BVQ
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
P | O2 | sing | 1.61Å | 1.60Å | |
P | O3 | sing | 1.61Å | 1.58Å | |
P | O4 | doub | 1.48Å | 1.49Å | |
P | O5 | sing | 1.61Å | 1.52Å | |
CO | N21 | sing | 1.78Å | 1.88Å | |
CO | N22 | sing | 1.78Å | 1.92Å | |
CO | N23 | sing | 1.77Å | 1.92Å | |
CO | N24 | sing | 1.79Å | 1.89Å | |
C1 | C2 | sing | 1.54Å | 1.58Å | |
C1 | C19 | sing | 1.55Å | 1.55Å | |
C1 | C20 | sing | 1.53Å | 1.52Å | |
C1 | N21 | sing | 1.46Å | 1.46Å | |
C2 | C3 | sing | 1.57Å | 1.58Å | |
C2 | C25 | sing | 1.53Å | 1.54Å | |
C2 | C26 | sing | 1.53Å | 1.56Å | |
O2 | C3R | sing | 1.43Å | 1.41Å | |
C3 | C4 | sing | 1.49Å | 1.51Å | |
C3 | C30 | sing | 1.53Å | 1.54Å | |
O3 | C2P | sing | 1.43Å | 1.42Å | |
C4 | C5 | sing | 1.42Å | 1.50Å | |
C4 | N21 | doub | 1.31Å | 1.30Å | |
C5 | C6 | doub | 1.38Å | 1.38Å | |
C5 | C35 | sing | 1.51Å | 1.50Å | |
C6 | C7 | sing | 1.51Å | 1.53Å | |
C6 | N22 | sing | 1.35Å | 1.39Å | |
C7 | C8 | sing | 1.55Å | 1.55Å | |
C7 | C36 | sing | 1.53Å | 1.54Å | |
C7 | C37 | sing | 1.53Å | 1.54Å | |
C8 | C9 | sing | 1.51Å | 1.51Å | |
C8 | C41 | sing | 1.53Å | 1.54Å | |
C9 | C10 | sing | 1.42Å | 1.39Å | |
C9 | N22 | doub | 1.32Å | 1.35Å | |
C10 | C11 | doub | 1.36Å | 1.37Å | |
C11 | C12 | sing | 1.50Å | 1.51Å | |
C11 | N23 | sing | 1.37Å | 1.36Å | |
C12 | C13 | sing | 1.56Å | 1.57Å | |
C12 | C46 | sing | 1.53Å | 1.54Å | |
C12 | C47 | sing | 1.53Å | 1.54Å | |
C13 | C14 | sing | 1.51Å | 1.59Å | |
C13 | C48 | sing | 1.53Å | 1.55Å | |
C14 | C15 | doub | 1.36Å | 1.38Å | |
C14 | N23 | sing | 1.38Å | 1.41Å | |
C15 | C16 | sing | 1.42Å | 1.51Å | |
C15 | C53 | sing | 1.51Å | 1.50Å | |
C16 | C17 | sing | 1.50Å | 1.53Å | |
C16 | N24 | doub | 1.30Å | 1.32Å | |
C17 | C18 | sing | 1.57Å | 1.54Å | |
C17 | C54 | sing | 1.53Å | 1.54Å | |
C17 | C55 | sing | 1.53Å | 1.56Å | |
C18 | C19 | sing | 1.55Å | 1.54Å | |
C18 | C60 | sing | 1.53Å | 1.54Å | |
C19 | N24 | sing | 1.46Å | 1.49Å | |
N1B | C1R | sing | 1.47Å | 1.46Å | |
N1B | C2B | sing | 1.35Å | 1.32Å | Aromatic |
N1B | C8B | sing | 1.38Å | 1.38Å | Aromatic |
C1P | C2P | sing | 1.53Å | 1.54Å | |
C1P | N59 | sing | 1.47Å | 1.45Å | |
C1R | C2R | sing | 1.54Å | 1.53Å | |
C1R | O6R | sing | 1.44Å | 1.41Å | |
C26 | C27 | sing | 1.51Å | 1.54Å | |
C27 | O28 | doub | 1.21Å | 1.24Å | |
C27 | N29 | sing | 1.35Å | 1.32Å | |
C2B | N3B | doub | 1.30Å | 1.35Å | Aromatic |
C2R | C3R | sing | 1.55Å | 1.52Å | |
C2R | O7R | sing | 1.43Å | 1.42Å | |
C30 | C31 | sing | 1.53Å | 1.53Å | |
C31 | C32 | sing | 1.51Å | 1.51Å | |
C32 | N33 | sing | 1.35Å | 1.33Å | |
C32 | O34 | doub | 1.21Å | 1.23Å | |
C37 | C38 | sing | 1.51Å | 1.56Å | |
C38 | O39 | doub | 1.21Å | 1.23Å | |
C38 | N40 | sing | 1.35Å | 1.33Å | |
N3B | C9B | sing | 1.35Å | 1.37Å | Aromatic |
C3R | C4R | sing | 1.55Å | 1.53Å | |
C41 | C42 | sing | 1.53Å | 1.53Å | |
C42 | C43 | sing | 1.51Å | 1.51Å | |
C43 | O44 | doub | 1.21Å | 1.24Å | |
C43 | N45 | sing | 1.35Å | 1.32Å | |
C48 | C49 | sing | 1.53Å | 1.53Å | |
C49 | C50 | sing | 1.51Å | 1.52Å | |
N4B | C5B | doub | 1.31Å | 1.34Å | Aromatic |
N4B | C9B | sing | 1.34Å | 1.34Å | Aromatic |
C4R | C5R | sing | 1.53Å | 1.51Å | |
C4R | O6R | sing | 1.44Å | 1.45Å | |
C50 | O51 | doub | 1.21Å | 1.24Å | |
C50 | N52 | sing | 1.35Å | 1.32Å | |
C55 | C56 | sing | 1.53Å | 1.53Å | |
C56 | C57 | sing | 1.51Å | 1.51Å | |
C57 | O58 | doub | 1.21Å | 1.23Å | |
C57 | N59 | sing | 1.35Å | 1.33Å | |
C5B | N6B | sing | 1.32Å | 1.34Å | Aromatic |
C5R | O8R | sing | 1.43Å | 1.42Å | |
C60 | C61 | sing | 1.51Å | 1.51Å | |
C61 | N62 | sing | 1.35Å | 1.32Å | |
C61 | O63 | doub | 1.21Å | 1.24Å | |
N6B | C7B | doub | 1.33Å | 1.35Å | Aromatic |
N7A | C7B | sing | 1.38Å | 1.34Å | |
C7B | C8B | sing | 1.40Å | 1.41Å | Aromatic |
C8B | C9B | doub | 1.40Å | 1.39Å | Aromatic |
C3 | H3 | sing | 1.09Å | 1.10Å | |
C8 | H8 | sing | 1.09Å | 1.10Å | |
C13 | H13 | sing | 1.09Å | 1.10Å | |
C18 | H18 | sing | 1.09Å | 1.10Å | |
C19 | H19 | sing | 1.09Å | 1.10Å | |
C1P | H1P | sing | 1.09Å | 1.10Å | |
C1P | H1PA | sing | 1.09Å | 1.10Å | |
C1R | H1R | sing | 1.09Å | 1.10Å | |
C20 | H20 | sing | 1.09Å | 1.10Å | |
C20 | H20A | sing | 1.09Å | 1.10Å | |
C20 | H20B | sing | 1.09Å | 1.10Å | |
C25 | H25 | sing | 1.09Å | 1.10Å | |
C25 | H25A | sing | 1.09Å | 1.10Å | |
C25 | H25B | sing | 1.09Å | 1.10Å | |
C26 | H26 | sing | 1.09Å | 1.10Å | |
C26 | H26A | sing | 1.09Å | 1.10Å | |
N29 | HN29 | sing | 0.97Å | 1.00Å | |
N29 | HN2A | sing | 0.97Å | 1.00Å | |
C2B | H2B | sing | 1.08Å | 1.08Å | |
C2P | H2P | sing | 1.09Å | 1.10Å | |
C2P | H2PA | sing | 1.09Å | 1.10Å | |
C2R | H2R | sing | 1.09Å | 1.10Å | |
