CC | OXT | HOR | 180.0° | 59.9° |
| CC | CA1 | CB1 | CG | 174.4° | 175.0° |
| CC | CA1 | CB1 | HB2 | 54.4° | 64.9° |
| CC | CA1 | CB1 | HB3 | 65.6° | 55.0° |
| CA1 | CC | CM | HM1 | 33.1° | 51.5° |
| CA1 | CC | CM | HM2 | 153.1° | 68.5° |
| CC | CA1 | N2 | C1 | 108.9° | 155.0° |
| CA1 | CC | CM | N11 | 86.9° | 171.6° |
| CB1 | CA1 | CC | OXT | 50.2° | 55.0° |
| CB1 | CA1 | CC | CM | 72.1° | 65.1° |
| CB1 | CA1 | CC | HC | 170.9° | 175.0° |
| CA1 | CB1 | CG | HB2 | 120.0° | 120.0° |
| CA1 | CB1 | CG | HB3 | 120.0° | 119.9° |
| CA1 | CB1 | HB2 | HB3 | 118.9° | 119.9° |
| CA1 | CB1 | CG | CD1 | 108.4° | 90.0° |
| CA1 | CB1 | CG | CD2 | 71.2° | 90.2° |
| CB1 | CA1 | N2 | C1 | 124.3° | 85.0° |
| HA1 | CA1 | CC | OXT | 166.3° | 175.0° |
| HA1 | CA1 | CC | CM | 44.0° | 55.0° |
| HA1 | CA1 | CC | HC | 73.0° | 65.0° |
| HA1 | CA1 | CB1 | CG | 69.5° | 55.0° |
| HA1 | CA1 | CB1 | HB2 | 170.5° | 175.0° |
| HA1 | CA1 | CB1 | HB3 | 50.5° | 65.0° |
| HA1 | CA1 | N2 | C1 | 7.7° | 35.0° |
| OXT | CC | CM | HC | 121.1° | 119.9° |
| OXT | CC | CM | HM1 | 91.6° | 171.6° |
| OXT | CC | CM | HM2 | 28.4° | 51.6° |
| OXT | CC | CM | N11 | 148.4° | 68.4° |
| CM | CC | OXT | HOR | 52.5° | 60.1° |
| CC | CM | HM1 | HM2 | 120.5° | 120.0° |
| CC | CM | HM1 | N11 | 119.1° | 120.1° |
| CC | CM | HM2 | N11 | 119.1° | 120.0° |
| CC | CM | N11 | C21 | 156.4° | 161.2° |
| CC | CM | N11 | C61 | 71.2° | 74.5° |
| HC | CC | OXT | HOR | 65.4° | 180.0° |
| HC | CC | CM | HM1 | 147.3° | 68.5° |
| HC | CC | CM | HM2 | 92.7° | 171.5° |
| HC | CC | CM | N11 | 27.3° | 51.6° |
| CG | CB1 | HB2 | HB3 | 119.0° | 120.1° |
| CB1 | CG | CD1 | CD2 | 179.7° | 179.8° |
| CB1 | CG | CD1 | CE1 | 179.2° | 180.0° |
| CB1 | CG | CD1 | HD1 | 0.8° | 0.0° |
| CB1 | CG | CD2 | CE2 | 179.7° | 180.0° |
| CB1 | CG | CD2 | HD2 | 0.3° | 0.0° |
| HB2 | CB1 | CG | CD1 | 11.6° | 30.0° |
| HB2 | CB1 | CG | CD2 | 168.8° | 149.7° |
| HB3 | CB1 | CG | CD1 | 131.6° | 150.1° |
| HB3 | CB1 | CG | CD2 | 48.8° | 29.7° |
| CG | CD1 | CE1 | HD1 | 180.0° | 179.9° |
| CD1 | CG | CD2 | CE2 | 0.1° | 0.2° |
| CD1 | CG | CD2 | HD2 | 180.0° | 179.7° |
| CG | CD1 | CE1 | CZ | 2.2° | 0.0° |
| CG | CD1 | CE1 | HE1 | 177.8° | 180.0° |
| CD2 | CG | CD1 | CE1 | 0.5° | 0.2° |
| CD2 | CG | CD1 | HD1 | 179.5° | 179.7° |
| CG | CD2 | CE2 | HD2 | 180.0° | 180.0° |
| CG | CD2 | CE2 | CZ | 3.3° | 0.0° |
| CG | CD2 | CE2 | HE2 | 176.7° | 180.0° |
| CD1 | CE1 | CZ | HE1 | 180.0° | 179.9° |
| CD1 | CE1 | CZ | CE2 | 5.4° | 0.2° |
| CD1 | CE1 | CZ | HZ | 174.6° | 179.9° |
| HD1 | CD1 | CE1 | CZ | 177.8° | 180.0° |
| HD1 | CD1 | CE1 | HE1 | 2.2° | 0.1° |
| CD2 | CE2 | CZ | CE1 | 5.9° | 0.2° |
