OVN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CD1 | CG | sing | 1.53Å | 1.52Å | |
| O4 | C4 | sing | 1.43Å | 1.42Å | |
| C5 | O5 | sing | 1.43Å | 1.43Å | |
| C5 | C4 | sing | 1.53Å | 1.53Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| CG | CB | sing | 1.53Å | 1.53Å | |
| CG | CD2 | sing | 1.53Å | 1.53Å | |
| O5 | C1 | sing | 1.43Å | 1.43Å | |
| C4 | C3 | sing | 1.53Å | 1.52Å | |
| CB | CA | sing | 1.53Å | 1.53Å | |
| C6 | O6 | sing | 1.43Å | 1.46Å | |
| C1 | C2 | sing | 1.53Å | 1.51Å | |
| C3 | O3 | sing | 1.43Å | 1.43Å | |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| C2 | C7 | sing | 1.53Å | 1.53Å | |
| N | CA | sing | 1.47Å | 1.47Å | |
| CA | C | sing | 1.51Å | 1.52Å | |
| O6 | S | sing | 1.52Å | 1.60Å | |
| C | N3S | sing | 1.35Å | 1.36Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| N3S | S | sing | 1.66Å | 1.60Å | |
| C7 | C8 | sing | 1.53Å | 1.52Å | |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| O1S | S | doub | 1.42Å | 1.42Å | |
| S | O2S | doub | 1.42Å | 1.42Å | |
| C9 | N10 | sing | 1.47Å | 1.46Å | |
| N11 | N10 | sing | 1.29Å | 1.34Å | Aromatic |
| N11 | N12 | doub | 1.29Å | 1.31Å | Aromatic |
| N10 | C14 | sing | 1.35Å | 1.34Å | Aromatic |
| N12 | C13 | sing | 1.34Å | 1.36Å | Aromatic |
| C14 | C13 | doub | 1.35Å | 1.36Å | Aromatic |
| C13 | C15 | sing | 1.51Å | 1.50Å | |
| C16 | C15 | sing | 1.53Å | 1.52Å | |
| C16 | C17 | sing | 1.53Å | 1.52Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C18 | O19 | sing | 1.43Å | 1.42Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H9 | sing | 1.09Å | 1.10Å | |
| C8 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H11 | sing | 1.08Å | 1.08Å | |
| C15 | H12 | sing | 1.09Å | 1.10Å | |
| C15 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| N | H20 | sing | 1.01Å | 1.00Å | |
| N | H21 | sing | 1.01Å | 1.00Å | |
| CA | H23 | sing | 1.09Å | 1.10Å | |
| CB | H24 | sing | 1.09Å | 1.10Å | |
| CB | H25 | sing | 1.09Å | 1.10Å | |
| CG | H26 | sing | 1.09Å | 1.10Å | |
| CD1 | H27 | sing | 1.09Å | 1.10Å | |
| CD1 | H28 | sing | 1.09Å | 1.10Å | |
| CD1 | H29 | sing | 1.09Å | 1.10Å | |
| CD2 | H30 | sing | 1.09Å | 1.10Å | |
| CD2 | H31 | sing | 1.09Å | 1.10Å | |
| CD2 | H32 | sing | 1.09Å | 1.10Å | |
| C2 | H33 | sing | 1.09Å | 1.10Å | |
| C5 | H34 | sing | 1.09Å | 1.10Å | |
| C9 | H35 | sing | 1.09Å | 1.10Å | |
| C9 | H36 | sing | 1.09Å | 1.10Å | |
