UEM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C | doub | 1.21Å | 1.25Å | |
| OXT | C | sing | 1.34Å | 1.25Å | |
| C | CA | sing | 1.51Å | 1.53Å | |
| CA | N | sing | 1.47Å | 1.49Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CB | C38 | sing | 1.53Å | 1.52Å | |
| O33 | C32 | sing | 1.43Å | 1.42Å | |
| C38 | S37 | sing | 1.81Å | 1.81Å | |
| O31 | C30 | sing | 1.43Å | 1.42Å | |
| C10 | N11 | doub | 1.31Å | 1.33Å | Aromatic |
| C10 | N9 | sing | 1.32Å | 1.33Å | Aromatic |
| N11 | C12 | sing | 1.33Å | 1.34Å | Aromatic |
| C32 | C34 | sing | 1.55Å | 1.53Å | |
| C32 | C30 | sing | 1.54Å | 1.54Å | |
| C34 | O35 | sing | 1.44Å | 1.45Å | |
| C34 | C36 | sing | 1.53Å | 1.52Å | |
| C30 | C29 | sing | 1.55Å | 1.52Å | |
| S37 | C36 | sing | 1.81Å | 1.81Å | |
| C29 | O35 | sing | 1.44Å | 1.41Å | |
| C29 | N28 | sing | 1.46Å | 1.46Å | |
| N9 | C8 | doub | 1.33Å | 1.35Å | Aromatic |
| C12 | N28 | sing | 1.37Å | 1.38Å | Aromatic |
| C12 | C13 | doub | 1.40Å | 1.41Å | Aromatic |
| N28 | C27 | sing | 1.37Å | 1.38Å | Aromatic |
| C8 | C13 | sing | 1.40Å | 1.42Å | Aromatic |
| C8 | N7 | sing | 1.38Å | 1.34Å | |
| C13 | C14 | sing | 1.47Å | 1.44Å | Aromatic |
| C27 | C14 | doub | 1.36Å | 1.37Å | Aromatic |
| C14 | C15 | sing | 1.43Å | 1.43Å | |
| C15 | C16 | trip | 1.17Å | 1.20Å | |
| C16 | C17 | sing | 1.43Å | 1.44Å | |
| C23 | C24 | doub | 1.36Å | 1.37Å | Aromatic |
| C23 | C22 | sing | 1.40Å | 1.42Å | Aromatic |
| C24 | C25 | sing | 1.39Å | 1.38Å | Aromatic |
| C17 | C22 | doub | 1.46Å | 1.43Å | Aromatic |
| C17 | C18 | sing | 1.39Å | 1.38Å | Aromatic |
| C22 | C21 | sing | 1.42Å | 1.42Å | Aromatic |
| C18 | C19 | doub | 1.39Å | 1.38Å | Aromatic |
| C25 | C26 | doub | 1.36Å | 1.37Å | Aromatic |
| C21 | C26 | sing | 1.41Å | 1.42Å | Aromatic |
| C21 | C20 | doub | 1.41Å | 1.42Å | Aromatic |
| C19 | C20 | sing | 1.36Å | 1.37Å | 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 | |
| OXT | H7 | sing | 0.97Å | 0.95Å | |
| C10 | H8 | sing | 1.08Å | 1.08Å | |
| C18 | H9 | sing | 1.08Å | 1.08Å | |
| C19 | H10 | sing | 1.08Å | 1.08Å | |
| C20 | H11 | sing | 1.08Å | 1.08Å | |
| C23 | H12 | sing | 1.08Å | 1.08Å | |
| C24 | H13 | sing | 1.08Å | 1.08Å | |
| C25 | H14 | sing | 1.08Å | 1.08Å | |
| C26 | H15 | sing | 1.08Å | 1.08Å | |
| C27 | H16 | sing | 1.08Å | 1.08Å | |
| C29 | H17 | sing | 1.09Å | 1.10Å | |
| C30 | H18 | sing | 1.09Å | 1.10Å | |
