OVH
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 | |
| O5 | C5 | sing | 1.43Å | 1.43Å | |
| O5 | C1 | sing | 1.43Å | 1.43Å | |
| C5 | C4 | sing | 1.53Å | 1.53Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| CG | CB | sing | 1.53Å | 1.53Å | |
| CG | CD2 | sing | 1.53Å | 1.53Å | |
| 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 | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | C7 | sing | 1.53Å | 1.53Å | |
| C3 | O3 | sing | 1.43Å | 1.42Å | |
| 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 | |
| C7 | C8 | sing | 1.53Å | 1.53Å | |
| N3S | S | sing | 1.66Å | 1.61Å | |
| O1S | S | doub | 1.42Å | 1.42Å | |
| S | O2S | doub | 1.42Å | 1.42Å | |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C9 | N10 | sing | 1.46Å | 1.46Å | |
| N11 | N10 | sing | 1.29Å | 1.34Å | Aromatic |
| N11 | N12 | doub | 1.29Å | 1.32Å | Aromatic |
| N10 | C14 | sing | 1.35Å | 1.35Å | Aromatic |
| N12 | C13 | sing | 1.35Å | 1.36Å | Aromatic |
| C14 | C13 | doub | 1.36Å | 1.37Å | Aromatic |
| C13 | C15 | sing | 1.48Å | 1.48Å | |
| C20 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
| C19 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
| C16 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.38Å | Aromatic |
| N | H1 | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | H4 | sing | 1.09Å | 1.10Å | |
| CB | H5 | sing | 1.09Å | 1.10Å | |
| CB | H6 | sing | 1.09Å | 1.10Å | |
| CG | H7 | sing | 1.09Å | 1.10Å | |
| CD1 | H8 | sing | 1.09Å | 1.10Å | |
| CD1 | H9 | sing | 1.09Å | 1.10Å | |
| CD1 | H10 | sing | 1.09Å | 1.10Å | |
| CD2 | H11 | sing | 1.09Å | 1.10Å | |
| CD2 | H12 | sing | 1.09Å | 1.10Å | |
| CD2 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C1 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.08Å | 1.08Å | |
| C16 | H17 | sing | 1.08Å | 1.08Å | |
| C17 | H18 | sing | 1.08Å | 1.08Å | |
| C18 | H19 | sing | 1.08Å | 1.08Å | |
| C19 | H20 | sing | 1.08Å | 1.08Å | |
| C2 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.08Å | 1.08Å | |
| C3 | H23 | sing | 1.09Å | 1.10Å | |
| C4 | H24 | sing | 1.09Å | 1.10Å | |
| C5 | H25 | sing | 1.09Å | 1.10Å | |
| C6 | H26 | sing | 1.09Å | 1.10Å | |
| C6 | H27 | sing | 1.09Å | 1.10Å | |
| C7 | H28 | sing | 1.09Å | 1.10Å | |
| C7 | H29 | sing | 1.09Å | 1.10Å | |