| N3S | H37 | sing | 0.97Å | 1.00Å | |
| O19 | H38 | sing | 0.97Å | 0.95Å | |
| O3 | H39 | sing | 0.97Å | 0.95Å | |
| O4 | H40 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CD1 | CG | CB | 110.2° | 109.5° |
| CD1 | CG | CD2 | 110.3° | 109.5° |
| CD1 | CG | H26 | 108.3° | 109.5° |
| CG | CD1 | H27 | 109.5° | 109.5° |
| CG | CD1 | H28 | 109.5° | 109.4° |
| CG | CD1 | H29 | 109.5° | 109.4° |
| O4 | C4 | C5 | 108.7° | 109.6° |
| O4 | C4 | C3 | 108.7° | 109.5° |
| O4 | C4 | H4 | 110.0° | 109.5° |
| C4 | O4 | H40 | 109.5° | 114.0° |
| O5 | C5 | C4 | 112.6° | 109.4° |
| O5 | C5 | C6 | 109.6° | 109.5° |
| C5 | O5 | C1 | 114.2° | 114.1° |
| O5 | C5 | H34 | 106.6° | 109.5° |
| C4 | C5 | C6 | 116.0° | 109.5° |
| C5 | C4 | C3 | 112.2° | 109.2° |
| C5 | C4 | H4 | 108.5° | 109.5° |
| C4 | C5 | H34 | 105.6° | 109.5° |
| C5 | C6 | O6 | 110.0° | 109.5° |
| C5 | C6 | H5 | 109.3° | 109.5° |
| C5 | C6 | H6 | 109.3° | 109.5° |
| C6 | C5 | H34 | 105.7° | 109.5° |
| CB | CG | CD2 | 111.6° | 109.4° |
| CG | CB | CA | 115.0° | 109.5° |
| CG | CB | H24 | 108.1° | 109.4° |
| CG | CB | H25 | 108.1° | 109.5° |
| CB | CG | H26 | 108.2° | 109.5° |
| CD2 | CG | H26 | 108.1° | 109.4° |
| CG | CD2 | H30 | 109.5° | 109.5° |
| CG | CD2 | H31 | 109.4° | 109.4° |
| CG | CD2 | H32 | 109.5° | 109.5° |
| O5 | C1 | C2 | 111.9° | 109.4° |
| O5 | C1 | H1 | 108.9° | 109.5° |
| O5 | C1 | H2 | 108.9° | 109.5° |
| C4 | C3 | O3 | 108.2° | 109.5° |
| C4 | C3 | C2 | 112.4° | 109.0° |
| C4 | C3 | H3 | 108.4° | 109.6° |
| C3 | C4 | H4 | 108.6° | 109.5° |
| CB | CA | N | 112.3° | 109.5° |
| CB | CA | C | 109.4° | 109.5° |
| CB | CA | H23 | 107.7° | 109.4° |
| CA | CB | H24 | 108.1° | 109.4° |
| CA | CB | H25 | 108.1° | 109.5° |
| C6 | O6 | S | 117.7° | 114.0° |
| O6 | C6 | H5 | 109.3° | 109.5° |
| O6 | C6 | H6 | 109.3° | 109.5° |
| C1 | C2 | C3 | 108.8° | 109.2° |
| C1 | C2 | C7 | 108.3° | 109.5° |
| C2 | C1 | H1 | 108.9° | 109.5° |
| C2 | C1 | H2 | 108.9° | 109.5° |
| C1 | C2 | H33 | 109.0° | 109.6° |
| O3 | C3 | C2 | 109.9° | 109.5° |
| O3 | C3 | H3 | 109.7° | 109.5° |
| C3 | O3 | H39 | 109.5° | 114.0° |
| C3 | C2 | C7 | 113.0° | 109.5° |
| C2 | C3 | H3 | 108.3° | 109.6° |
| C3 | C2 | H33 | 108.8° | 109.5° |
| C2 | C7 | C8 | 115.4° | 109.5° |
| C2 | C7 | H7 | 108.0° | 109.5° |
| C2 | C7 | H8 | 108.0° | 109.5° |
| C7 | C2 | H33 | 108.8° | 109.6° |
| N | CA | C | 111.1° | 109.5° |
| CA | N | H20 | 109.5° | 111.0° |