C30 | H30 | sing | 1.09Å | 1.10Å | |
C30 | H30A | sing | 1.09Å | 1.10Å | |
C31 | H31 | sing | 1.09Å | 1.10Å | |
C31 | H31A | sing | 1.09Å | 1.10Å | |
N33 | HN33 | sing | 0.97Å | 1.00Å | |
N33 | HN3A | sing | 0.97Å | 1.00Å | |
C35 | H35 | sing | 1.09Å | 1.10Å | |
C35 | H35A | sing | 1.09Å | 1.10Å | |
C35 | H35B | sing | 1.09Å | 1.10Å | |
C36 | H36 | sing | 1.09Å | 1.10Å | |
C36 | H36A | sing | 1.09Å | 1.10Å | |
C36 | H36B | sing | 1.09Å | 1.10Å | |
C37 | H37 | sing | 1.09Å | 1.10Å | |
C37 | H37A | sing | 1.09Å | 1.10Å | |
C3R | H3R | sing | 1.09Å | 1.10Å | |
N40 | HN40 | sing | 0.97Å | 1.00Å | |
N40 | HN4A | sing | 0.97Å | 1.00Å | |
C41 | H41 | sing | 1.09Å | 1.10Å | |
C41 | H41A | sing | 1.09Å | 1.10Å | |
C42 | H42 | sing | 1.09Å | 1.10Å | |
C42 | H42A | sing | 1.09Å | 1.10Å | |
N45 | HN45 | sing | 0.97Å | 1.00Å | |
N45 | HN4B | sing | 0.97Å | 1.00Å | |
C46 | H46 | sing | 1.09Å | 1.10Å | |
C46 | H46A | sing | 1.09Å | 1.10Å | |
C46 | H46B | sing | 1.09Å | 1.10Å | |
C47 | H47 | sing | 1.09Å | 1.10Å | |
C47 | H47A | sing | 1.09Å | 1.10Å | |
C47 | H47B | sing | 1.09Å | 1.10Å | |
C48 | H48 | sing | 1.09Å | 1.10Å | |
C48 | H48A | sing | 1.09Å | 1.10Å | |
C49 | H49 | sing | 1.09Å | 1.10Å | |
C49 | H49A | sing | 1.09Å | 1.10Å | |
C4R | H4R | sing | 1.09Å | 1.10Å | |
N52 | HN52 | sing | 0.97Å | 1.00Å | |
N52 | HN5A | sing | 0.97Å | 1.00Å | |
C53 | H53 | sing | 1.09Å | 1.10Å | |
C53 | H53A | sing | 1.09Å | 1.10Å | |
C53 | H53B | sing | 1.09Å | 1.10Å | |
C54 | H54 | sing | 1.09Å | 1.10Å | |
C54 | H54A | sing | 1.09Å | 1.10Å | |
C54 | H54B | sing | 1.09Å | 1.10Å | |
C55 | H55 | sing | 1.09Å | 1.10Å | |
C55 | H55A | sing | 1.09Å | 1.10Å | |
C56 | H56 | sing | 1.09Å | 1.10Å | |
C56 | H56A | sing | 1.09Å | 1.10Å | |
N59 | HN59 | sing | 0.97Å | 1.00Å | |
C5B | H5B | sing | 1.08Å | 1.08Å | |
C5R | H5R | sing | 1.09Å | 1.10Å | |
C5R | H5RA | sing | 1.09Å | 1.10Å | |
C60 | H60 | sing | 1.09Å | 1.10Å | |
C60 | H60A | sing | 1.09Å | 1.10Å | |
N62 | HN62 | sing | 0.97Å | 1.00Å | |
N62 | HN6A | sing | 0.97Å | 1.00Å | |
N7A | HN7A | sing | 0.97Å | 1.00Å | |
N7A | HN7B | sing | 0.97Å | 1.00Å | |
O7R | HO7R | sing | 0.97Å | 0.95Å | |
O8R | HO8R | sing | 0.97Å | 0.95Å | |
O5 | H5 | sing | 0.97Å | 0.95Å | |
C10 | H10 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O2 | P | O3 | 101.9° | 109.5° |
O2 | P | O4 | 111.1° | 109.5° |
O2 | P | O5 | 108.4° | 109.5° |
P | O2 | C3R | 123.9° | 123.0° |
O3 | P | O4 | 112.6° | 109.5° |
O3 | P | O5 | 103.7° | 109.5° |
P | O3 | C2P | 120.5° | 123.0° |
O4 | P | O5 | 117.8° | 109.5° |
P | O5 | H5 | 109.5° | 114.0° |
N21 | CO | N22 | 88.4° | 98.6° |
N21 | CO | N23 | 163.2° | 136.1° |
N21 | CO | N24 | 84.1° | 95.0° |
CO | N21 | C1 | 116.0° | 106.6° |
CO | N21 | C4 | 131.3° | 131.5° |
N22 | CO | N23 | 96.2° | 103.0° |
N22 | CO | N24 | 172.0° | 132.2° |
CO | N22 | C6 | 128.3° | 120.3° |
CO | N22 | C9 | 121.2° | 121.0° |
N23 | CO | N24 | 90.3° | 97.9° |
CO | N23 | C11 | 124.2° | 121.5° |
CO | N23 | C14 | 125.7° | 122.0° |
CO | N24 | C16 | 136.1° | 130.7° |
CO | N24 | C19 | 113.8° | 106.1° |
C2 | C1 | C19 | 117.7° | 114.3° |
C2 | C1 | C20 | 114.9° | 111.3° |
C2 | C1 | N21 | 103.4° | 101.7° |
C1 | C2 | C3 | 101.5° | 101.8° |
C1 | C2 | C25 | 112.7° | 110.9° |
C1 | C2 | C26 | 107.9° | 111.0° |
C19 | C1 | C20 | 107.1° | 111.2° |
C19 | C1 | N21 | 104.7° | 106.0° |
C1 | C19 | C18 | 120.5° | 112.9° |
C1 | C19 | N24 | 105.2° | 107.0° |
C1 | C19 | H19 | 108.8° | 111.3° |
C20 | C1 | N21 | 108.1° | 111.9° |
C1 | C20 | H20 | 109.5° | 109.5° |
C1 | C20 | H20A | 109.5° | 109.5° |
C1 | C20 | H20B | 109.5° | 109.5° |
C1 | N21 | C4 | 112.6° | 116.4° |
C3 | C2 | C25 | 114.5° | 111.0° |
C3 | C2 | C26 | 107.3° | 110.9° |
C2 | C3 | C4 | 101.6° | 101.9° |
C2 | C3 | C30 | 113.5° | 110.9° |
C2 | C3 | H3 | 108.5° | 111.0° |
C25 | C2 | C26 | 112.2° | 110.9° |
C2 | C25 | H25 | 109.5° | 109.5° |
C2 | C25 | H25A | 109.5° | 109.4° |
C2 | C25 | H25B | 109.5° | 109.5° |
C2 | C26 | C27 | 116.7° | 109.4° |
C2 | C26 | H26 | 107.6° | 109.4° |
C2 | C26 | H26A | 107.6° | 109.5° |
O2 | C3R | C2R | 112.8° | 110.9° |
O2 | C3R | C4R | 109.6° | 110.9° |
O2 | C3R | H3R | 111.5° | 110.8° |
C4 | C3 | C30 | 114.6° | 111.0° |
C3 | C4 | C5 | 124.3° | 136.1° |
C3 | C4 | N21 | 112.6° | 105.6° |
C4 | C3 | H3 | 109.4° | 111.0° |
C3 | C30 | C31 | 113.5° | 109.5° |
C30 | C3 | H3 | 109.0° | 110.8° |
C3 | C30 | H30 | 108.5° | 109.5° |
C3 | C30 | H30A | 108.4° | 109.5° |
O3 | C2P | C1P | 109.9° | 109.5° |
O3 | C2P | H2P | 109.4° | 109.5° |
O3 | C2P | H2PA | 109.4° | 109.5° |
C5 | C4 | N21 | 123.0° | 116.2° |
C4 | C5 | C6 | 121.8° | 125.6° |
C4 | C5 | C35 | 111.9° | 117.2° |