| C8 | H30 | sing | 1.09Å | 1.10Å | |
| C8 | H31 | sing | 1.09Å | 1.10Å | |
| C9 | H32 | sing | 1.09Å | 1.10Å | |
| C9 | H33 | sing | 1.09Å | 1.10Å | |
| N3S | H34 | sing | 0.97Å | 1.00Å | |
| O3 | H35 | sing | 0.97Å | 0.95Å | |
| O4 | H36 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CD1 | CG | CB | 111.0° | 109.5° |
| CD1 | CG | CD2 | 110.1° | 109.5° |
| CD1 | CG | H7 | 108.2° | 109.5° |
| CG | CD1 | H8 | 109.5° | 109.5° |
| CG | CD1 | H9 | 109.4° | 109.5° |
| CG | CD1 | H10 | 109.5° | 109.5° |
| O4 | C4 | C5 | 108.1° | 109.6° |
| O4 | C4 | C3 | 109.4° | 109.5° |
| O4 | C4 | H24 | 109.8° | 109.5° |
| C4 | O4 | H36 | 109.5° | 114.0° |
| C5 | O5 | C1 | 113.9° | 114.1° |
| O5 | C5 | C4 | 112.4° | 109.4° |
| O5 | C5 | C6 | 109.6° | 109.4° |
| O5 | C5 | H25 | 106.6° | 109.5° |
| O5 | C1 | C2 | 112.1° | 109.4° |
| O5 | C1 | H14 | 108.8° | 109.5° |
| O5 | C1 | H15 | 108.8° | 109.5° |
| C4 | C5 | C6 | 116.3° | 109.5° |
| C5 | C4 | C3 | 112.7° | 109.1° |
| C5 | C4 | H24 | 108.4° | 109.5° |
| C4 | C5 | H25 | 105.5° | 109.5° |
| C5 | C6 | O6 | 110.0° | 109.5° |
| C6 | C5 | H25 | 105.7° | 109.5° |
| C5 | C6 | H26 | 109.3° | 109.4° |
| C5 | C6 | H27 | 109.3° | 109.5° |
| CB | CG | CD2 | 111.3° | 109.5° |
| CG | CB | CA | 113.8° | 109.5° |
| CG | CB | H5 | 108.4° | 109.5° |
| CG | CB | H6 | 108.4° | 109.5° |
| CB | CG | H7 | 108.1° | 109.5° |
| CD2 | CG | H7 | 108.0° | 109.5° |
| CG | CD2 | H11 | 109.5° | 109.4° |
| CG | CD2 | H12 | 109.5° | 109.5° |
| CG | CD2 | H13 | 109.5° | 109.5° |
| C4 | C3 | C2 | 112.9° | 109.0° |
| C4 | C3 | O3 | 107.6° | 109.5° |
| C4 | C3 | H23 | 108.3° | 109.6° |
| C3 | C4 | H24 | 108.4° | 109.5° |
| CB | CA | N | 110.1° | 109.4° |
| CB | CA | C | 110.8° | 109.5° |
| CB | CA | H4 | 107.9° | 109.5° |
| CA | CB | H5 | 108.4° | 109.5° |
| CA | CB | H6 | 108.4° | 109.4° |
| C6 | O6 | S | 117.2° | 114.0° |
| O6 | C6 | H26 | 109.3° | 109.5° |
| O6 | C6 | H27 | 109.3° | 109.5° |
| C1 | C2 | C3 | 108.9° | 109.1° |
| C1 | C2 | C7 | 103.8° | 109.6° |
| C2 | C1 | H14 | 108.8° | 109.5° |
| C2 | C1 | H15 | 108.8° | 109.5° |
| C1 | C2 | H21 | 109.2° | 109.5° |
| C3 | C2 | C7 | 116.7° | 109.5° |
| C2 | C3 | O3 | 109.9° | 109.6° |
| C3 | C2 | H21 | 109.0° | 109.5° |
| C2 | C3 | H23 | 108.3° | 109.5° |