| CA | N | H21 | 109.5° | 111.0° |
| N | CA | H23 | 108.5° | 109.5° |
| CA | C | N3S | 115.3° | 120.0° |
| CA | C | O | 121.1° | 120.0° |
| C | CA | H23 | 107.8° | 109.5° |
| O6 | S | N3S | 106.5° | 107.2° |
| O6 | S | O1S | 107.4° | 106.4° |
| O6 | S | O2S | 104.1° | 106.4° |
| N3S | C | O | 123.6° | 120.0° |
| C | N3S | S | 126.7° | 120.0° |
| C | N3S | H37 | 116.7° | 120.0° |
| N3S | S | O1S | 107.3° | 106.4° |
| N3S | S | O2S | 109.5° | 106.4° |
| S | N3S | H37 | 116.7° | 120.0° |
| C7 | C8 | C9 | 113.0° | 109.5° |
| C8 | C7 | H7 | 108.0° | 109.4° |
| C8 | C7 | H8 | 108.0° | 109.5° |
| C7 | C8 | H9 | 108.6° | 109.5° |
| C7 | C8 | H10 | 108.6° | 109.4° |
| C8 | C9 | N10 | 113.0° | 109.5° |
| C9 | C8 | H9 | 108.6° | 109.5° |
| C9 | C8 | H10 | 108.6° | 109.4° |
| C8 | C9 | H35 | 108.6° | 109.5° |
| C8 | C9 | H36 | 108.6° | 109.5° |
| O1S | S | O2S | 121.2° | 123.2° |
| C9 | N10 | N11 | 120.9° | 125.8° |
| C9 | N10 | C14 | 128.4° | 125.8° |
| N10 | C9 | H35 | 108.5° | 109.5° |
| N10 | C9 | H36 | 108.6° | 109.4° |
| N10 | N11 | N12 | 106.9° | 110.2° |
| N11 | N10 | C14 | 110.7° | 108.3° |
| N11 | N12 | C13 | 109.2° | 108.9° |
| N10 | C14 | C13 | 105.2° | 106.1° |
| N10 | C14 | H11 | 127.4° | 127.0° |
| N12 | C13 | C14 | 107.9° | 106.5° |
| N12 | C13 | C15 | 121.7° | 126.7° |
| C14 | C13 | C15 | 130.4° | 126.8° |
| C13 | C14 | H11 | 127.4° | 126.9° |
| C13 | C15 | C16 | 113.0° | 109.5° |
| C13 | C15 | H12 | 108.6° | 109.5° |
| C13 | C15 | H13 | 108.6° | 109.5° |
| C15 | C16 | C17 | 113.4° | 109.5° |
| C16 | C15 | H12 | 108.6° | 109.5° |
| C16 | C15 | H13 | 108.6° | 109.5° |
| C15 | C16 | H14 | 108.5° | 109.4° |
| C15 | C16 | H15 | 108.5° | 109.5° |
| C16 | C17 | C18 | 117.4° | 109.5° |
| C17 | C16 | H14 | 108.5° | 109.5° |
| C17 | C16 | H15 | 108.5° | 109.5° |
| C16 | C17 | H16 | 107.4° | 109.5° |
| C16 | C17 | H17 | 107.5° | 109.5° |
| C17 | C18 | O19 | 112.1° | 109.5° |
| C18 | C17 | H16 | 107.5° | 109.5° |
| C18 | C17 | H17 | 107.5° | 109.5° |
| C17 | C18 | H18 | 108.8° | 109.4° |
| C17 | C18 | H19 | 108.8° | 109.5° |
| O19 | C18 | H18 | 108.8° | 109.5° |
| O19 | C18 | H19 | 108.8° | 109.5° |
| C18 | O19 | H38 | 109.5° | 114.0° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H5 | C6 | H6 | 109.5° | 109.4° |
| H7 | C7 | H8 | 109.5° | 109.5° |
| H9 | C8 | H10 | 109.4° | 109.5° |
| H12 | C15 | H13 | 109.5° | 109.4° |
| H14 | C16 | H15 | 109.4° | 109.5° |