| CD2 | CE2 | CZ | HE2 | 180.0° | 179.9° |
| CD2 | CE2 | CZ | HZ | 174.1° | 180.0° |
| HD2 | CD2 | CE2 | CZ | 176.7° | 179.9° |
| HD2 | CD2 | CE2 | HE2 | 3.3° | 0.0° |
| CE1 | CZ | CE2 | HZ | 180.0° | 179.8° |
| CE1 | CZ | CE2 | HE2 | 174.1° | 179.7° |
| HE1 | CE1 | CZ | CE2 | 174.6° | 179.8° |
| HE1 | CE1 | CZ | HZ | 5.4° | 0.0° |
| HE2 | CE2 | CZ | HZ | 5.9° | 0.1° |
| HM1 | CM | HM2 | N11 | 120.5° | 119.9° |
| HM1 | CM | N11 | C21 | 36.4° | 41.1° |
| HM1 | CM | N11 | C61 | 168.8° | 165.4° |
| HM2 | CM | N11 | C21 | 83.6° | 78.8° |
| HM2 | CM | N11 | C61 | 48.8° | 45.5° |
| C21 | N11 | C61 | CM | 131.1° | 124.2° |
| N11 | C21 | C31 | CD | 126.2° | 120.0° |
| N11 | C21 | C31 | H2 | 117.8° | 120.0° |
| N11 | C21 | CD | H2 | 117.3° | 120.0° |
| N11 | C21 | C31 | C41 | 38.4° | 59.2° |
| N11 | C21 | C31 | H31 | 81.6° | 60.8° |
| N11 | C21 | C31 | H32 | 158.4° | 179.1° |
| C21 | N11 | C61 | C51 | 64.3° | 61.7° |
| C21 | N11 | C61 | H61 | 55.7° | 58.3° |
| C21 | N11 | C61 | H62 | 175.8° | 178.3° |
| N11 | C21 | CD | O2 | 45.3° | 32.7° |
| N11 | C21 | CD | N3 | 135.9° | 147.2° |
| C61 | N11 | C21 | C31 | 46.6° | 61.7° |
| C61 | N11 | C21 | CD | 171.5° | 178.3° |
| C61 | N11 | C21 | H2 | 72.6° | 58.3° |
| N11 | C61 | C51 | C41 | 67.5° | 59.2° |
| N11 | C61 | C51 | H61 | 120.0° | 120.0° |
| N11 | C61 | C51 | H62 | 120.0° | 120.1° |
| N11 | C61 | C51 | H51 | 52.5° | 60.8° |
| N11 | C61 | C51 | H52 | 172.6° | 179.1° |
| N11 | C61 | H61 | H62 | 120.0° | 120.0° |
| C31 | C21 | CD | H2 | 119.0° | 120.0° |
| C21 | C31 | C41 | H31 | 120.0° | 120.0° |
| C21 | C31 | C41 | H32 | 120.0° | 119.9° |
| C21 | C31 | H31 | H32 | 116.0° | 120.1° |
| C21 | C31 | C41 | C51 | 46.2° | 57.7° |
| C21 | C31 | C41 | H41 | 68.2° | 62.3° |
| C31 | C21 | CD | O2 | 78.4° | 87.3° |
| C31 | C21 | CD | N3 | 100.4° | 92.8° |
| C31 | C21 | N11 | CM | 179.5° | 174.1° |
| C21 | C31 | C41 | S | 173.4° | 177.6° |
| CD | C21 | C31 | C41 | 164.6° | 179.2° |
| CD | C21 | C31 | H31 | 44.6° | 59.3° |
| CD | C21 | C31 | H32 | 75.4° | 60.9° |
| C21 | CD | O2 | N3 | 178.5° | 179.9° |
| C21 | CD | N3 | C1' | 179.3° | 180.0° |
| C21 | CD | N3 | HN | 0.7° | 0.0° |
| CD | C21 | N11 | CM | 54.6° | 54.1° |
| H2 | C21 | C31 | C41 | 79.3° | 60.8° |
| H2 | C21 | C31 | H31 | 160.7° | 179.2° |
| H2 | C21 | C31 | H32 | 40.7° | 59.1° |
| H2 | C21 | CD | O2 | 162.6° | 152.7° |
| H2 | C21 | CD | N3 | 18.6° | 27.2° |
| H2 | C21 | N11 | CM | 61.3° | 65.9° |
| C41 | C31 | H31 | H32 | 116.0° | 120.1° |
| C31 | C41 | C51 | H41 | 122.6° | 119.9° |
| C31 | C41 | C51 | S | 119.9° | 119.9° |
| C31 | C41 | H41 | S | 116.4° | 120.1° |