| C2 | C7 | C8 | 117.6° | 109.4° |
| C7 | C2 | H21 | 109.0° | 109.6° |
| C2 | C7 | H28 | 107.4° | 109.5° |
| C2 | C7 | H29 | 107.4° | 109.5° |
| O3 | C3 | H23 | 109.7° | 109.5° |
| C3 | O3 | H35 | 109.5° | 114.0° |
| N | CA | C | 111.2° | 109.5° |
| CA | N | H1 | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | H4 | 108.7° | 109.5° |
| CA | C | N3S | 116.8° | 120.0° |
| CA | C | O | 120.9° | 120.0° |
| C | CA | H4 | 108.0° | 109.5° |
| O6 | S | N3S | 106.3° | 107.2° |
| O6 | S | O1S | 106.6° | 106.4° |
| O6 | S | O2S | 104.0° | 106.4° |
| N3S | C | O | 122.2° | 120.0° |
| C | N3S | S | 129.6° | 120.0° |
| C | N3S | H34 | 115.2° | 120.0° |
| C7 | C8 | C9 | 116.7° | 109.5° |
| C8 | C7 | H28 | 107.4° | 109.5° |
| C8 | C7 | H29 | 107.4° | 109.4° |
| C7 | C8 | H30 | 107.6° | 109.4° |
| C7 | C8 | H31 | 107.6° | 109.5° |
| N3S | S | O1S | 106.7° | 106.4° |
| N3S | S | O2S | 111.1° | 106.4° |
| S | N3S | H34 | 115.2° | 120.0° |
| O1S | S | O2S | 121.1° | 123.2° |
| C8 | C9 | N10 | 114.3° | 109.5° |
| C9 | C8 | H30 | 107.7° | 109.5° |
| C9 | C8 | H31 | 107.7° | 109.4° |
| C8 | C9 | H32 | 108.3° | 109.5° |
| C8 | C9 | H33 | 108.3° | 109.5° |
| C9 | N10 | N11 | 120.2° | 125.8° |
| C9 | N10 | C14 | 128.6° | 125.7° |
| N10 | C9 | H32 | 108.3° | 109.5° |
| N10 | C9 | H33 | 108.2° | 109.5° |
| N10 | N11 | N12 | 106.9° | 110.4° |
| N11 | N10 | C14 | 111.2° | 108.5° |
| N11 | N12 | C13 | 109.1° | 108.8° |
| N10 | C14 | C13 | 104.8° | 106.1° |
| N10 | C14 | H16 | 127.6° | 127.0° |
| N12 | C13 | C14 | 108.0° | 106.1° |
| N12 | C13 | C15 | 122.1° | 126.9° |
| C14 | C13 | C15 | 129.8° | 126.9° |
| C13 | C14 | H16 | 127.6° | 126.9° |
| C13 | C15 | C20 | 120.5° | 120.1° |
| C13 | C15 | C16 | 120.7° | 120.1° |
| C15 | C20 | C19 | 120.5° | 119.9° |
| C20 | C15 | C16 | 118.7° | 119.8° |
| C15 | C20 | H22 | 119.8° | 120.1° |
| C20 | C19 | C18 | 120.3° | 120.1° |
| C20 | C19 | H20 | 119.9° | 119.9° |
| C19 | C20 | H22 | 119.7° | 120.1° |
| C15 | C16 | C17 | 120.4° | 119.8° |
| C15 | C16 | H17 | 119.8° | 120.1° |
| C19 | C18 | C17 | 119.7° | 120.2° |
| C19 | C18 | H19 | 120.1° | 119.9° |
| C18 | C19 | H20 | 119.8° | 120.0° |
| C16 | C17 | C18 | 120.3° | 120.1° |
| C17 | C16 | H17 | 119.8° | 120.1° |
| C16 | C17 | H18 | 119.8° | 119.9° |
| C18 | C17 | H18 | 119.8° | 119.9° |