C6 | C5 | C35 | 126.3° | 117.2° |
C5 | C6 | C7 | 130.4° | 128.3° |
C5 | C6 | N22 | 120.2° | 126.4° |
C5 | C35 | H35 | 109.5° | 109.5° |
C5 | C35 | H35A | 109.5° | 109.4° |
C5 | C35 | H35B | 109.5° | 109.5° |
C7 | C6 | N22 | 109.1° | 104.8° |
C6 | C7 | C8 | 99.4° | 103.1° |
C6 | C7 | C36 | 118.1° | 110.7° |
C6 | C7 | C37 | 111.5° | 110.7° |
C6 | N22 | C9 | 108.6° | 114.2° |
C8 | C7 | C36 | 107.9° | 110.7° |
C8 | C7 | C37 | 108.5° | 110.7° |
C7 | C8 | C9 | 99.8° | 103.3° |
C7 | C8 | C41 | 109.9° | 110.6° |
C7 | C8 | H8 | 112.8° | 110.7° |
C36 | C7 | C37 | 110.5° | 110.8° |
C7 | C36 | H36 | 109.5° | 109.5° |
C7 | C36 | H36A | 109.5° | 109.5° |
C7 | C36 | H36B | 109.5° | 109.5° |
C7 | C37 | C38 | 112.4° | 109.5° |
C7 | C37 | H37 | 108.7° | 109.4° |
C7 | C37 | H37A | 108.7° | 109.5° |
C9 | C8 | C41 | 107.1° | 110.7° |
C8 | C9 | C10 | 120.8° | 129.7° |
C8 | C9 | N22 | 109.9° | 105.9° |
C9 | C8 | H8 | 113.4° | 110.7° |
C8 | C41 | C42 | 114.9° | 109.5° |
C41 | C8 | H8 | 113.0° | 110.7° |
C8 | C41 | H41 | 108.1° | 109.5° |
C8 | C41 | H41A | 108.1° | 109.5° |
C10 | C9 | N22 | 129.2° | 123.6° |
C9 | C10 | C11 | 123.6° | 126.0° |
C9 | C10 | H10 | 118.2° | 117.0° |
C10 | C11 | C12 | 120.3° | 133.2° |
C10 | C11 | N23 | 125.3° | 121.9° |
C11 | C10 | H10 | 118.2° | 117.0° |
C12 | C11 | N23 | 114.2° | 104.6° |
C11 | C12 | C13 | 103.7° | 103.6° |
C11 | C12 | C46 | 113.7° | 110.6° |
C11 | C12 | C47 | 105.8° | 110.6° |
C11 | N23 | C14 | 109.7° | 112.2° |
C13 | C12 | C46 | 108.3° | 110.6° |
C13 | C12 | C47 | 116.0° | 110.6° |
C12 | C13 | C14 | 102.2° | 104.3° |
C12 | C13 | C48 | 112.1° | 110.5° |
C12 | C13 | H13 | 107.8° | 110.5° |
C46 | C12 | C47 | 109.3° | 110.6° |
C12 | C46 | H46 | 109.5° | 109.5° |
C12 | C46 | H46A | 109.5° | 109.5° |
C12 | C46 | H46B | 109.5° | 109.5° |
C12 | C47 | H47 | 109.5° | 109.4° |
C12 | C47 | H47A | 109.4° | 109.5° |
C12 | C47 | H47B | 109.5° | 109.4° |
C14 | C13 | C48 | 118.6° | 110.4° |
C13 | C14 | C15 | 122.6° | 129.9° |
C13 | C14 | N23 | 109.9° | 104.8° |
C14 | C13 | H13 | 107.5° | 110.4° |
C13 | C48 | C49 | 116.8° | 109.5° |
C48 | C13 | H13 | 108.1° | 110.5° |
C13 | C48 | H48 | 107.6° | 109.5° |
C13 | C48 | H48A | 107.6° | 109.4° |
C15 | C14 | N23 | 127.4° | 124.8° |
C14 | C15 | C16 | 120.9° | 125.1° |
C14 | C15 | C53 | 121.1° | 117.4° |
C16 | C15 | C53 | 118.0° | 117.4° |
C15 | C16 | C17 | 127.4° | 135.0° |
C15 | C16 | N24 | 118.9° | 118.0° |
C15 | C53 | H53 | 109.5° | 109.5° |
C15 | C53 | H53A | 109.5° | 109.4° |
C15 | C53 | H53B | 109.4° | 109.5° |
C17 | C16 | N24 | 113.5° | 105.3° |
C16 | C17 | C18 | 99.9° | 101.7° |
C16 | C17 | C54 | 108.7° | 111.0° |
C16 | C17 | C55 | 118.0° | 111.0° |
C16 | N24 | C19 | 110.1° | 116.4° |
C18 | C17 | C54 | 113.0° | 111.0° |
C18 | C17 | C55 | 108.7° | 111.0° |
C17 | C18 | C19 | 104.2° | 101.2° |
C17 | C18 | C60 | 114.7° | 111.1° |
C17 | C18 | H18 | 107.6° | 111.0° |
C54 | C17 | C55 | 108.4° | 110.9° |
C17 | C54 | H54 | 109.5° | 109.5° |
C17 | C54 | H54A | 109.5° | 109.5° |
C17 | C54 | H54B | 109.4° | 109.4° |
C17 | C55 | C56 | 114.4° | 109.5° |
C17 | C55 | H55 | 108.2° | 109.4° |
C17 | C55 | H55A | 108.2° | 109.4° |
C19 | C18 | C60 | 114.9° | 111.1° |
C18 | C19 | N24 | 103.3° | 101.9° |
C19 | C18 | H18 | 107.6° | 111.1° |
C18 | C19 | H19 | 108.9° | 111.3° |
C18 | C60 | C61 | 111.0° | 109.5° |
C60 | C18 | H18 | 107.5° | 111.0° |
C18 | C60 | H60 | 109.1° | 109.5° |
C18 | C60 | H60A | 109.1° | 109.5° |
N24 | C19 | H19 | 109.7° | 112.0° |
C1R | N1B | C2B | 119.8° | 126.5° |
C1R | N1B | C8B | 136.3° | 126.4° |
N1B | C1R | C2R | 114.7° | 109.9° |
N1B | C1R | O6R | 108.8° | 109.8° |
N1B | C1R | H1R | 109.1° | 109.8° |
C2B | N1B | C8B | 103.5° | 107.1° |
N1B | C2B | N3B | 113.9° | 110.1° |
N1B | C2B | H2B | 123.1° | 124.9° |
N1B | C8B | C7B | 132.6° | 135.2° |
N1B | C8B | C9B | 110.6° | 106.1° |
C2P | C1P | N59 | 111.4° | 109.5° |
C2P | C1P | H1P | 109.0° | 109.4° |
C2P | C1P | H1PA | 109.0° | 109.5° |
C1P | C2P | H2P | 109.4° | 109.4° |
C1P | C2P | H2PA | 109.4° | 109.5° |
C1P | N59 | C57 | 123.2° | 120.0° |
N59 | C1P | H1P | 109.0° | 109.4° |
N59 | C1P | H1PA | 109.0° | 109.5° |
C1P | N59 | HN59 | 118.4° | 119.9° |
C2R | C1R | O6R | 106.1° | 107.3° |
C1R | C2R | C3R | 100.6° | 104.2° |
C1R | C2R | O7R | 110.8° | 110.5° |
C2R | C1R | H1R | 108.2° | 109.9° |
C1R | C2R | H2R | 110.4° | 110.5° |
C1R | O6R | C4R | 110.4° | 107.0° |
O6R | C1R | H1R | 109.8° | 110.0° |
C26 | C27 | O28 | 120.5° | 120.0° |
C26 | C27 | N29 | 116.3° | 120.0° |
C27 | C26 | H26 | 107.6° | 109.5° |
C27 | C26 | H26A | 107.6° | 109.5° |
O28 | C27 | N29 | 123.2° | 120.0° |
C27 | N29 | HN29 | 120.0° | 120.0° |