| C32 | H19 | sing | 1.09Å | 1.10Å | |
| C34 | H20 | sing | 1.09Å | 1.10Å | |
| C36 | H21 | sing | 1.09Å | 1.10Å | |
| C36 | H22 | sing | 1.09Å | 1.10Å | |
| C38 | H23 | sing | 1.09Å | 1.10Å | |
| C38 | H24 | sing | 1.09Å | 1.10Å | |
| N7 | H25 | sing | 0.97Å | 1.00Å | |
| N7 | H26 | sing | 0.97Å | 1.00Å | |
| O31 | H27 | sing | 0.97Å | 0.95Å | |
| O33 | H28 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | OXT | 126.0° | 120.0° |
| O | C | CA | 117.4° | 120.0° |
| OXT | C | CA | 116.7° | 120.0° |
| C | OXT | H7 | 109.5° | 116.9° |
| C | CA | N | 109.5° | 109.5° |
| C | CA | CB | 110.8° | 109.5° |
| C | CA | H4 | 108.4° | 109.5° |
| N | CA | CB | 110.7° | 109.4° |
| CA | N | H1 | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | H4 | 109.0° | 109.5° |
| CA | CB | C38 | 113.9° | 109.5° |
| CB | CA | H4 | 108.4° | 109.5° |
| CA | CB | H5 | 108.4° | 109.5° |
| CA | CB | H6 | 108.3° | 109.4° |
| CB | C38 | S37 | 115.3° | 109.5° |
| C38 | CB | H5 | 108.3° | 109.5° |
| C38 | CB | H6 | 108.3° | 109.5° |
| CB | C38 | H23 | 108.0° | 109.6° |
| CB | C38 | H24 | 108.0° | 109.5° |
| O33 | C32 | C34 | 111.0° | 110.5° |
| O33 | C32 | C30 | 111.8° | 110.6° |
| O33 | C32 | H19 | 111.0° | 110.6° |
| C32 | O33 | H28 | 109.5° | 114.0° |
| C38 | S37 | C36 | 102.1° | 103.0° |
| S37 | C38 | H23 | 108.0° | 109.5° |
| S37 | C38 | H24 | 108.0° | 109.4° |
| O31 | C30 | C32 | 111.4° | 110.6° |
| O31 | C30 | C29 | 110.5° | 110.5° |
| O31 | C30 | H18 | 112.1° | 110.5° |
| C30 | O31 | H27 | 109.5° | 114.0° |
| N11 | C10 | N9 | 128.7° | 122.7° |
| C10 | N11 | C12 | 112.2° | 120.7° |
| N11 | C10 | H8 | 115.6° | 118.6° |
| C10 | N9 | C8 | 118.7° | 120.9° |
| N9 | C10 | H8 | 115.6° | 118.6° |
| N11 | C12 | N28 | 125.6° | 134.0° |
| N11 | C12 | C13 | 125.8° | 118.5° |
| C34 | C32 | C30 | 103.8° | 104.0° |
| C32 | C34 | O35 | 106.9° | 104.8° |
| C32 | C34 | C36 | 119.2° | 110.4° |
| C34 | C32 | H19 | 109.5° | 110.5° |
| C32 | C34 | H20 | 106.1° | 110.3° |
| C32 | C30 | C29 | 101.3° | 104.1° |
| C32 | C30 | H18 | 110.4° | 110.5° |
| C30 | C32 | H19 | 109.5° | 110.5° |
| O35 | C34 | C36 | 110.4° | 110.4° |
| C34 | O35 | C29 | 107.2° | 105.3° |
| O35 | C34 | H20 | 107.2° | 110.4° |
| C34 | C36 | S37 | 119.7° | 109.5° |
| C36 | C34 | H20 | 106.3° | 110.4° |
| C34 | C36 | H21 | 106.9° | 109.5° |
| C34 | C36 | H22 | 106.9° | 109.5° |
| C30 | C29 | O35 | 105.0° | 104.8° |
| C30 | C29 | N28 | 115.3° | 110.4° |