| H16 | C17 | H17 | 109.4° | 109.4° |
| H18 | C18 | H19 | 109.5° | 109.4° |
| H20 | N | H21 | 109.5° | 111.0° |
| H24 | CB | H25 | 109.4° | 109.4° |
| H27 | CD1 | H28 | 109.4° | 109.5° |
| H27 | CD1 | H29 | 109.5° | 109.5° |
| H28 | CD1 | H29 | 109.5° | 109.5° |
| H30 | CD2 | H31 | 109.5° | 109.5° |
| H30 | CD2 | H32 | 109.5° | 109.5° |
| H31 | CD2 | H32 | 109.5° | 109.4° |
| H35 | C9 | H36 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CD1 | CG | CB | CD2 | 122.9° | 120.0° |
| CD1 | CG | CB | H26 | 118.3° | 120.1° |
| CD1 | CG | CD2 | H26 | 118.3° | 120.0° |
| CD1 | CG | CB | CA | 170.0° | 174.1° |
| CD1 | CG | CB | H24 | 69.2° | 54.2° |
| CD1 | CG | CB | H25 | 49.2° | 65.8° |
| CG | CD1 | H27 | H28 | 120.0° | 120.0° |
| CG | CD1 | H27 | H29 | 120.0° | 120.0° |
| CG | CD1 | H28 | H29 | 120.0° | 119.9° |
| CD1 | CG | CD2 | H30 | 180.0° | 180.0° |
| CD1 | CG | CD2 | H31 | 60.0° | 59.9° |
| CD1 | CG | CD2 | H32 | 60.0° | 60.0° |
| O4 | C4 | C5 | O5 | 73.2° | 177.6° |
| O4 | C4 | C5 | C3 | 120.3° | 119.9° |
| O4 | C4 | C5 | H4 | 119.7° | 120.2° |
| O4 | C4 | C5 | C6 | 159.3° | 62.5° |
| O4 | C4 | C3 | H4 | 119.7° | 120.1° |
| O4 | C4 | C3 | O3 | 49.0° | 57.1° |
| O4 | C4 | C3 | C2 | 72.5° | 176.9° |
| O4 | C4 | C3 | H3 | 167.8° | 63.1° |
| O4 | C4 | C5 | H34 | 42.7° | 57.5° |
| O5 | C5 | C4 | C6 | 127.4° | 120.0° |
| O5 | C5 | C4 | H34 | 115.9° | 120.0° |
| O5 | C5 | C6 | H34 | 114.5° | 120.0° |
| O5 | C5 | C4 | C3 | 47.0° | 57.6° |
| O5 | C5 | C6 | O6 | 74.7° | 65.0° |
| C5 | O5 | C1 | C2 | 59.6° | 61.2° |
| C5 | O5 | C1 | H1 | 179.9° | 178.8° |
| C5 | O5 | C1 | H2 | 60.8° | 58.8° |
| O5 | C5 | C4 | H4 | 167.1° | 62.3° |
| O5 | C5 | C6 | H5 | 45.3° | 175.0° |
| O5 | C5 | C6 | H6 | 165.2° | 55.0° |
| C4 | C5 | C6 | H34 | 116.6° | 120.0° |
| C4 | C5 | O5 | C1 | 53.4° | 61.2° |
| C5 | C4 | C3 | H4 | 120.0° | 119.9° |
| C4 | C5 | C6 | O6 | 54.2° | 175.0° |
| C5 | C4 | C3 | O3 | 169.3° | 62.9° |
| C5 | C4 | C3 | C2 | 47.8° | 56.9° |
| C5 | C4 | C3 | H3 | 71.9° | 176.9° |
| C4 | C5 | C6 | H5 | 174.2° | 55.0° |
| C4 | C5 | C6 | H6 | 65.9° | 64.9° |
| C5 | C4 | O4 | H40 | 180.0° | 60.3° |
| C6 | C5 | O5 | C1 | 77.3° | 178.9° |
| C6 | C5 | C4 | C3 | 80.4° | 177.6° |
| C5 | C6 | O6 | H5 | 120.1° | 120.0° |
| C5 | C6 | O6 | H6 | 120.1° | 120.0° |
| C5 | C6 | O6 | S | 165.5° | 180.0° |
| C6 | C5 | C4 | H4 | 39.7° | 57.7° |
| C5 | C6 | H5 | H6 | 119.7° | 120.0° |