| C17 | C18 | H19 | 120.2° | 119.9° |
| H1 | N | H2 | 109.5° | 111.0° |
| H5 | CB | H6 | 109.5° | 109.4° |
| H8 | CD1 | H9 | 109.5° | 109.4° |
| H8 | CD1 | H10 | 109.5° | 109.5° |
| H9 | CD1 | H10 | 109.5° | 109.5° |
| H11 | CD2 | H12 | 109.5° | 109.5° |
| H11 | CD2 | H13 | 109.5° | 109.4° |
| H12 | CD2 | H13 | 109.4° | 109.5° |
| H14 | C1 | H15 | 109.5° | 109.5° |
| H26 | C6 | H27 | 109.5° | 109.5° |
| H28 | C7 | H29 | 109.4° | 109.5° |
| H30 | C8 | H31 | 109.5° | 109.5° |
| H32 | C9 | H33 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CD1 | CG | CB | CD2 | 123.1° | 120.0° |
| CD1 | CG | CB | H7 | 118.5° | 120.0° |
| CD1 | CG | CD2 | H7 | 118.0° | 120.0° |
| CD1 | CG | CB | CA | 168.2° | 175.0° |
| CD1 | CG | CB | H5 | 71.1° | 55.0° |
| CD1 | CG | CB | H6 | 47.6° | 65.0° |
| CG | CD1 | H8 | H9 | 120.0° | 120.0° |
| CG | CD1 | H8 | H10 | 120.0° | 120.0° |
| CG | CD1 | H9 | H10 | 120.0° | 120.1° |
| CD1 | CG | CD2 | H11 | 180.0° | 180.0° |
| CD1 | CG | CD2 | H12 | 60.0° | 60.0° |
| CD1 | CG | CD2 | H13 | 60.0° | 60.1° |
| O4 | C4 | C5 | O5 | 74.7° | 177.6° |
| O4 | C4 | C5 | C3 | 121.1° | 119.9° |
| O4 | C4 | C5 | H24 | 119.0° | 120.2° |
| O4 | C4 | C5 | C6 | 157.9° | 62.5° |
| O4 | C4 | C3 | H24 | 119.7° | 120.1° |
| O4 | C4 | C3 | C2 | 74.5° | 177.0° |
| O4 | C4 | C3 | O3 | 46.9° | 57.1° |
| O4 | C4 | C3 | H23 | 165.5° | 63.1° |
| O4 | C4 | C5 | H25 | 41.1° | 57.5° |
| O5 | C5 | C4 | C6 | 127.4° | 119.9° |
| O5 | C5 | C4 | H25 | 115.8° | 120.0° |
| O5 | C5 | C6 | H25 | 114.5° | 120.0° |
| O5 | C5 | C4 | C3 | 46.4° | 57.6° |
| O5 | C5 | C6 | O6 | 76.7° | 65.1° |
| C5 | O5 | C1 | C2 | 60.8° | 61.2° |
| C5 | O5 | C1 | H14 | 178.8° | 178.9° |
| C5 | O5 | C1 | H15 | 59.6° | 58.8° |
| O5 | C5 | C4 | H24 | 166.3° | 62.3° |
| O5 | C5 | C6 | H26 | 43.4° | 174.9° |
| O5 | C5 | C6 | H27 | 163.3° | 55.0° |
| C1 | O5 | C5 | C4 | 54.3° | 61.2° |
| C1 | O5 | C5 | C6 | 76.7° | 178.8° |
| O5 | C1 | C2 | H14 | 120.4° | 119.9° |
| O5 | C1 | C2 | H15 | 120.4° | 120.0° |
| O5 | C1 | C2 | C3 | 56.9° | 57.6° |
| O5 | C1 | C2 | C7 | 178.2° | 62.3° |
| O5 | C1 | H14 | H15 | 118.8° | 120.0° |
| O5 | C1 | C2 | H21 | 62.1° | 177.5° |
| C1 | O5 | C5 | H25 | 169.4° | 58.9° |
| C4 | C5 | C6 | H25 | 116.7° | 120.1° |
| C5 | C4 | C3 | H24 | 119.9° | 119.9° |