| C30 | C29 | H17 | 108.4° | 110.4° |
| C29 | C30 | H18 | 110.7° | 110.5° |
| S37 | C36 | H21 | 106.8° | 109.4° |
| S37 | C36 | H22 | 106.8° | 109.5° |
| O35 | C29 | N28 | 109.0° | 110.4° |
| O35 | C29 | H17 | 109.9° | 110.4° |
| C29 | N28 | C12 | 125.1° | 124.8° |
| C29 | N28 | C27 | 126.6° | 124.8° |
| N28 | C29 | H17 | 109.2° | 110.3° |
| N9 | C8 | C13 | 118.5° | 118.3° |
| N9 | C8 | N7 | 118.0° | 120.9° |
| N28 | C12 | C13 | 108.6° | 107.5° |
| C12 | N28 | C27 | 108.3° | 110.4° |
| C12 | C13 | C8 | 116.1° | 118.8° |
| C12 | C13 | C14 | 106.3° | 106.2° |
| N28 | C27 | C14 | 110.1° | 109.6° |
| N28 | C27 | H16 | 125.0° | 125.3° |
| C13 | C8 | N7 | 123.5° | 120.8° |
| C8 | C13 | C14 | 137.6° | 135.0° |
| C8 | N7 | H25 | 109.5° | 120.1° |
| C8 | N7 | H26 | 109.4° | 120.0° |
| C13 | C14 | C27 | 106.7° | 106.3° |
| C13 | C14 | C15 | 124.2° | 126.8° |
| C27 | C14 | C15 | 129.0° | 126.9° |
| C14 | C27 | H16 | 125.0° | 125.2° |
| C14 | C15 | C16 | 174.7° | 179.9° |
| C15 | C16 | C17 | 172.7° | 179.9° |
| C16 | C17 | C22 | 120.0° | 120.7° |
| C16 | C17 | C18 | 119.9° | 120.7° |
| C24 | C23 | C22 | 120.9° | 119.6° |
| C23 | C24 | C25 | 120.7° | 120.9° |
| C24 | C23 | H12 | 119.6° | 120.2° |
| C23 | C24 | H13 | 119.7° | 119.5° |
| C23 | C22 | C17 | 123.1° | 121.6° |
| C23 | C22 | C21 | 118.4° | 119.6° |
| C22 | C23 | H12 | 119.5° | 120.1° |
| C24 | C25 | C26 | 120.6° | 121.0° |
| C25 | C24 | H13 | 119.7° | 119.6° |
| C24 | C25 | H14 | 119.7° | 119.5° |
| C22 | C17 | C18 | 120.0° | 118.6° |
| C17 | C22 | C21 | 118.6° | 118.8° |
| C17 | C18 | C19 | 120.9° | 120.6° |
| C17 | C18 | H9 | 119.6° | 119.7° |
| C22 | C21 | C26 | 118.7° | 119.2° |
| C22 | C21 | C20 | 118.9° | 119.5° |
| C18 | C19 | C20 | 120.9° | 121.9° |
| C19 | C18 | H9 | 119.5° | 119.7° |
| C18 | C19 | H10 | 119.5° | 119.1° |
| C25 | C26 | C21 | 120.8° | 119.6° |
| C26 | C25 | H14 | 119.7° | 119.5° |
| C25 | C26 | H15 | 119.6° | 120.2° |
| C26 | C21 | C20 | 122.4° | 121.3° |
| C21 | C26 | H15 | 119.6° | 120.2° |
| C21 | C20 | C19 | 120.7° | 120.7° |
| C21 | C20 | H11 | 119.6° | 119.6° |
| C20 | C19 | H10 | 119.5° | 119.1° |
| C19 | C20 | H11 | 119.7° | 119.7° |
| H1 | N | H2 | 109.4° | 111.0° |
| H5 | CB | H6 | 109.5° | 109.5° |
| H21 | C36 | H22 | 109.5° | 109.5° |
| H23 | C38 | H24 | 109.4° | 109.4° |
| H25 | N7 | H26 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | OXT | CA | 179.6° | 180.0° |