| C31 | C41 | C51 | C61 | 56.9° | 57.7° |
| C31 | C41 | C51 | H51 | 63.1° | 62.3° |
| C31 | C41 | C51 | H52 | 176.9° | 177.6° |
| C31 | C41 | S | CE | 29.2° | 175.0° |
| H31 | C31 | C41 | C51 | 73.8° | 62.3° |
| H31 | C31 | C41 | H41 | 171.8° | 177.8° |
| H31 | C31 | C41 | S | 53.4° | 57.6° |
| H32 | C31 | C41 | C51 | 166.2° | 177.6° |
| H32 | C31 | C41 | H41 | 51.7° | 57.7° |
| H32 | C31 | C41 | S | 66.6° | 62.5° |
| C51 | C41 | H41 | S | 124.0° | 120.2° |
| C41 | C51 | C61 | H51 | 120.0° | 120.0° |
| C41 | C51 | C61 | H52 | 120.0° | 119.9° |
| C41 | C51 | H51 | H52 | 121.5° | 120.1° |
| C41 | C51 | C61 | H61 | 52.5° | 60.8° |
| C41 | C51 | C61 | H62 | 172.5° | 179.2° |
| C51 | C41 | S | CE | 152.3° | 65.4° |
| H41 | C41 | C51 | C61 | 65.7° | 62.2° |
| H41 | C41 | C51 | H51 | 174.3° | 177.8° |
| H41 | C41 | C51 | H52 | 54.3° | 57.7° |
| H41 | C41 | S | CE | 93.7° | 54.9° |
| C61 | C51 | H51 | H52 | 121.5° | 120.1° |
| C51 | C61 | H61 | H62 | 120.0° | 119.9° |
| C51 | C61 | N11 | CM | 164.7° | 174.1° |
| C61 | C51 | C41 | S | 176.8° | 177.5° |
| H51 | C51 | C61 | H61 | 172.5° | 179.2° |
| H51 | C51 | C61 | H62 | 67.5° | 59.3° |
| H51 | C51 | C41 | S | 56.8° | 57.5° |
| H52 | C51 | C61 | H61 | 67.5° | 59.1° |
| H52 | C51 | C61 | H62 | 52.6° | 60.8° |
| H52 | C51 | C41 | S | 63.2° | 62.5° |
| H61 | C61 | N11 | CM | 75.4° | 65.9° |
| H62 | C61 | N11 | CM | 44.7° | 54.1° |
| O2 | CD | N3 | C1' | 0.8° | 0.1° |
| O2 | CD | N3 | HN | 179.2° | 179.9° |
| CD | N3 | C1' | HN | 180.0° | 179.9° |
| CD | N3 | C1' | C2' | 176.6° | 60.0° |
| CD | N3 | C1' | C3' | 57.0° | 180.0° |
| CD | N3 | C1' | C4' | 65.8° | 60.0° |
| N3 | C1' | C2' | C3' | 119.8° | 120.0° |
| N3 | C1' | C2' | C4' | 120.9° | 120.0° |
| N3 | C1' | C3' | C4' | 123.9° | 120.0° |
| N3 | C1' | C2' | H2'1 | 180.0° | 60.0° |
| N3 | C1' | C2' | H2'2 | 60.0° | 180.0° |
| N3 | C1' | C2' | H2'3 | 60.0° | 60.0° |
| N3 | C1' | C3' | H3'1 | 180.0° | 60.0° |
| N3 | C1' | C3' | H3'2 | 60.0° | 180.0° |
| N3 | C1' | C3' | H3'3 | 60.0° | 59.9° |
| N3 | C1' | C4' | H4'1 | 180.0° | 60.0° |
| N3 | C1' | C4' | H4'2 | 60.0° | 179.9° |
| N3 | C1' | C4' | H4'3 | 60.0° | 60.1° |
| HN | N3 | C1' | C2' | 3.5° | 120.0° |
| HN | N3 | C1' | C3' | 123.0° | 0.0° |
| HN | N3 | C1' | C4' | 114.2° | 120.0° |
| C2' | C1' | C3' | C4' | 117.2° | 120.0° |
| C1' | C2' | H2'1 | H2'2 | 120.0° | 120.0° |
| C1' | C2' | H2'1 | H2'3 | 120.0° | 120.1° |
| C1' | C2' | H2'2 | H2'3 | 120.0° | 120.0° |
| C2' | C1' | C3' | H3'1 | 61.1° | 179.9° |
| C2' | C1' | C3' | H3'2 | 178.9° | 60.0° |
| C2' | C1' | C3' | H3'3 | 58.9° | 60.0° |
| C2' | C1' | C4' | H4'1 | 61.4° | 59.9° |