C27 | N29 | HN2A | 120.0° | 120.0° |
C2B | N3B | C9B | 106.5° | 109.8° |
N3B | C2B | H2B | 123.1° | 125.0° |
C3R | C2R | O7R | 112.0° | 110.5° |
C2R | C3R | C4R | 102.8° | 102.1° |
C3R | C2R | H2R | 110.5° | 110.5° |
C2R | C3R | H3R | 109.9° | 110.9° |
O7R | C2R | H2R | 112.1° | 110.5° |
C2R | O7R | HO7R | 109.5° | 114.0° |
C30 | C31 | C32 | 111.9° | 109.5° |
C31 | C30 | H30 | 108.5° | 109.5° |
C31 | C30 | H30A | 108.5° | 109.5° |
C30 | C31 | H31 | 108.9° | 109.5° |
C30 | C31 | H31A | 108.8° | 109.5° |
C31 | C32 | N33 | 116.3° | 120.0° |
C31 | C32 | O34 | 120.8° | 120.0° |
C32 | C31 | H31 | 108.9° | 109.5° |
C32 | C31 | H31A | 108.8° | 109.5° |
N33 | C32 | O34 | 122.9° | 120.0° |
C32 | N33 | HN33 | 120.0° | 120.0° |
C32 | N33 | HN3A | 120.0° | 120.0° |
C37 | C38 | O39 | 119.2° | 120.1° |
C37 | C38 | N40 | 117.7° | 120.0° |
C38 | C37 | H37 | 108.7° | 109.5° |
C38 | C37 | H37A | 108.8° | 109.5° |
O39 | C38 | N40 | 123.0° | 120.0° |
C38 | N40 | HN40 | 120.0° | 120.0° |
C38 | N40 | HN4A | 120.0° | 120.0° |
N3B | C9B | N4B | 127.7° | 134.5° |
N3B | C9B | C8B | 105.5° | 106.9° |
C3R | C4R | C5R | 114.3° | 110.6° |
C3R | C4R | O6R | 105.1° | 103.5° |
C4R | C3R | H3R | 109.9° | 110.9° |
C3R | C4R | H4R | 108.9° | 110.6° |
C41 | C42 | C43 | 112.5° | 109.5° |
C42 | C41 | H41 | 108.1° | 109.5° |
C42 | C41 | H41A | 108.1° | 109.4° |
C41 | C42 | H42 | 108.7° | 109.5° |
C41 | C42 | H42A | 108.7° | 109.5° |
C42 | C43 | O44 | 121.1° | 120.0° |
C42 | C43 | N45 | 116.1° | 120.0° |
C43 | C42 | H42 | 108.7° | 109.5° |
C43 | C42 | H42A | 108.7° | 109.5° |
O44 | C43 | N45 | 122.8° | 120.0° |
C43 | N45 | HN45 | 120.0° | 120.1° |
C43 | N45 | HN4B | 120.0° | 120.0° |
C48 | C49 | C50 | 113.4° | 109.5° |
C49 | C48 | H48 | 107.6° | 109.5° |
C49 | C48 | H48A | 107.6° | 109.4° |
C48 | C49 | H49 | 108.5° | 109.5° |
C48 | C49 | H49A | 108.4° | 109.4° |
C49 | C50 | O51 | 121.2° | 120.0° |
C49 | C50 | N52 | 116.1° | 120.0° |
C50 | C49 | H49 | 108.5° | 109.5° |
C50 | C49 | H49A | 108.5° | 109.5° |
C5B | N4B | C9B | 111.1° | 120.6° |
N4B | C5B | N6B | 128.8° | 122.5° |
N4B | C5B | H5B | 115.6° | 118.7° |
N4B | C9B | C8B | 126.8° | 118.6° |
C5R | C4R | O6R | 109.2° | 110.6° |
C4R | C5R | O8R | 111.4° | 109.5° |
C5R | C4R | H4R | 109.1° | 110.5° |
C4R | C5R | H5R | 109.0° | 109.5° |
C4R | C5R | H5RA | 109.0° | 109.5° |
O6R | C4R | H4R | 110.0° | 110.8° |
O51 | C50 | N52 | 122.7° | 120.0° |
C50 | N52 | HN52 | 120.0° | 120.0° |
C50 | N52 | HN5A | 120.0° | 120.0° |
C55 | C56 | C57 | 110.2° | 109.5° |
C56 | C55 | H55 | 108.2° | 109.5° |
C56 | C55 | H55A | 108.2° | 109.5° |
C55 | C56 | H56 | 109.3° | 109.5° |
C55 | C56 | H56A | 109.3° | 109.5° |
C56 | C57 | O58 | 121.9° | 120.0° |
C56 | C57 | N59 | 115.7° | 120.0° |
C57 | C56 | H56 | 109.3° | 109.5° |
C57 | C56 | H56A | 109.3° | 109.4° |
O58 | C57 | N59 | 122.4° | 120.0° |
C57 | N59 | HN59 | 118.4° | 120.0° |
C5B | N6B | C7B | 118.8° | 121.1° |
N6B | C5B | H5B | 115.6° | 118.7° |
O8R | C5R | H5R | 109.0° | 109.5° |
O8R | C5R | H5RA | 109.0° | 109.5° |
C5R | O8R | HO8R | 109.5° | 114.0° |
C60 | C61 | N62 | 116.5° | 120.0° |
C60 | C61 | O63 | 120.5° | 120.0° |
C61 | C60 | H60 | 109.1° | 109.5° |
C61 | C60 | H60A | 109.1° | 109.5° |
N62 | C61 | O63 | 123.0° | 120.0° |
C61 | N62 | HN62 | 120.0° | 120.1° |
C61 | N62 | HN6A | 120.0° | 120.0° |
N6B | C7B | N7A | 118.5° | 120.8° |
N6B | C7B | C8B | 117.7° | 118.5° |
N7A | C7B | C8B | 123.7° | 120.7° |
C7B | N7A | HN7A | 109.5° | 120.0° |
C7B | N7A | HN7B | 109.5° | 120.1° |
C7B | C8B | C9B | 116.8° | 118.7° |
H1P | C1P | H1PA | 109.5° | 109.4° |
H20 | C20 | H20A | 109.4° | 109.5° |
H20 | C20 | H20B | 109.5° | 109.5° |
H20A | C20 | H20B | 109.5° | 109.4° |
H25 | C25 | H25A | 109.5° | 109.4° |
H25 | C25 | H25B | 109.4° | 109.5° |
H25A | C25 | H25B | 109.4° | 109.5° |
H26 | C26 | H26A | 109.5° | 109.5° |
HN29 | N29 | HN2A | 120.0° | 120.0° |
H2P | C2P | H2PA | 109.5° | 109.5° |
H30 | C30 | H30A | 109.5° | 109.4° |
H31 | C31 | H31A | 109.5° | 109.4° |
HN33 | N33 | HN3A | 120.0° | 120.0° |
H35 | C35 | H35A | 109.5° | 109.5° |
H35 | C35 | H35B | 109.5° | 109.5° |
H35A | C35 | H35B | 109.5° | 109.4° |
H36 | C36 | H36A | 109.5° | 109.5° |
H36 | C36 | H36B | 109.5° | 109.4° |
H36A | C36 | H36B | 109.5° | 109.5° |
H37 | C37 | H37A | 109.5° | 109.4° |
HN40 | N40 | HN4A | 120.0° | 120.0° |
H41 | C41 | H41A | 109.4° | 109.5° |
H42 | C42 | H42A | 109.5° | 109.4° |
HN45 | N45 | HN4B | 120.0° | 119.9° |
H46 | C46 | H46A | 109.4° | 109.5° |
H46 | C46 | H46B | 109.5° | 109.5° |
H46A | C46 | H46B | 109.4° | 109.5° |
H47 | C47 | H47A | 109.5° | 109.5° |
H47 | C47 | H47B | 109.5° | 109.5° |