| O | C | CA | N | 34.8° | 20.0° |
| O | C | CA | CB | 157.3° | 100.0° |
| O | C | CA | H4 | 83.9° | 140.0° |
| O | C | OXT | H7 | 0.0° | 0.0° |
| OXT | C | CA | N | 144.8° | 160.0° |
| OXT | C | CA | CB | 22.4° | 80.1° |
| OXT | C | CA | H4 | 96.5° | 40.0° |
| C | CA | N | CB | 122.5° | 120.0° |
| C | CA | N | H4 | 118.4° | 120.0° |
| C | CA | CB | H4 | 118.8° | 120.1° |
| C | CA | CB | C38 | 178.4° | 175.0° |
| C | CA | N | H1 | 180.0° | 60.0° |
| C | CA | N | H2 | 60.0° | 176.1° |
| C | CA | CB | H5 | 60.9° | 65.0° |
| C | CA | CB | H6 | 57.8° | 55.0° |
| CA | C | OXT | H7 | 179.6° | 180.0° |
| N | CA | CB | H4 | 119.5° | 120.0° |
| N | CA | CB | C38 | 59.9° | 65.1° |
| CA | N | H1 | H2 | 120.0° | 123.9° |
| N | CA | CB | H5 | 60.8° | 55.0° |
| N | CA | CB | H6 | 179.5° | 175.0° |
| CA | CB | C38 | H5 | 120.7° | 120.0° |
| CA | CB | C38 | H6 | 120.6° | 119.9° |
| CA | CB | C38 | S37 | 174.0° | 180.0° |
| CB | CA | N | H1 | 57.5° | 60.0° |
| CB | CA | N | H2 | 177.5° | 64.0° |
| CA | CB | H5 | H6 | 118.0° | 119.9° |
| CA | CB | C38 | H23 | 53.2° | 59.9° |
| CA | CB | C38 | H24 | 65.1° | 60.1° |
| CB | C38 | S37 | H23 | 120.8° | 120.1° |
| CB | C38 | S37 | H24 | 120.9° | 120.0° |
| CB | C38 | S37 | C36 | 156.6° | 180.0° |
| C38 | CB | CA | H4 | 59.6° | 54.9° |
| C38 | CB | H5 | H6 | 118.0° | 120.0° |
| CB | C38 | H23 | H24 | 117.3° | 120.0° |
| O33 | C32 | C30 | O31 | 23.9° | 0.1° |
| O33 | C32 | C34 | C30 | 120.3° | 118.7° |
| O33 | C32 | C34 | H19 | 122.9° | 122.7° |
| O33 | C32 | C30 | H19 | 123.5° | 122.8° |
| O33 | C32 | C34 | O35 | 115.1° | 142.7° |
| O33 | C32 | C34 | C36 | 118.8° | 98.5° |
| O33 | C32 | C30 | C29 | 93.6° | 118.6° |
| O33 | C32 | C30 | H18 | 149.1° | 122.8° |
| O33 | C32 | C34 | H20 | 1.0° | 23.8° |
| C38 | S37 | C36 | C34 | 57.1° | 180.0° |
| S37 | C38 | CB | H5 | 65.3° | 60.0° |
| S37 | C38 | CB | H6 | 53.4° | 60.0° |
| C38 | S37 | C36 | H21 | 178.5° | 60.0° |
| C38 | S37 | C36 | H22 | 64.4° | 60.0° |
| S37 | C38 | H23 | H24 | 117.4° | 119.9° |
| O31 | C30 | C32 | C34 | 143.6° | 118.7° |
| O31 | C30 | C32 | C29 | 117.5° | 118.7° |
| O31 | C30 | C32 | H18 | 125.2° | 122.7° |
| O31 | C30 | C29 | H18 | 124.7° | 122.6° |
| O31 | C30 | C29 | O35 | 157.7° | 142.8° |
| O31 | C30 | C29 | N28 | 82.4° | 98.4° |
| O31 | C30 | C29 | H17 | 40.3° | 23.9° |
| O31 | C30 | C32 | H19 | 99.6° | 122.7° |