| C4 | C5 | C6 | O6 | 52.2° | 175.0° |
| C5 | C4 | C3 | C2 | 45.8° | 57.0° |
| C5 | C4 | C3 | O3 | 167.3° | 62.9° |
| C5 | C4 | C3 | H23 | 74.2° | 176.9° |
| C4 | C5 | C6 | H26 | 172.3° | 55.0° |
| C4 | C5 | C6 | H27 | 67.9° | 65.0° |
| C5 | C4 | O4 | H36 | 180.0° | 60.2° |
| C6 | C5 | C4 | C3 | 81.0° | 177.6° |
| C5 | C6 | O6 | H26 | 120.1° | 120.0° |
| C5 | C6 | O6 | H27 | 120.1° | 120.0° |
| C5 | C6 | O6 | S | 159.3° | 180.0° |
| C6 | C5 | C4 | H24 | 38.9° | 57.7° |
| C5 | C6 | H26 | H27 | 119.7° | 120.0° |
| CB | CG | CD2 | H7 | 118.5° | 120.0° |
| CG | CB | CA | H5 | 120.6° | 120.0° |
| CG | CB | CA | H6 | 120.6° | 120.0° |
| CG | CB | CA | N | 70.3° | 65.0° |
| CG | CB | CA | C | 166.3° | 175.0° |
| CG | CB | CA | H4 | 48.3° | 55.0° |
| CG | CB | H5 | H6 | 118.0° | 120.0° |
| CB | CG | CD1 | H8 | 180.0° | 60.0° |
| CB | CG | CD1 | H9 | 60.0° | 180.0° |
| CB | CG | CD1 | H10 | 60.0° | 60.0° |
| CB | CG | CD2 | H11 | 56.4° | 60.0° |
| CB | CG | CD2 | H12 | 176.5° | 180.0° |
| CB | CG | CD2 | H13 | 63.6° | 60.0° |
| CD2 | CG | CB | CA | 68.7° | 65.0° |
| CD2 | CG | CB | H5 | 52.0° | 175.0° |
| CD2 | CG | CB | H6 | 170.7° | 55.0° |
| CD2 | CG | CD1 | H8 | 56.3° | 60.0° |
| CD2 | CG | CD1 | H9 | 176.3° | 60.0° |
| CD2 | CG | CD1 | H10 | 63.7° | 180.0° |
| CG | CD2 | H11 | H12 | 120.0° | 120.0° |
| CG | CD2 | H11 | H13 | 120.0° | 120.0° |
| CG | CD2 | H12 | H13 | 120.0° | 120.0° |
| C4 | C3 | C2 | C1 | 50.1° | 57.0° |
| C4 | C3 | C2 | O3 | 120.2° | 119.9° |
| C4 | C3 | C2 | H23 | 120.0° | 120.0° |
| C4 | C3 | C2 | C7 | 167.0° | 62.9° |
| C4 | C3 | O3 | H23 | 117.7° | 120.3° |
| C4 | C3 | C2 | H21 | 69.0° | 176.9° |
| C3 | C4 | C5 | H25 | 162.2° | 62.4° |
| C4 | C3 | O3 | H35 | 180.0° | 60.4° |
| C3 | C4 | O4 | H36 | 56.9° | 179.9° |
| CB | CA | N | C | 123.1° | 120.0° |
| CB | CA | N | H4 | 118.0° | 120.0° |
| CB | CA | C | H4 | 118.0° | 120.0° |
| CB | CA | C | N3S | 114.4° | 80.0° |
| CB | CA | C | O | 66.3° | 99.9° |
| CB | CA | N | H1 | 180.0° | 60.0° |
| CB | CA | N | H2 | 60.0° | 63.9° |
| CA | CB | H5 | H6 | 118.0° | 119.9° |
| CA | CB | CG | H7 | 49.8° | 55.0° |
| C6 | O6 | S | N3S | 49.1° | 75.0° |
| C6 | O6 | S | O1S | 64.5° | 38.5° |
| C6 | O6 | S | O2S | 166.5° | 171.5° |
| O6 | C6 | C5 | H25 | 168.9° | 54.9° |