| CB | CG | CD2 | H26 | 118.9° | 119.9° |
| CG | CB | CA | H24 | 120.8° | 120.0° |
| CG | CB | CA | H25 | 120.8° | 120.1° |
| CG | CB | CA | N | 70.4° | 65.2° |
| CG | CB | CA | C | 165.9° | 174.8° |
| CG | CB | CA | H23 | 49.0° | 54.8° |
| CG | CB | H24 | H25 | 117.5° | 120.0° |
| CB | CG | CD1 | H27 | 180.0° | 179.8° |
| CB | CG | CD1 | H28 | 60.0° | 60.1° |
| CB | CG | CD1 | H29 | 60.0° | 59.8° |
| CB | CG | CD2 | H30 | 57.2° | 60.0° |
| CB | CG | CD2 | H31 | 177.1° | 180.0° |
| CB | CG | CD2 | H32 | 62.9° | 60.1° |
| CD2 | CG | CB | CA | 67.1° | 65.8° |
| CD2 | CG | CB | H24 | 53.7° | 174.2° |
| CD2 | CG | CB | H25 | 172.1° | 54.2° |
| CD2 | CG | CD1 | H27 | 56.4° | 59.9° |
| CD2 | CG | CD1 | H28 | 176.4° | 179.9° |
| CD2 | CG | CD1 | H29 | 63.6° | 60.1° |
| CG | CD2 | H30 | H31 | 120.0° | 120.0° |
| CG | CD2 | H30 | H32 | 120.0° | 120.0° |
| CG | CD2 | H31 | H32 | 120.0° | 119.9° |
| O5 | C1 | C2 | H1 | 120.4° | 120.0° |
| O5 | C1 | C2 | H2 | 120.4° | 120.0° |
| O5 | C1 | C2 | C3 | 57.2° | 57.6° |
| O5 | C1 | C2 | C7 | 179.5° | 62.3° |
| O5 | C1 | H1 | H2 | 118.9° | 120.1° |
| O5 | C1 | C2 | H33 | 61.3° | 177.5° |
| C1 | O5 | C5 | H34 | 168.7° | 58.8° |
| C4 | C3 | C2 | C1 | 52.1° | 56.9° |
| C4 | C3 | O3 | C2 | 123.1° | 119.5° |
| C4 | C3 | O3 | H3 | 118.0° | 120.3° |
| C4 | C3 | C2 | H3 | 119.7° | 120.0° |
| C4 | C3 | C2 | C7 | 172.5° | 62.9° |
| C4 | C3 | C2 | H33 | 66.6° | 176.9° |
| C3 | C4 | C5 | H34 | 163.0° | 62.4° |
| C4 | C3 | O3 | H39 | 180.0° | 60.5° |
| C3 | C4 | O4 | H40 | 57.5° | 180.0° |
| CB | CA | N | C | 122.8° | 120.1° |
| CB | CA | N | H23 | 118.9° | 119.9° |
| CB | CA | C | H23 | 116.8° | 120.0° |
| CB | CA | C | N3S | 113.5° | 79.9° |
| CB | CA | C | O | 67.1° | 100.0° |
| CB | CA | N | H20 | 180.0° | 54.0° |
| CB | CA | N | H21 | 60.0° | 69.9° |
| CA | CB | H24 | H25 | 117.5° | 119.9° |
| CA | CB | CG | H26 | 51.7° | 54.0° |
| C6 | O6 | S | N3S | 52.4° | 75.0° |
| C6 | O6 | S | O1S | 62.3° | 38.6° |
| C6 | O6 | S | O2S | 168.0° | 171.5° |
| O6 | C6 | H5 | H6 | 119.7° | 120.0° |
| O6 | C6 | C5 | H34 | 170.7° | 55.0° |
| C1 | C2 | C3 | O3 | 172.7° | 62.9° |
| C1 | C2 | C3 | C7 | 120.3° | 119.9° |
| C1 | C2 | C3 | H33 | 118.7° | 120.0° |
| C1 | C2 | C7 | H33 | 118.3° | 120.2° |
| C1 | C2 | C7 | C8 | 156.1° | 65.0° |
| C2 | C1 | H1 | H2 | 118.9° | 120.0° |
| C1 | C2 | C3 | H3 | 67.5° | 176.9° |
| C1 | C2 | C7 | H7 | 35.3° | 175.0° |