| N11 | C10 | N9 | H8 | 180.0° | 179.8° |
| N11 | C10 | N9 | C8 | 0.0° | 0.1° |
| C10 | N11 | C12 | N28 | 179.6° | 180.0° |
| C10 | N11 | C12 | C13 | 0.1° | 0.0° |
| N9 | C10 | N11 | C12 | 0.1° | 0.1° |
| C10 | N9 | C8 | C13 | 0.1° | 0.0° |
| C10 | N9 | C8 | N7 | 179.4° | 180.0° |
| N11 | C12 | N28 | C29 | 1.1° | 0.0° |
| N11 | C12 | N28 | C13 | 179.8° | 180.0° |
| N11 | C12 | N28 | C27 | 180.0° | 180.0° |
| N11 | C12 | C13 | C8 | 0.1° | 0.0° |
| N11 | C12 | C13 | C14 | 179.9° | 180.0° |
| C12 | N11 | C10 | H8 | 179.9° | 179.7° |
| C34 | C32 | C30 | H19 | 116.8° | 118.6° |
| C32 | C34 | O35 | C36 | 131.2° | 118.8° |
| C32 | C34 | O35 | H20 | 113.5° | 118.8° |
| C32 | C34 | C36 | H20 | 119.7° | 122.2° |
| C34 | C32 | C30 | C29 | 26.1° | 0.0° |
| C32 | C34 | C36 | S37 | 85.8° | 175.0° |
| C32 | C34 | O35 | C29 | 20.2° | 40.5° |
| C34 | C32 | C30 | H18 | 91.2° | 118.6° |
| C32 | C34 | C36 | H21 | 35.6° | 55.0° |
| C32 | C34 | C36 | H22 | 152.7° | 65.0° |
| C34 | C32 | O33 | H28 | 180.0° | 179.9° |
| C30 | C32 | C34 | O35 | 5.1° | 24.0° |
| C30 | C32 | C34 | C36 | 120.9° | 142.8° |
| C32 | C30 | C29 | H18 | 117.1° | 118.6° |
| C32 | C30 | C29 | O35 | 39.5° | 24.0° |
| C32 | C30 | C29 | N28 | 159.4° | 142.8° |
| C32 | C30 | C29 | H17 | 77.9° | 94.9° |
| C30 | C32 | C34 | H20 | 119.3° | 94.9° |
| C32 | C30 | O31 | H27 | 180.0° | 65.3° |
| C30 | C32 | O33 | H28 | 64.7° | 65.3° |
| O35 | C34 | C36 | H20 | 115.9° | 122.4° |
| C34 | O35 | C29 | C30 | 37.8° | 40.5° |
| O35 | C34 | C36 | S37 | 149.8° | 69.6° |
| C34 | O35 | C29 | N28 | 161.8° | 159.4° |
| C34 | O35 | C29 | H17 | 78.6° | 78.4° |
| O35 | C34 | C32 | H19 | 121.9° | 94.6° |
| O35 | C34 | C36 | H21 | 88.7° | 170.4° |
| O35 | C34 | C36 | H22 | 28.4° | 50.4° |
| C34 | C36 | S37 | H21 | 121.4° | 120.0° |
| C34 | C36 | S37 | H22 | 121.4° | 120.0° |
| C36 | C34 | O35 | C29 | 151.3° | 159.3° |
| C36 | C34 | C32 | H19 | 4.1° | 24.2° |
| C34 | C36 | H21 | H22 | 115.4° | 120.0° |
| C30 | C29 | O35 | N28 | 124.0° | 118.8° |
| C30 | C29 | O35 | H17 | 116.4° | 118.9° |
| C30 | C29 | N28 | H17 | 122.3° | 122.3° |
| C30 | C29 | N28 | C12 | 125.4° | 88.1° |
| C30 | C29 | N28 | C27 | 56.0° | 91.8° |
| C29 | C30 | C32 | H19 | 142.9° | 118.6° |
| C29 | C30 | O31 | H27 | 68.2° | 180.0° |
| S37 | C36 | C34 | H20 | 33.9° | 52.7° |
| S37 | C36 | H21 | H22 | 115.3° | 120.0° |
| C36 | S37 | C38 | H23 | 35.7° | 59.9° |