H47A | C47 | H47B | 109.5° | 109.5° |
H48 | C48 | H48A | 109.5° | 109.5° |
H49 | C49 | H49A | 109.5° | 109.5° |
HN52 | N52 | HN5A | 120.0° | 120.0° |
H53 | C53 | H53A | 109.4° | 109.4° |
H53 | C53 | H53B | 109.5° | 109.5° |
H53A | C53 | H53B | 109.5° | 109.5° |
H54 | C54 | H54A | 109.4° | 109.5° |
H54 | C54 | H54B | 109.5° | 109.5° |
H54A | C54 | H54B | 109.5° | 109.5° |
H55 | C55 | H55A | 109.5° | 109.5° |
H56 | C56 | H56A | 109.5° | 109.5° |
H5R | C5R | H5RA | 109.5° | 109.4° |
H60 | C60 | H60A | 109.5° | 109.4° |
HN62 | N62 | HN6A | 120.0° | 119.9° |
HN7A | N7A | HN7B | 109.4° | 119.9° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O2 | P | O3 | O4 | 119.0° | 120.0° |
O2 | P | O3 | O5 | 112.5° | 120.0° |
O2 | P | O4 | O5 | 125.9° | 120.0° |
O2 | P | O3 | C2P | 88.6° | 174.6° |
P | O2 | C3R | C2R | 133.8° | 123.8° |
P | O2 | C3R | C4R | 112.4° | 123.5° |
P | O2 | C3R | H3R | 9.5° | 0.1° |
O2 | P | O5 | H5 | 127.2° | 60.0° |
O3 | P | O4 | O5 | 120.6° | 120.0° |
O3 | P | O2 | C3R | 67.1° | 174.8° |
P | O3 | C2P | C1P | 173.3° | 175.8° |
P | O3 | C2P | H2P | 53.3° | 55.9° |
P | O3 | C2P | H2PA | 66.6° | 64.2° |
O3 | P | O5 | H5 | 125.1° | 60.0° |
O4 | P | O2 | C3R | 172.8° | 54.8° |
O4 | P | O3 | C2P | 30.4° | 54.5° |
O4 | P | O5 | H5 | 0.0° | 180.0° |
O5 | P | O2 | C3R | 41.8° | 65.2° |
O5 | P | O3 | C2P | 158.9° | 65.5° |
N21 | CO | N22 | N23 | 163.8° | 141.6° |
N21 | CO | N22 | N24 | 20.9° | 104.9° |
N21 | CO | N23 | N24 | 70.0° | 105.8° |
CO | N21 | C1 | C2 | 157.7° | 156.6° |
CO | N21 | C1 | C19 | 33.9° | 36.8° |
CO | N21 | C1 | C20 | 80.1° | 84.6° |
CO | N21 | C1 | C4 | 177.7° | 157.0° |
CO | N21 | C4 | C3 | 174.6° | 172.0° |
CO | N21 | C4 | C5 | 5.2° | 5.6° |
N21 | CO | N22 | C6 | 29.9° | 6.7° |
N21 | CO | N22 | C9 | 167.8° | 147.9° |
N21 | CO | N23 | C11 | 112.5° | 108.0° |
N21 | CO | N23 | C14 | 76.1° | 96.9° |
N21 | CO | N24 | C16 | 167.5° | 137.1° |
N21 | CO | N24 | C19 | 14.3° | 12.0° |
N22 | CO | N23 | N24 | 175.2° | 136.7° |
N22 | CO | N21 | C1 | 164.6° | 149.4° |
N22 | CO | N21 | C4 | 18.3° | 2.7° |
CO | N22 | C6 | C5 | 28.3° | 14.1° |
CO | N22 | C6 | C7 | 157.0° | 172.8° |
CO | N22 | C6 | C9 | 164.1° | 156.2° |
CO | N22 | C9 | C8 | 177.4° | 173.5° |
CO | N22 | C9 | C10 | 1.4° | 15.9° |
N22 | CO | N23 | C11 | 7.3° | 9.4° |
N22 | CO | N23 | C14 | 178.7° | 145.6° |
N22 | CO | N24 | C16 | 146.6° | 116.5° |
N22 | CO | N24 | C19 | 35.2° | 94.4° |
N23 | CO | N21 | C1 | 58.3° | 91.5° |
N23 | CO | N21 | C4 | 124.6° | 116.3° |
N23 | CO | N22 | C6 | 166.4° | 148.3° |
N23 | CO | N22 | C9 | 4.0° | 6.4° |
CO | N23 | C11 | C10 | 8.3° | 16.9° |
CO | N23 | C11 | C12 | 176.7° | 168.3° |
CO | N23 | C11 | C14 | 172.6° | 157.3° |
CO | N23 | C14 | C13 | 174.1° | 172.2° |
CO | N23 | C14 | C15 | 2.5° | 15.8° |
N23 | CO | N24 | C16 | 3.4° | 0.9° |
N23 | CO | N24 | C19 | 178.4° | 150.0° |
CO | N24 | C19 | C1 | 35.1° | 34.6° |
N24 | CO | N21 | C1 | 12.5° | 15.4° |
N24 | CO | N21 | C4 | 164.6° | 136.8° |
N24 | CO | N22 | C6 | 50.7° | 98.2° |
N24 | CO | N22 | C9 | 146.9° | 107.2° |
N24 | CO | N23 | C11 | 177.5° | 146.2° |
N24 | CO | N23 | C14 | 6.1° | 8.9° |
CO | N24 | C16 | C15 | 3.3° | 1.5° |
CO | N24 | C16 | C17 | 179.2° | 169.0° |
CO | N24 | C16 | C19 | 178.2° | 146.6° |
CO | N24 | C19 | C18 | 162.2° | 153.3° |
CO | N24 | C19 | H19 | 81.8° | 87.6° |
C2 | C1 | C19 | C20 | 131.2° | 127.0° |
C2 | C1 | C19 | N21 | 114.2° | 111.2° |
C2 | C1 | C20 | N21 | 114.8° | 113.0° |
C1 | C2 | C3 | C25 | 121.7° | 118.1° |
C1 | C2 | C3 | C26 | 113.1° | 118.1° |
C1 | C2 | C25 | C26 | 122.1° | 123.8° |
C1 | C2 | C3 | C4 | 25.6° | 33.1° |
C1 | C2 | C3 | C30 | 97.9° | 85.0° |
C2 | C1 | N21 | C4 | 19.9° | 0.4° |
C2 | C1 | C19 | C18 | 88.6° | 90.1° |
C2 | C1 | C19 | N24 | 155.6° | 158.6° |
C1 | C2 | C26 | C27 | 174.4° | 174.1° |
C1 | C2 | C3 | H3 | 140.8° | 151.3° |
C2 | C1 | C19 | H19 | 38.2° | 35.9° |
C2 | C1 | C20 | H20 | 180.0° | 58.4° |
C2 | C1 | C20 | H20A | 60.0° | 178.4° |
C2 | C1 | C20 | H20B | 60.0° | 61.6° |
C1 | C2 | C25 | H25 | 180.0° | 66.5° |
C1 | C2 | C25 | H25A | 60.0° | 173.6° |
C1 | C2 | C25 | H25B | 60.0° | 53.5° |
C1 | C2 | C26 | H26 | 64.5° | 65.9° |
C1 | C2 | C26 | H26A | 53.4° | 54.1° |
C19 | C1 | C20 | N21 | 112.4° | 118.4° |
C19 | C1 | C2 | C3 | 142.4° | 134.9° |
C19 | C1 | C2 | C25 | 94.7° | 107.0° |
C19 | C1 | C2 | C26 | 29.8° | 16.8° |
C19 | C1 | N21 | C4 | 143.8° | 120.2° |
C1 | C19 | N24 | C16 | 146.3° | 119.6° |
C1 | C19 | C18 | C17 | 145.8° | 136.6° |
C1 | C19 | C18 | N24 | 116.8° | 114.4° |
C1 | C19 | C18 | H19 | 126.7° | 126.0° |
C1 | C19 | C18 | C60 | 87.9° | 105.4° |
C1 | C19 | N24 | H19 | 116.9° | 122.2° |