| C1 | C2 | C7 | H8 | 83.1° | 55.0° |
| O3 | C3 | C2 | H3 | 119.8° | 120.2° |
| O3 | C3 | C2 | C7 | 67.0° | 177.3° |
| O3 | C3 | C4 | H4 | 70.7° | 177.2° |
| O3 | C3 | C2 | H33 | 54.0° | 57.1° |
| C3 | C2 | C7 | H33 | 121.0° | 120.1° |
| C3 | C2 | C7 | C8 | 83.2° | 175.3° |
| C3 | C2 | C1 | H1 | 177.6° | 177.6° |
| C3 | C2 | C1 | H2 | 63.1° | 62.4° |
| C2 | C3 | C4 | H4 | 167.8° | 62.9° |
| C3 | C2 | C7 | H7 | 155.9° | 55.3° |
| C3 | C2 | C7 | H8 | 37.6° | 64.7° |
| C2 | C3 | O3 | H39 | 57.0° | 180.0° |
| C2 | C7 | C8 | H7 | 120.9° | 120.0° |
| C2 | C7 | C8 | H8 | 120.8° | 120.0° |
| C2 | C7 | C8 | C9 | 165.7° | 180.0° |
| C7 | C2 | C1 | H1 | 59.2° | 57.7° |
| C7 | C2 | C1 | H2 | 60.1° | 177.7° |
| C7 | C2 | C3 | H3 | 52.8° | 57.1° |
| C2 | C7 | H7 | H8 | 117.3° | 120.0° |
| C2 | C7 | C8 | H9 | 45.2° | 60.0° |
| C2 | C7 | C8 | H10 | 73.7° | 60.1° |
| N | CA | C | H23 | 118.7° | 120.0° |
| N | CA | C | N3S | 11.0° | 160.0° |
| N | CA | C | O | 168.4° | 20.1° |
| CA | N | H20 | H21 | 120.0° | 124.0° |
| N | CA | CB | H24 | 168.8° | 54.8° |
| N | CA | CB | H25 | 50.4° | 174.7° |
| CA | C | N3S | O | 179.4° | 179.9° |
| CA | C | N3S | S | 179.7° | 179.9° |
| C | CA | N | H20 | 57.2° | 66.0° |
| C | CA | N | H21 | 62.8° | 170.0° |
| C | CA | CB | H24 | 45.0° | 65.3° |
| C | CA | CB | H25 | 73.3° | 54.6° |
| CA | C | N3S | H37 | 0.3° | 0.1° |
| O6 | S | N3S | C | 64.5° | 65.0° |
| O6 | S | N3S | O1S | 114.7° | 113.5° |
| O6 | S | N3S | O2S | 111.9° | 113.5° |
| O6 | S | O1S | O2S | 119.2° | 122.9° |
| S | O6 | C6 | H5 | 74.4° | 60.0° |
| S | O6 | C6 | H6 | 45.4° | 60.0° |
| O6 | S | N3S | H37 | 115.6° | 115.0° |
| C | N3S | S | H37 | 180.0° | 180.0° |
| C | N3S | S | O1S | 179.2° | 178.5° |
| C | N3S | S | O2S | 47.5° | 48.5° |
| N3S | C | CA | H23 | 129.7° | 40.0° |
| O | C | N3S | S | 0.3° | 0.0° |
| O | C | CA | H23 | 49.7° | 140.0° |
| O | C | N3S | H37 | 179.7° | 180.0° |
| N3S | S | O1S | O2S | 126.7° | 123.0° |
| C7 | C8 | C9 | H9 | 120.6° | 120.0° |
| C7 | C8 | C9 | H10 | 120.5° | 119.9° |
| C7 | C8 | C9 | N10 | 70.8° | 180.0° |
| C8 | C7 | H7 | H8 | 117.3° | 120.0° |
| C7 | C8 | H9 | H10 | 118.4° | 120.0° |
| C8 | C7 | C2 | H33 | 37.8° | 55.1° |
| C7 | C8 | C9 | H35 | 49.7° | 60.0° |
| C7 | C8 | C9 | H36 | 168.7° | 60.0° |
| C8 | C9 | N10 | H35 | 120.5° | 120.1° |
| C8 | C9 | N10 | H36 | 120.5° | 120.0° |
| C8 | C9 | N10 | N11 | 84.7° | 54.9° |