| O6 | C6 | H26 | H27 | 119.8° | 120.0° |
| C1 | C2 | C3 | C7 | 117.0° | 119.9° |
| C1 | C2 | C3 | H21 | 119.1° | 119.9° |
| C1 | C2 | C7 | H21 | 116.3° | 120.2° |
| C1 | C2 | C3 | O3 | 170.3° | 62.9° |
| C1 | C2 | C7 | C8 | 173.7° | 65.0° |
| C2 | C1 | H14 | H15 | 118.8° | 120.1° |
| C1 | C2 | C3 | H23 | 69.9° | 177.0° |
| C1 | C2 | C7 | H28 | 65.1° | 55.0° |
| C1 | C2 | C7 | H29 | 52.6° | 175.0° |
| C3 | C2 | C7 | H21 | 124.0° | 120.1° |
| C2 | C3 | O3 | H23 | 119.0° | 120.2° |
| C3 | C2 | C7 | C8 | 54.0° | 175.3° |
| C3 | C2 | C1 | H14 | 177.3° | 177.6° |
| C3 | C2 | C1 | H15 | 63.5° | 62.4° |
| C2 | C3 | C4 | H24 | 165.7° | 62.9° |
| C3 | C2 | C7 | H28 | 175.1° | 64.7° |
| C3 | C2 | C7 | H29 | 67.2° | 55.4° |
| C2 | C3 | O3 | H35 | 56.6° | 180.0° |
| C7 | C2 | C3 | O3 | 72.8° | 177.2° |
| C2 | C7 | C8 | H28 | 121.2° | 120.0° |
| C2 | C7 | C8 | H29 | 121.2° | 120.0° |
| C2 | C7 | C8 | C9 | 128.3° | 180.0° |
| C7 | C2 | C1 | H14 | 57.8° | 57.7° |
| C7 | C2 | C1 | H15 | 61.4° | 177.7° |
| C7 | C2 | C3 | H23 | 47.1° | 57.0° |
| C2 | C7 | H28 | H29 | 116.4° | 120.1° |
| C2 | C7 | C8 | H30 | 110.6° | 60.1° |
| C2 | C7 | C8 | H31 | 7.3° | 60.0° |
| O3 | C3 | C2 | H21 | 51.2° | 57.0° |
| O3 | C3 | C4 | H24 | 72.8° | 177.2° |
| N | CA | C | H4 | 119.3° | 120.0° |
| N | CA | C | N3S | 8.3° | 160.0° |
| N | CA | C | O | 171.0° | 20.0° |
| CA | N | H1 | H2 | 120.0° | 124.0° |
| N | CA | CB | H5 | 169.1° | 55.0° |
| N | CA | CB | H6 | 50.3° | 175.0° |
| CA | C | N3S | O | 179.3° | 180.0° |
| CA | C | N3S | S | 179.6° | 180.0° |
| C | CA | N | H1 | 56.9° | 60.0° |
| C | CA | N | H2 | 63.1° | 176.1° |
| C | CA | CB | H5 | 45.7° | 65.0° |
| C | CA | CB | H6 | 73.1° | 55.0° |
| CA | C | N3S | H34 | 0.4° | 0.0° |
| O6 | S | N3S | C | 68.0° | 65.0° |
| O6 | S | N3S | O1S | 113.5° | 113.5° |
| O6 | S | N3S | O2S | 112.5° | 113.5° |
| O6 | S | O1S | O2S | 118.3° | 122.9° |
| S | O6 | C6 | H26 | 80.6° | 60.0° |
| S | O6 | C6 | H27 | 39.2° | 60.0° |
| O6 | S | N3S | H34 | 112.0° | 115.0° |
| C | N3S | S | H34 | 180.0° | 179.9° |
| C | N3S | S | O1S | 178.5° | 178.5° |
| C | N3S | S | O2S | 44.5° | 48.5° |
| N3S | C | CA | H4 | 127.6° | 40.0° |
| O | C | N3S | S | 1.1° | 0.0° |
| O | C | CA | H4 | 51.7° | 140.0° |