| C36 | S37 | C38 | H24 | 82.6° | 60.0° |
| O35 | C29 | N28 | H17 | 120.1° | 122.3° |
| O35 | C29 | N28 | C12 | 117.0° | 156.5° |
| O35 | C29 | N28 | C27 | 61.7° | 23.6° |
| O35 | C29 | C30 | H18 | 77.6° | 94.7° |
| C29 | O35 | C34 | H20 | 93.3° | 78.3° |
| C29 | N28 | C12 | C27 | 178.9° | 180.0° |
| C29 | N28 | C12 | C13 | 178.7° | 180.0° |
| C29 | N28 | C27 | C14 | 178.7° | 180.0° |
| C29 | N28 | C27 | H16 | 1.3° | 0.0° |
| N28 | C29 | C30 | H18 | 42.3° | 24.2° |
| N9 | C8 | C13 | C12 | 0.0° | 0.0° |
| N9 | C8 | C13 | N7 | 179.4° | 180.0° |
| N9 | C8 | C13 | C14 | 179.7° | 180.0° |
| C8 | N9 | C10 | H8 | 180.0° | 179.7° |
| N9 | C8 | N7 | H25 | 0.0° | 179.9° |
| N9 | C8 | N7 | H26 | 120.0° | 0.0° |
| N28 | C12 | C13 | C8 | 179.7° | 180.0° |
| N28 | C12 | C13 | C14 | 0.1° | 0.0° |
| C12 | N28 | C27 | C14 | 0.2° | 0.0° |
| C12 | N28 | C27 | H16 | 179.8° | 180.0° |
| C12 | N28 | C29 | H17 | 3.1° | 34.2° |
| C13 | C12 | N28 | C27 | 0.2° | 0.0° |
| C12 | C13 | C8 | C14 | 179.7° | 180.0° |
| C12 | C13 | C8 | N7 | 179.5° | 180.0° |
| C12 | C13 | C14 | C27 | 0.0° | 0.0° |
| C12 | C13 | C14 | C15 | 179.2° | 180.0° |
| N28 | C27 | C14 | C13 | 0.1° | 0.0° |
| N28 | C27 | C14 | H16 | 180.0° | 180.0° |
| N28 | C27 | C14 | C15 | 179.0° | 180.0° |
| C27 | N28 | C29 | H17 | 178.3° | 145.8° |
| C8 | C13 | C14 | C27 | 179.7° | 180.0° |
| C8 | C13 | C14 | C15 | 0.6° | 0.0° |
| C13 | C8 | N7 | H25 | 179.4° | 0.1° |
| C13 | C8 | N7 | H26 | 60.5° | 180.0° |
| N7 | C8 | C13 | C14 | 0.8° | 0.0° |
| C8 | N7 | H25 | H26 | 120.0° | 180.0° |
| C13 | C14 | C27 | C15 | 179.1° | 180.0° |
| C13 | C14 | C15 | C16 | 10.7° | 148.1° |
| C13 | C14 | C27 | H16 | 179.9° | 180.0° |
| C27 | C14 | C15 | C16 | 168.3° | 32.0° |
| C14 | C15 | C16 | C17 | 5.1° | 180.0° |
| C15 | C14 | C27 | H16 | 1.0° | 0.0° |
| C15 | C16 | C17 | C22 | 90.4° | 148.1° |
| C15 | C16 | C17 | C18 | 87.1° | 32.3° |
| C16 | C17 | C22 | C23 | 2.5° | 0.3° |
| C16 | C17 | C22 | C18 | 177.5° | 179.7° |
| C16 | C17 | C22 | C21 | 177.5° | 179.7° |
| C16 | C17 | C18 | C19 | 177.4° | 179.7° |
| C16 | C17 | C18 | H9 | 2.6° | 0.3° |
| C24 | C23 | C22 | H12 | 180.0° | 179.9° |
| C23 | C24 | C25 | H13 | 180.0° | 179.9° |
| C24 | C23 | C22 | C17 | 180.0° | 179.9° |
| C24 | C23 | C22 | C21 | 0.0° | 0.0° |
| C23 | C24 | C25 | C26 | 0.0° | 0.0° |
| C23 | C24 | C25 | H14 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.0° | 0.0° |