| C8 | C9 | N10 | C14 | 96.4° | 125.0° |
| C9 | C8 | C7 | H7 | 73.4° | 60.0° |
| C9 | C8 | C7 | H8 | 44.9° | 60.0° |
| C9 | C8 | H9 | H10 | 118.4° | 120.0° |
| C8 | C9 | H35 | H36 | 118.4° | 120.0° |
| O1S | S | N3S | H37 | 0.8° | 1.5° |
| O2S | S | N3S | H37 | 132.5° | 131.5° |
| C9 | N10 | N11 | C14 | 179.1° | 180.0° |
| C9 | N10 | N11 | N12 | 178.9° | 179.8° |
| C9 | N10 | C14 | C13 | 178.8° | 180.0° |
| N10 | C9 | C8 | H9 | 168.6° | 60.0° |
| N10 | C9 | C8 | H10 | 49.7° | 60.1° |
| C9 | N10 | C14 | H11 | 1.2° | 0.1° |
| N10 | C9 | H35 | H36 | 118.4° | 120.0° |
| N10 | N11 | N12 | C13 | 0.1° | 0.4° |
| N11 | N10 | C14 | C13 | 0.2° | 0.0° |
| N11 | N10 | C14 | H11 | 179.8° | 180.0° |
| N11 | N10 | C9 | H35 | 154.8° | 175.0° |
| N11 | N10 | C9 | H36 | 35.9° | 65.0° |
| N12 | N11 | N10 | C14 | 0.2° | 0.2° |
| N11 | N12 | C13 | C14 | 0.1° | 0.4° |
| N11 | N12 | C13 | C15 | 179.9° | 179.8° |
| N10 | C14 | C13 | N12 | 0.2° | 0.3° |
| N10 | C14 | C13 | H11 | 180.0° | 180.0° |
| N10 | C14 | C13 | C15 | 179.8° | 180.0° |
| C14 | N10 | C9 | H35 | 24.1° | 5.0° |
| C14 | N10 | C9 | H36 | 143.0° | 115.0° |
| N12 | C13 | C14 | C15 | 180.0° | 179.7° |
| N12 | C13 | C15 | C16 | 117.9° | 54.7° |
| N12 | C13 | C14 | H11 | 179.8° | 179.7° |
| N12 | C13 | C15 | H12 | 121.6° | 65.3° |
| N12 | C13 | C15 | H13 | 2.6° | 174.7° |
| C14 | C13 | C15 | C16 | 62.1° | 125.0° |
| C14 | C13 | C15 | H12 | 58.5° | 115.0° |
| C14 | C13 | C15 | H13 | 177.5° | 5.0° |
| C13 | C15 | C16 | H12 | 120.5° | 120.0° |
| C13 | C15 | C16 | H13 | 120.5° | 120.0° |
| C13 | C15 | C16 | C17 | 179.7° | 180.0° |
| C15 | C13 | C14 | H11 | 0.1° | 0.0° |
| C13 | C15 | H12 | H13 | 118.4° | 120.0° |
| C13 | C15 | C16 | H14 | 59.7° | 59.9° |
| C13 | C15 | C16 | H15 | 59.1° | 60.0° |
| C15 | C16 | C17 | H14 | 120.6° | 120.0° |
| C15 | C16 | C17 | H15 | 120.6° | 120.0° |
| C15 | C16 | C17 | C18 | 71.6° | 180.0° |
| C16 | C15 | H12 | H13 | 118.4° | 119.9° |
| C15 | C16 | H14 | H15 | 118.2° | 119.9° |
| C15 | C16 | C17 | H16 | 49.5° | 59.9° |
| C15 | C16 | C17 | H17 | 167.2° | 60.0° |
| C16 | C17 | C18 | H16 | 121.1° | 120.0° |
| C16 | C17 | C18 | H17 | 121.2° | 120.0° |
| C16 | C17 | C18 | O19 | 174.1° | 180.0° |
| C17 | C16 | C15 | H12 | 59.2° | 60.0° |
| C17 | C16 | C15 | H13 | 59.8° | 60.0° |
| C17 | C16 | H14 | H15 | 118.1° | 120.0° |
| C16 | C17 | H16 | H17 | 116.4° | 120.0° |
| C16 | C17 | C18 | H18 | 53.7° | 59.9° |