| O | C | N3S | H34 | 178.9° | 179.9° |
| C7 | C8 | C9 | H30 | 121.0° | 120.0° |
| C7 | C8 | C9 | H31 | 121.0° | 120.0° |
| C7 | C8 | C9 | N10 | 53.7° | 180.0° |
| C8 | C7 | C2 | H21 | 70.0° | 55.2° |
| C8 | C7 | H28 | H29 | 116.3° | 120.0° |
| C7 | C8 | H30 | H31 | 116.7° | 120.0° |
| C7 | C8 | C9 | H32 | 174.4° | 60.0° |
| C7 | C8 | C9 | H33 | 67.0° | 60.0° |
| N3S | S | O1S | O2S | 128.4° | 123.0° |
| O1S | S | N3S | H34 | 1.5° | 1.5° |
| O2S | S | N3S | H34 | 135.4° | 131.4° |
| C8 | C9 | N10 | H32 | 120.7° | 120.0° |
| C8 | C9 | N10 | H33 | 120.7° | 120.0° |
| C8 | C9 | N10 | N11 | 152.4° | 55.0° |
| C8 | C9 | N10 | C14 | 25.6° | 125.0° |
| C9 | C8 | C7 | H28 | 7.1° | 60.0° |
| C9 | C8 | C7 | H29 | 110.5° | 60.0° |
| C9 | C8 | H30 | H31 | 116.8° | 120.0° |
| C8 | C9 | H32 | H33 | 117.8° | 120.0° |
| C9 | N10 | N11 | C14 | 178.3° | 180.0° |
| C9 | N10 | N11 | N12 | 177.7° | 179.8° |
| C9 | N10 | C14 | C13 | 177.2° | 180.0° |
| C9 | N10 | C14 | H16 | 2.8° | 0.0° |
| N10 | C9 | C8 | H30 | 67.3° | 60.0° |
| N10 | C9 | C8 | H31 | 174.7° | 60.0° |
| N10 | C9 | H32 | H33 | 117.8° | 120.0° |
| N10 | N11 | N12 | C13 | 0.0° | 0.4° |
| N11 | N10 | C14 | C13 | 1.0° | 0.0° |
| N11 | N10 | C14 | H16 | 179.0° | 180.0° |
| N11 | N10 | C9 | H32 | 86.9° | 175.0° |
| N11 | N10 | C9 | H33 | 31.7° | 65.0° |
| N12 | N11 | N10 | C14 | 0.6° | 0.2° |
| N11 | N12 | C13 | C14 | 0.6° | 0.4° |
| N11 | N12 | C13 | C15 | 176.8° | 179.8° |
| N10 | C14 | C13 | N12 | 0.9° | 0.2° |
| N10 | C14 | C13 | H16 | 180.0° | 180.0° |
| N10 | C14 | C13 | C15 | 176.2° | 180.0° |
| C14 | N10 | C9 | H32 | 95.1° | 5.0° |
| C14 | N10 | C9 | H33 | 146.4° | 115.0° |
| N12 | C13 | C14 | C15 | 177.2° | 179.8° |
| N12 | C13 | C15 | C20 | 30.7° | 180.0° |
| N12 | C13 | C15 | C16 | 149.9° | 0.2° |
| N12 | C13 | C14 | H16 | 179.1° | 179.8° |
| C14 | C13 | C15 | C20 | 146.1° | 0.2° |
| C14 | C13 | C15 | C16 | 33.3° | 180.0° |
| C13 | C15 | C20 | C16 | 179.4° | 179.9° |
| C13 | C15 | C20 | C19 | 179.4° | 179.7° |
| C13 | C15 | C16 | C17 | 179.5° | 180.0° |
| C15 | C13 | C14 | H16 | 3.8° | 0.0° |
| C13 | C15 | C16 | H17 | 0.5° | 0.1° |
| C13 | C15 | C20 | H22 | 0.6° | 0.1° |
| C15 | C20 | C19 | H22 | 180.0° | 179.7° |
| C15 | C20 | C19 | C18 | 0.3° | 0.6° |
| C20 | C15 | C16 | C17 | 0.1° | 0.1° |