| C23 | C22 | C17 | C21 | 180.0° | 180.0° |
| C23 | C22 | C17 | C18 | 180.0° | 180.0° |
| C23 | C22 | C21 | C26 | 0.0° | 0.0° |
| C23 | C22 | C21 | C20 | 180.0° | 180.0° |
| C22 | C23 | C24 | H13 | 180.0° | 180.0° |
| C24 | C25 | C26 | H14 | 180.0° | 180.0° |
| C24 | C25 | C26 | C21 | 0.0° | 0.1° |
| C25 | C24 | C23 | H12 | 180.0° | 180.0° |
| C24 | C25 | C26 | H15 | 180.0° | 179.9° |
| C22 | C17 | C18 | C19 | 0.0° | 0.1° |
| C17 | C22 | C21 | C26 | 180.0° | 180.0° |
| C17 | C22 | C21 | C20 | 0.0° | 0.0° |
| C22 | C17 | C18 | H9 | 180.0° | 180.0° |
| C17 | C22 | C23 | H12 | 0.0° | 0.0° |
| C18 | C17 | C22 | C21 | 0.0° | 0.0° |
| C17 | C18 | C19 | H9 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.1° | 0.0° |
| C17 | C18 | C19 | H10 | 179.9° | 180.0° |
| C22 | C21 | C26 | C25 | 0.0° | 0.1° |
| C22 | C21 | C26 | C20 | 180.0° | 180.0° |
| C22 | C21 | C20 | C19 | 0.1° | 0.0° |
| C22 | C21 | C20 | H11 | 179.9° | 179.9° |
| C21 | C22 | C23 | H12 | 180.0° | 180.0° |
| C22 | C21 | C26 | H15 | 180.0° | 179.9° |
| C18 | C19 | C20 | C21 | 0.1° | 0.0° |
| C18 | C19 | C20 | H10 | 180.0° | 179.9° |
| C18 | C19 | C20 | H11 | 179.9° | 179.9° |
| C25 | C26 | C21 | H15 | 180.0° | 179.8° |
| C25 | C26 | C21 | C20 | 180.0° | 179.9° |
| C26 | C25 | C24 | H13 | 179.9° | 179.9° |
| C26 | C21 | C20 | C19 | 179.9° | 180.0° |
| C26 | C21 | C20 | H11 | 0.1° | 0.1° |
| C21 | C26 | C25 | H14 | 180.0° | 180.0° |
| C21 | C20 | C19 | H11 | 180.0° | 179.9° |
| C21 | C20 | C19 | H10 | 179.8° | 180.0° |
| C20 | C21 | C26 | H15 | 0.0° | 0.1° |
| C20 | C19 | C18 | H9 | 179.9° | 180.0° |
| H1 | N | CA | H4 | 61.6° | 180.0° |
| H2 | N | CA | H4 | 58.3° | 56.0° |
| H4 | CA | CB | H5 | 179.7° | 175.0° |
| H4 | CA | CB | H6 | 61.0° | 65.0° |
| H5 | CB | C38 | H23 | 173.8° | 180.0° |
| H5 | CB | C38 | H24 | 55.6° | 59.9° |
| H6 | CB | C38 | H23 | 67.5° | 60.0° |
| H6 | CB | C38 | H24 | 174.3° | NaN° |
| H9 | C18 | C19 | H10 | 0.1° | 0.1° |
| H10 | C19 | C20 | H11 | 0.1° | 0.1° |
| H12 | C23 | C24 | H13 | 0.0° | 0.1° |
| H13 | C24 | C25 | H14 | 0.1° | 0.0° |
| H14 | C25 | C26 | H15 | 0.0° | 0.1° |
| H17 | C29 | C30 | H18 | 165.0° | 146.5° |
| H18 | C30 | C32 | H19 | 25.6° | 0.0° |
| H18 | C30 | O31 | H27 | 55.7° | 57.4° |
| H19 | C32 | C34 | H20 | 123.9° | 146.5° |
| H19 | C32 | O33 | H28 | 57.9° | 57.4° |
| H20 | C34 | C36 | H21 | 155.3° | 67.2° |
| H20 | C34 | C36 | H22 | 87.5° | 172.7° |