C1 | C19 | C18 | H18 | 31.8° | 18.7° |
C19 | C1 | C20 | H20 | 47.2° | 173.0° |
C19 | C1 | C20 | H20A | 72.8° | 53.0° |
C19 | C1 | C20 | H20B | 167.2° | 67.0° |
C20 | C1 | C2 | C3 | 90.0° | 98.2° |
C20 | C1 | C2 | C25 | 33.0° | 19.9° |
C20 | C1 | C2 | C26 | 157.5° | 143.7° |
C20 | C1 | N21 | C4 | 102.2° | 118.4° |
C20 | C1 | C19 | C18 | 42.7° | 36.8° |
C20 | C1 | C19 | N24 | 73.1° | 74.4° |
C20 | C1 | C19 | H19 | 169.4° | 162.9° |
C1 | C20 | H20 | H20A | 120.0° | 120.0° |
C1 | C20 | H20 | H20B | 120.0° | 120.0° |
C1 | C20 | H20A | H20B | 120.0° | 120.0° |
N21 | C1 | C2 | C3 | 27.5° | 21.1° |
N21 | C1 | C2 | C25 | 150.5° | 139.2° |
N21 | C1 | C2 | C26 | 85.0° | 97.0° |
C1 | N21 | C4 | C3 | 2.6° | 22.0° |
C1 | N21 | C4 | C5 | 177.6° | 144.4° |
N21 | C1 | C19 | C18 | 157.3° | 158.7° |
N21 | C1 | C19 | N24 | 41.5° | 47.4° |
N21 | C1 | C19 | H19 | 76.0° | 75.3° |
N21 | C1 | C20 | H20 | 65.2° | 54.6° |
N21 | C1 | C20 | H20A | 174.9° | 65.4° |
N21 | C1 | C20 | H20B | 54.9° | 174.6° |
C3 | C2 | C25 | C26 | 122.6° | 123.8° |
C2 | C3 | C4 | C30 | 122.7° | 118.1° |
C2 | C3 | C4 | H3 | 114.5° | 118.2° |
C2 | C3 | C30 | H3 | 121.0° | 123.7° |
C2 | C3 | C4 | C5 | 164.0° | 128.5° |
C2 | C3 | C4 | N21 | 15.8° | 33.9° |
C3 | C2 | C26 | C27 | 65.8° | 61.7° |
C2 | C3 | C30 | C31 | 100.5° | 175.0° |
C3 | C2 | C25 | H25 | 64.7° | 178.9° |
C3 | C2 | C25 | H25A | 55.4° | 61.2° |
C3 | C2 | C25 | H25B | 175.3° | 58.9° |
C3 | C2 | C26 | H26 | 173.1° | 178.3° |
C3 | C2 | C26 | H26A | 55.2° | 58.2° |
C2 | C3 | C30 | H30 | 138.9° | 65.0° |
C2 | C3 | C30 | H30A | 20.1° | 55.0° |
C25 | C2 | C3 | C4 | 147.3° | 151.2° |
C25 | C2 | C3 | C30 | 23.8° | 33.1° |
C25 | C2 | C26 | C27 | 60.8° | 62.1° |
C25 | C2 | C3 | H3 | 97.5° | 90.6° |
C2 | C25 | H25 | H25A | 120.0° | 119.9° |
C2 | C25 | H25 | H25B | 120.0° | 120.0° |
C2 | C25 | H25A | H25B | 120.0° | 120.0° |
C25 | C2 | C26 | H26 | 60.3° | 57.9° |
C25 | C2 | C26 | H26A | 178.2° | 178.0° |
C26 | C2 | C3 | C4 | 87.5° | 85.0° |
C26 | C2 | C3 | C30 | 149.0° | 156.8° |
C2 | C26 | C27 | H26 | 121.0° | 119.9° |
C2 | C26 | C27 | H26A | 121.0° | 120.0° |
C2 | C26 | C27 | O28 | 10.7° | 2.1° |
C2 | C26 | C27 | N29 | 168.3° | 177.9° |
C26 | C2 | C3 | H3 | 27.7° | 33.2° |
C26 | C2 | C25 | H25 | 57.9° | 57.3° |
C26 | C2 | C25 | H25A | 178.0° | 62.6° |
C26 | C2 | C25 | H25B | 62.1° | 177.3° |
C2 | C26 | H26 | H26A | 116.7° | 120.0° |
O2 | C3R | C2R | C1R | 80.4° | 139.1° |
O2 | C3R | C2R | C4R | 118.0° | 118.2° |
O2 | C3R | C2R | H3R | 125.1° | 123.6° |
O2 | C3R | C2R | O7R | 37.3° | 20.4° |
O2 | C3R | C4R | H3R | 122.9° | 123.6° |
O2 | C3R | C4R | C5R | 149.0° | 86.3° |
O2 | C3R | C4R | O6R | 91.3° | 155.2° |
O2 | C3R | C2R | H2R | 163.0° | 102.2° |
O2 | C3R | C4R | H4R | 26.6° | 36.5° |
C4 | C3 | C30 | H3 | 122.9° | 123.8° |
C3 | C4 | C5 | N21 | 179.8° | 161.0° |
C3 | C4 | C5 | C6 | 174.2° | 160.0° |
C3 | C4 | C5 | C35 | 4.3° | 20.0° |
C4 | C3 | C30 | C31 | 143.5° | 72.5° |
C4 | C3 | C30 | H30 | 22.9° | 47.5° |
C4 | C3 | C30 | H30A | 96.0° | 167.4° |
C30 | C3 | C4 | C5 | 73.3° | 113.4° |
C30 | C3 | C4 | N21 | 107.0° | 84.2° |
C3 | C30 | C31 | H30 | 120.6° | 120.0° |
C3 | C30 | C31 | H30A | 120.6° | 120.1° |
C3 | C30 | C31 | C32 | 172.5° | 180.0° |
C3 | C30 | H30 | H30A | 118.2° | 120.0° |
C3 | C30 | C31 | H31 | 52.1° | 60.0° |
C3 | C30 | C31 | H31A | 67.1° | 59.9° |
O3 | C2P | C1P | H2P | 120.1° | 119.9° |
O3 | C2P | C1P | H2PA | 120.1° | 120.1° |
O3 | C2P | C1P | N59 | 63.4° | 65.1° |
O3 | C2P | C1P | H1P | 176.3° | 174.9° |
O3 | C2P | C1P | H1PA | 56.9° | 55.0° |
O3 | C2P | H2P | H2PA | 119.8° | 120.1° |
C4 | C5 | C6 | C35 | 178.3° | 180.0° |
C4 | C5 | C6 | C7 | 179.0° | 176.8° |
C4 | C5 | C6 | N22 | 5.6° | 11.7° |
C5 | C4 | C3 | H3 | 49.5° | 10.3° |
C4 | C5 | C35 | H35 | 180.0° | 4.3° |
C4 | C5 | C35 | H35A | 60.0° | 124.3° |
C4 | C5 | C35 | H35B | 60.0° | 115.8° |
N21 | C4 | C5 | C6 | 6.0° | 1.0° |
N21 | C4 | C5 | C35 | 175.5° | 179.0° |
N21 | C4 | C3 | H3 | 130.3° | 152.1° |
C5 | C6 | C7 | N22 | 174.0° | 173.0° |
C5 | C6 | C7 | C8 | 147.2° | 155.7° |
C5 | C6 | C7 | C36 | 31.0° | 37.3° |
C5 | C6 | C7 | C37 | 98.5° | 85.9° |
C5 | C6 | N22 | C9 | 167.6° | 142.2° |
C6 | C5 | C35 | H35 | 1.6° | 175.7° |
C6 | C5 | C35 | H35A | 118.5° | 55.7° |
C6 | C5 | C35 | H35B | 121.6° | 64.2° |
C35 | C5 | C6 | C7 | 0.7° | 3.2° |
C35 | C5 | C6 | N22 | 172.7° | 168.4° |
C5 | C35 | H35 | H35A | 120.0° | 119.9° |
C5 | C35 | H35 | H35B | 120.0° | 120.1° |
C5 | C35 | H35A | H35B | 120.0° | 120.0° |
C6 | C7 | C8 | C36 | 123.8° | 118.4° |
C6 | C7 | C8 | C37 | 116.5° | 118.4° |
C6 | C7 | C36 | C37 | 130.0° | 123.2° |