| C20 | C15 | C16 | H17 | 179.8° | 179.7° |
| C15 | C20 | C19 | H20 | 179.8° | 179.7° |
| C19 | C20 | C15 | C16 | 0.0° | 0.5° |
| C20 | C19 | C18 | H20 | 180.0° | 179.7° |
| C20 | C19 | C18 | C17 | 0.3° | 0.3° |
| C20 | C19 | C18 | H19 | 179.7° | 179.8° |
| C15 | C16 | C17 | H17 | 180.0° | 179.9° |
| C15 | C16 | C17 | C18 | 0.1° | 0.1° |
| C15 | C16 | C17 | H18 | 179.9° | 180.0° |
| C16 | C15 | C20 | H22 | 180.0° | 179.8° |
| C19 | C18 | C17 | C16 | 0.2° | 0.0° |
| C19 | C18 | C17 | H19 | 180.0° | 179.9° |
| C19 | C18 | C17 | H18 | 179.8° | 179.9° |
| C18 | C19 | C20 | H22 | 179.8° | 179.7° |
| C16 | C17 | C18 | H18 | 180.0° | 179.9° |
| C16 | C17 | C18 | H19 | 179.8° | 179.9° |
| C18 | C17 | C16 | H17 | 179.9° | 180.0° |
| C17 | C18 | C19 | H20 | 179.7° | 180.0° |
| H1 | N | CA | H4 | 62.0° | 180.0° |
| H2 | N | CA | H4 | 178.0° | 56.1° |
| H4 | CA | CB | H5 | 72.4° | 175.0° |
| H4 | CA | CB | H6 | 168.9° | 65.0° |
| H5 | CB | CG | H7 | 170.4° | 65.0° |
| H6 | CB | CG | H7 | 70.9° | 175.0° |
| H7 | CG | CD1 | H8 | 61.6° | 180.0° |
| H7 | CG | CD1 | H9 | 58.4° | 60.0° |
| H7 | CG | CD1 | H10 | 178.4° | 60.1° |
| H7 | CG | CD2 | H11 | 62.0° | 60.0° |
| H7 | CG | CD2 | H12 | 58.0° | 60.0° |
| H7 | CG | CD2 | H13 | 178.0° | 179.9° |
| H8 | CD1 | H9 | H10 | 120.0° | 120.0° |
| H11 | CD2 | H12 | H13 | 120.0° | 120.0° |
| H14 | C1 | C2 | H21 | 58.3° | 62.6° |
| H15 | C1 | C2 | H21 | 177.5° | 57.5° |
| H17 | C16 | C17 | H18 | 0.1° | 0.1° |
| H18 | C17 | C18 | H19 | 0.2° | 0.0° |
| H19 | C18 | C19 | H20 | 0.3° | 0.1° |
| H20 | C19 | C20 | H22 | 0.2° | 0.0° |
| H21 | C2 | C3 | H23 | 171.0° | 63.2° |
| H21 | C2 | C7 | H28 | 51.2° | 175.2° |
| H21 | C2 | C7 | H29 | 168.8° | 64.8° |
| H23 | C3 | C4 | H24 | 45.8° | 57.0° |
| H23 | C3 | O3 | H35 | 62.3° | 59.8° |
| H24 | C4 | C5 | H25 | 77.9° | 177.7° |
| H24 | C4 | O4 | H36 | 61.9° | 60.0° |
| H25 | C5 | C6 | H26 | 71.0° | 65.1° |
| H25 | C5 | C6 | H27 | 48.8° | 175.0° |
| H28 | C7 | C8 | H30 | 128.2° | 179.9° |
| H28 | C7 | C8 | H31 | 113.9° | 60.0° |
| H29 | C7 | C8 | H30 | 10.5° | 60.0° |
| H29 | C7 | C8 | H31 | 128.4° | 180.0° |
| H30 | C8 | C9 | H32 | 53.4° | 179.9° |
| H30 | C8 | C9 | H33 | 172.0° | 60.0° |
| H31 | C8 | C9 | H32 | 64.6° | 60.0° |
| H31 | C8 | C9 | H33 | 54.0° | 180.0° |