| C2' | C1' | C4' | H4'2 | 58.6° | 60.0° |
| C2' | C1' | C4' | H4'3 | 178.6° | 180.0° |
| C3' | C1' | C2' | H2'1 | 60.2° | 60.0° |
| C3' | C1' | C2' | H2'2 | 59.8° | 60.0° |
| C3' | C1' | C2' | H2'3 | 179.8° | 180.0° |
| C1' | C3' | H3'1 | H3'2 | 120.0° | 120.0° |
| C1' | C3' | H3'1 | H3'3 | 120.0° | 119.9° |
| C1' | C3' | H3'2 | H3'3 | 120.0° | 120.0° |
| C3' | C1' | C4' | H4'1 | 57.4° | 180.0° |
| C3' | C1' | C4' | H4'2 | 177.4° | 60.0° |
| C3' | C1' | C4' | H4'3 | 62.6° | 60.0° |
| C4' | C1' | C2' | H2'1 | 59.1° | 180.0° |
| C4' | C1' | C2' | H2'2 | 179.1° | 60.0° |
| C4' | C1' | C2' | H2'3 | 60.9° | 59.9° |
| C4' | C1' | C3' | H3'1 | 56.1° | 60.0° |
| C4' | C1' | C3' | H3'2 | 63.9° | 60.0° |
| C4' | C1' | C3' | H3'3 | 176.1° | 179.9° |
| C1' | C4' | H4'1 | H4'2 | 120.0° | 120.0° |
| C1' | C4' | H4'1 | H4'3 | 120.0° | 120.1° |
| C1' | C4' | H4'2 | H4'3 | 120.0° | 120.0° |
| H2'1 | C2' | H2'2 | H2'3 | 120.0° | 120.0° |
| H3'1 | C3' | H3'2 | H3'3 | 120.0° | 120.0° |
| H4'1 | C4' | H4'2 | H4'3 | 120.0° | 120.0° |
| N12 | C22 | C32 | H21 | 180.0° | 180.0° |
| N12 | C22 | C32 | C42 | 1.4° | 0.0° |
| N12 | C22 | C32 | CE | 173.8° | 180.0° |
| C22 | N12 | C62 | C52 | 2.0° | 0.1° |
| C22 | N12 | C62 | H63 | 178.1° | 180.0° |
| C62 | N12 | C22 | C32 | 0.3° | 0.1° |
| C62 | N12 | C22 | H21 | 179.7° | 180.0° |
| N12 | C62 | C52 | C42 | 1.9° | 0.1° |
| N12 | C62 | C52 | H63 | 180.0° | 179.9° |
| N12 | C62 | C52 | H53 | 178.1° | 180.0° |
| C22 | C32 | C42 | CE | 172.0° | 180.0° |
| C22 | C32 | C42 | C52 | 1.4° | 0.0° |
| C22 | C32 | C42 | H42 | 178.5° | 180.0° |
| C22 | C32 | CE | S | 57.8° | 90.0° |
| C22 | C32 | CE | H11 | 62.2° | 150.0° |
| C22 | C32 | CE | H2A | 177.8° | 30.1° |
| H21 | C22 | C32 | C42 | 178.6° | 180.0° |
| H21 | C22 | C32 | CE | 6.2° | 0.0° |
| C32 | C42 | C52 | H42 | 180.0° | 179.9° |
| C32 | C42 | C52 | C62 | 0.1° | 0.0° |
| C32 | C42 | C52 | H53 | 179.9° | 179.9° |
| C42 | C32 | CE | S | 114.5° | 90.0° |
| C42 | C32 | CE | H11 | 125.5° | 30.1° |
| C42 | C32 | CE | H2A | 5.5° | 150.0° |
| CE | C32 | C42 | C52 | 173.5° | 180.0° |
| CE | C32 | C42 | H42 | 6.5° | 0.1° |
| C32 | CE | S | H11 | 120.0° | 120.0° |
| C32 | CE | S | H2A | 120.0° | 120.0° |
| C32 | CE | H11 | H2A | 122.1° | 119.9° |
| C32 | CE | S | C41 | 125.1° | 180.0° |
| C42 | C52 | C62 | H53 | 180.0° | 180.0° |
| C42 | C52 | C62 | H63 | 178.2° | 180.0° |
| H42 | C42 | C52 | C62 | 179.9° | 179.9° |
| H42 | C42 | C52 | H53 | 0.1° | 0.0° |
| H53 | C52 | C62 | H63 | 1.8° | 0.1° |
| S | CE | H11 | H2A | 122.1° | 120.0° |
| H11 | CE | S | C41 | 5.1° | 60.0° |
| H2A | CE | S | C41 | 114.9° | 60.0° |