C6 | C7 | C8 | C9 | 33.6° | 1.1° |
C6 | C7 | C8 | C41 | 78.7° | 117.4° |
C7 | C6 | N22 | C9 | 7.1° | 31.0° |
C6 | C7 | C37 | C38 | 86.6° | 174.0° |
C6 | C7 | C8 | H8 | 154.3° | 119.5° |
C6 | C7 | C36 | H36 | 180.0° | 70.7° |
C6 | C7 | C36 | H36A | 60.0° | 169.3° |
C6 | C7 | C36 | H36B | 60.0° | 49.2° |
C6 | C7 | C37 | H37 | 33.9° | 66.0° |
C6 | C7 | C37 | H37A | 153.0° | 54.0° |
N22 | C6 | C7 | C8 | 26.7° | 17.2° |
N22 | C6 | C7 | C36 | 143.0° | 135.6° |
N22 | C6 | C7 | C37 | 87.5° | 101.1° |
C6 | N22 | C9 | C8 | 17.2° | 30.4° |
C6 | N22 | C9 | C10 | 166.9° | 140.2° |
C8 | C7 | C36 | C37 | 118.4° | 123.1° |
C7 | C8 | C9 | C41 | 114.5° | 118.4° |
C7 | C8 | C9 | H8 | 120.2° | 118.5° |
C7 | C8 | C41 | H8 | 126.9° | 123.1° |
C7 | C8 | C9 | C10 | 150.4° | 153.9° |
C7 | C8 | C9 | N22 | 33.2° | 15.9° |
C8 | C7 | C37 | C38 | 164.9° | 60.4° |
C7 | C8 | C41 | C42 | 167.5° | 166.3° |
C8 | C7 | C36 | H36 | 68.4° | 175.6° |
C8 | C7 | C36 | H36A | 51.6° | 55.6° |
C8 | C7 | C36 | H36B | 171.6° | 64.5° |
C8 | C7 | C37 | H37 | 74.6° | 179.6° |
C8 | C7 | C37 | H37A | 44.5° | 59.7° |
C7 | C8 | C41 | H41 | 46.7° | 73.7° |
C7 | C8 | C41 | H41A | 71.7° | 46.3° |
C36 | C7 | C8 | C9 | 157.4° | 119.5° |
C36 | C7 | C8 | C41 | 45.0° | 1.0° |
C36 | C7 | C37 | C38 | 46.9° | 62.8° |
C36 | C7 | C8 | H8 | 82.0° | 122.0° |
C7 | C36 | H36 | H36A | 120.0° | 120.0° |
C7 | C36 | H36 | H36B | 120.0° | 120.0° |
C7 | C36 | H36A | H36B | 120.0° | 120.0° |
C36 | C7 | C37 | H37 | 167.3° | 57.2° |
C36 | C7 | C37 | H37A | 73.6° | 177.2° |
C37 | C7 | C8 | C9 | 83.0° | 117.3° |
C37 | C7 | C8 | C41 | 164.7° | 124.2° |
C7 | C37 | C38 | H37 | 120.4° | 120.0° |
C7 | C37 | C38 | H37A | 120.5° | 120.0° |
C7 | C37 | C38 | O39 | 58.9° | 1.7° |
C7 | C37 | C38 | N40 | 123.9° | 178.3° |
C37 | C7 | C8 | H8 | 37.7° | 1.1° |
C37 | C7 | C36 | H36 | 50.0° | 52.5° |
C37 | C7 | C36 | H36A | 170.0° | 67.5° |
C37 | C7 | C36 | H36B | 70.0° | 172.4° |
C7 | C37 | H37 | H37A | 118.6° | 120.0° |
C9 | C8 | C41 | H8 | 125.6° | 123.1° |
C8 | C9 | C10 | N22 | 175.6° | 168.3° |
C8 | C9 | C10 | C11 | 175.9° | 178.2° |
C9 | C8 | C41 | C42 | 60.0° | 79.9° |
C9 | C8 | C41 | H41 | 60.8° | 40.1° |
C9 | C8 | C41 | H41A | 179.2° | 160.1° |
C8 | C9 | C10 | H10 | 4.1° | 2.0° |
C41 | C8 | C9 | C10 | 95.1° | 35.5° |
C41 | C8 | C9 | N22 | 81.3° | 134.3° |
C8 | C41 | C42 | H41 | 120.8° | 120.0° |
C8 | C41 | C42 | H41A | 120.8° | 120.0° |
C8 | C41 | C42 | C43 | 157.7° | 174.7° |
C8 | C41 | H41 | H41A | 117.6° | 120.0° |
C8 | C41 | C42 | H42 | 81.9° | 65.2° |
C8 | C41 | C42 | H42A | 37.3° | 54.7° |
C9 | C10 | C11 | H10 | 180.0° | 179.8° |
C9 | C10 | C11 | C12 | 178.7° | 178.7° |
C9 | C10 | C11 | N23 | 4.1° | 8.2° |
C10 | C9 | C8 | H8 | 30.2° | 87.6° |
N22 | C9 | C10 | C11 | 0.3° | 9.9° |
N22 | C9 | C8 | H8 | 153.4° | 102.6° |
N22 | C9 | C10 | H10 | 179.7° | 170.3° |
C10 | C11 | C12 | N23 | 175.2° | 173.9° |
C10 | C11 | C12 | C13 | 180.0° | 151.5° |
C10 | C11 | C12 | C46 | 62.6° | 32.9° |
C10 | C11 | C12 | C47 | 57.4° | 90.0° |
C10 | C11 | N23 | C14 | 179.1° | 140.4° |
C11 | C12 | C13 | C46 | 121.1° | 118.5° |
C11 | C12 | C13 | C47 | 115.6° | 118.6° |
C11 | C12 | C46 | C47 | 118.0° | 122.9° |
C11 | C12 | C13 | C14 | 3.2° | 5.3° |
C11 | C12 | C13 | C48 | 131.2° | 124.0° |
C12 | C11 | N23 | C14 | 4.2° | 34.4° |
C11 | C12 | C13 | H13 | 110.0° | 113.4° |
C11 | C12 | C46 | H46 | 180.0° | 58.5° |
C11 | C12 | C46 | H46A | 60.0° | 178.5° |
C11 | C12 | C46 | H46B | 60.0° | 61.5° |
C11 | C12 | C47 | H47 | 180.0° | 61.4° |
C11 | C12 | C47 | H47A | 60.0° | 178.5° |
C11 | C12 | C47 | H47B | 60.0° | 58.5° |
C12 | C11 | C10 | H10 | 1.3° | 1.4° |
N23 | C11 | C12 | C13 | 4.7° | 22.5° |
N23 | C11 | C12 | C46 | 122.2° | 141.0° |
N23 | C11 | C12 | C47 | 117.9° | 96.1° |
C11 | N23 | C14 | C13 | 1.7° | 30.6° |
C11 | N23 | C14 | C15 | 174.9° | 141.4° |
N23 | C11 | C10 | H10 | 175.9° | 171.7° |
C13 | C12 | C46 | C47 | 127.3° | 122.9° |
C12 | C13 | C14 | C48 | 123.8° | 118.7° |
C12 | C13 | C14 | H13 | 113.4° | 118.7° |
C12 | C13 | C48 | H13 | 118.7° | 122.6° |
C12 | C13 | C14 | C15 | 178.0° | 158.0° |
C12 | C13 | C14 | N23 | 1.1° | 13.5° |
C12 | C13 | C48 | C49 | 92.3° | 174.3° |
C13 | C12 | C46 | H46 | 65.3° | 55.7° |
C13 | C12 | C46 | H46A | 174.7° | 64.3° |
C13 | C12 | C46 | H46B | 54.8° | 175.7° |
C13 | C12 | C47 | H47 | 65.6° | 175.7° |
C13 | C12 | C47 | H47A | 54.4° | 64.3° |
C13 | C12 | C47 | H47B | 174.3° | 55.7° |
C12 | C13 | C48 | H48 | 28.7° | 65.7° |
C12 | C13 | C48 | H48A | 146.6° | 54.3° |
C46 | C12 | C13 | C14 | 124.3° | 123.9° |
C46 | C12 | C13 | C48 | 107.6° | 117.4° |
C46 | C12 | C13 | H13 | 11.2° | 5.2° |