| C16 | C17 | C18 | H19 | 65.5° | 60.0° |
| C17 | C18 | O19 | H18 | 120.4° | 120.0° |
| C17 | C18 | O19 | H19 | 120.4° | 120.0° |
| C18 | C17 | C16 | H14 | 167.8° | 60.0° |
| C18 | C17 | C16 | H15 | 49.0° | 60.0° |
| C18 | C17 | H16 | H17 | 116.4° | 120.0° |
| C17 | C18 | H18 | H19 | 118.8° | 119.9° |
| C17 | C18 | O19 | H38 | 180.0° | 180.0° |
| O19 | C18 | C17 | H16 | 64.8° | 60.0° |
| O19 | C18 | C17 | H17 | 52.9° | 60.0° |
| O19 | C18 | H18 | H19 | 118.7° | 120.0° |
| H1 | C1 | C2 | H33 | 59.0° | 62.5° |
| H2 | C1 | C2 | H33 | 178.3° | 57.5° |
| H3 | C3 | C4 | H4 | 48.2° | 57.0° |
| H3 | C3 | C2 | H33 | 173.8° | 63.1° |
| H3 | C3 | O3 | H39 | 61.9° | 59.8° |
| H4 | C4 | C5 | H34 | 76.9° | 177.7° |
| H4 | C4 | O4 | H40 | 61.3° | 59.9° |
| H5 | C6 | C5 | H34 | 69.2° | 65.0° |
| H6 | C6 | C5 | H34 | 50.6° | 175.0° |
| H7 | C7 | C8 | H9 | 166.0° | 60.0° |
| H7 | C7 | C8 | H10 | 47.1° | 180.0° |
| H7 | C7 | C2 | H33 | 83.1° | 64.8° |
| H8 | C7 | C8 | H9 | 75.6° | 180.0° |
| H8 | C7 | C8 | H10 | 165.4° | 60.0° |
| H8 | C7 | C2 | H33 | 158.6° | 175.2° |
| H9 | C8 | C9 | H35 | 70.9° | 180.0° |
| H9 | C8 | C9 | H36 | 48.1° | 60.0° |
| H10 | C8 | C9 | H35 | 170.2° | 60.0° |
| H10 | C8 | C9 | H36 | 70.8° | 180.0° |
| H12 | C15 | C16 | H14 | 179.8° | 180.0° |
| H12 | C15 | C16 | H15 | 61.4° | 60.0° |
| H13 | C15 | C16 | H14 | 60.8° | 60.1° |
| H13 | C15 | C16 | H15 | 179.6° | 180.0° |
| H14 | C16 | C17 | H16 | 71.1° | 180.0° |
| H14 | C16 | C17 | H17 | 46.6° | 60.0° |
| H15 | C16 | C17 | H16 | 170.2° | 60.1° |
| H15 | C16 | C17 | H17 | 72.2° | 180.0° |
| H16 | C17 | C18 | H18 | 174.8° | 180.0° |
| H16 | C17 | C18 | H19 | 55.6° | 60.1° |
| H17 | C17 | C18 | H18 | 67.5° | 60.1° |
| H17 | C17 | C18 | H19 | 173.3° | 180.0° |
| H18 | C18 | O19 | H38 | 59.6° | 60.0° |
| H19 | C18 | O19 | H38 | 59.6° | 60.0° |
| H20 | N | CA | H23 | 61.1° | 174.0° |
| H21 | N | CA | H23 | 178.9° | 50.0° |
| H23 | CA | CB | H24 | 71.9° | 174.7° |
| H23 | CA | CB | H25 | 169.8° | 65.4° |
| H24 | CB | CG | H26 | 172.5° | 65.9° |
| H25 | CB | CG | H26 | 69.1° | 174.1° |
| H26 | CG | CD1 | H27 | 61.7° | 60.1° |
| H26 | CG | CD1 | H28 | 58.2° | 59.9° |
| H26 | CG | CD1 | H29 | 178.2° | 179.9° |
| H26 | CG | CD2 | H30 | 61.7° | 60.0° |
| H26 | CG | CD2 | H31 | 58.2° | 60.1° |
| H26 | CG | CD2 | H32 | 178.3° | 180.0° |
| H27 | CD1 | H28 | H29 | 120.0° | 120.1° |
| H30 | CD2 | H31 | H32 | 120.0° | 120.0° |