C12 | C46 | H46 | H46A | 120.0° | 120.0° |
C12 | C46 | H46 | H46B | 120.0° | 120.0° |
C12 | C46 | H46A | H46B | 120.0° | 120.0° |
C46 | C12 | C47 | H47 | 57.2° | 61.5° |
C46 | C12 | C47 | H47A | 177.2° | 58.6° |
C46 | C12 | C47 | H47B | 62.8° | 178.6° |
C47 | C12 | C13 | C14 | 112.4° | 113.2° |
C47 | C12 | C13 | C48 | 15.7° | 5.5° |
C47 | C12 | C13 | H13 | 134.5° | 128.1° |
C47 | C12 | C46 | H46 | 62.0° | 178.6° |
C47 | C12 | C46 | H46A | 58.0° | 58.5° |
C47 | C12 | C46 | H46B | 177.9° | 61.5° |
C12 | C47 | H47 | H47A | 120.0° | 120.0° |
C12 | C47 | H47 | H47B | 120.0° | 119.9° |
C12 | C47 | H47A | H47B | 120.0° | 120.0° |
C14 | C13 | C48 | H13 | 122.5° | 122.5° |
C13 | C14 | C15 | N23 | 176.2° | 169.9° |
C13 | C14 | C15 | C16 | 177.5° | 176.9° |
C13 | C14 | C15 | C53 | 1.6° | 3.0° |
C14 | C13 | C48 | C49 | 26.5° | 70.8° |
C14 | C13 | C48 | H48 | 147.5° | 49.2° |
C14 | C13 | C48 | H48A | 94.6° | 169.2° |
C48 | C13 | C14 | C15 | 58.2° | 83.3° |
C48 | C13 | C14 | N23 | 125.0° | 105.2° |
C13 | C48 | C49 | H48 | 121.1° | 120.0° |
C13 | C48 | C49 | H48A | 121.1° | 119.9° |
C13 | C48 | C49 | C50 | 157.9° | 177.6° |
C13 | C48 | H48 | H48A | 116.7° | 120.0° |
C13 | C48 | C49 | H49 | 37.3° | 57.5° |
C13 | C48 | C49 | H49A | 81.5° | 62.5° |
C14 | C15 | C16 | C53 | 179.1° | 180.0° |
C14 | C15 | C16 | C17 | 175.7° | 159.0° |
C14 | C15 | C16 | N24 | 9.0° | 3.8° |
C15 | C14 | C13 | H13 | 64.6° | 39.2° |
C14 | C15 | C53 | H53 | 180.0° | 5.2° |
C14 | C15 | C53 | H53A | 60.0° | 125.1° |
C14 | C15 | C53 | H53B | 60.0° | 114.9° |
N23 | C14 | C15 | C16 | 6.3° | 13.1° |
N23 | C14 | C15 | C53 | 174.7° | 166.9° |
N23 | C14 | C13 | H13 | 112.2° | 132.2° |
C15 | C16 | C17 | N24 | 175.5° | 164.3° |
C15 | C16 | C17 | C18 | 167.1° | 129.2° |
C15 | C16 | C17 | C54 | 74.3° | 112.7° |
C15 | C16 | C17 | C55 | 49.6° | 11.2° |
C15 | C16 | N24 | C19 | 174.9° | 145.1° |
C16 | C15 | C53 | H53 | 0.9° | 174.8° |
C16 | C15 | C53 | H53A | 119.1° | 54.9° |
C16 | C15 | C53 | H53B | 120.9° | 65.1° |
C53 | C15 | C16 | C17 | 3.4° | 21.0° |
C53 | C15 | C16 | N24 | 171.9° | 176.2° |
C15 | C53 | H53 | H53A | 120.0° | 119.9° |
C15 | C53 | H53 | H53B | 120.0° | 120.0° |
C15 | C53 | H53A | H53B | 120.0° | 120.0° |
C16 | C17 | C18 | C54 | 115.4° | 118.1° |
C16 | C17 | C18 | C55 | 124.2° | 118.1° |
C16 | C17 | C54 | C55 | 129.4° | 123.9° |
C16 | C17 | C18 | C19 | 27.4° | 34.4° |
C16 | C17 | C18 | C60 | 153.8° | 152.4° |
C17 | C16 | N24 | C19 | 1.0° | 22.4° |
C16 | C17 | C55 | C56 | 48.7° | 65.6° |
C16 | C17 | C18 | H18 | 86.6° | 83.7° |
C16 | C17 | C54 | H54 | 180.0° | 58.5° |
C16 | C17 | C54 | H54A | 60.0° | 178.6° |
C16 | C17 | C54 | H54B | 60.0° | 61.4° |
C16 | C17 | C55 | H55 | 72.0° | 54.4° |
C16 | C17 | C55 | H55A | 169.4° | 174.4° |
N24 | C16 | C17 | C18 | 17.3° | 35.1° |
N24 | C16 | C17 | C54 | 101.3° | 83.0° |
N24 | C16 | C17 | C55 | 134.9° | 153.1° |
C16 | N24 | C19 | C18 | 19.1° | 0.9° |
C16 | N24 | C19 | H19 | 96.9° | 118.2° |
C18 | C17 | C54 | C55 | 120.6° | 123.8° |
C17 | C18 | C19 | C60 | 126.3° | 118.0° |
C17 | C18 | C19 | H18 | 114.0° | 118.0° |
C17 | C18 | C60 | H18 | 119.6° | 124.0° |
C17 | C18 | C19 | N24 | 29.1° | 22.2° |
C18 | C17 | C55 | C56 | 64.0° | 46.7° |
C17 | C18 | C60 | C61 | 82.9° | 68.8° |
C17 | C18 | C19 | H19 | 87.4° | 97.4° |
C18 | C17 | C54 | H54 | 70.0° | 53.8° |
C18 | C17 | C54 | H54A | 170.0° | 66.3° |
C18 | C17 | C54 | H54B | 50.0° | 173.7° |
C18 | C17 | C55 | H55 | 175.2° | 166.7° |
C18 | C17 | C55 | H55A | 56.7° | 73.3° |
C17 | C18 | C60 | H60 | 37.3° | 51.2° |
C17 | C18 | C60 | H60A | 156.9° | 171.2° |
C54 | C17 | C18 | C19 | 87.9° | 83.7° |
C54 | C17 | C18 | C60 | 38.4° | 34.2° |
C54 | C17 | C55 | C56 | 172.8° | 170.5° |
C54 | C17 | C18 | H18 | 158.0° | 158.2° |
C17 | C54 | H54 | H54A | 120.0° | 120.0° |
C17 | C54 | H54 | H54B | 120.0° | 119.9° |
C17 | C54 | H54A | H54B | 120.0° | 120.0° |
C54 | C17 | C55 | H55 | 52.0° | 69.5° |
C54 | C17 | C55 | H55A | 66.5° | 50.5° |
C55 | C17 | C18 | C19 | 151.7° | 152.5° |
C55 | C17 | C18 | C60 | 82.0° | 89.6° |
C17 | C55 | C56 | H55 | 120.7° | 120.0° |
C17 | C55 | C56 | H55A | 120.7° | 120.0° |
C17 | C55 | C56 | C57 | 172.3° | 175.8° |
C55 | C17 | C18 | H18 | 37.6° | 34.4° |
C55 | C17 | C54 | H54 | 50.6° | 177.6° |
C55 | C17 | C54 | H54A | 69.4° | 57.6° |
C55 | C17 | C54 | H54B | 170.6° | 62.4° |
C17 | C55 | H55 | H55A | 117.7° | 120.0° |
C17 | C55 | C56 | H56 | 67.6° | 64.2° |
C17 | C55 | C56 | H56A | 52.2° | 55.8° |
C19 | C18 | C60 | H18 | 119.7° | 124.2° |
C18 | C19 | N24 | H19 | 116.0° | 119.1° |
C19 | C18 | C60 | C61 | 156.5° | 179.3° |
C19 | C18 | C60 | H60 | 83.3° | 60.6° |
C19 | C18 | C60 | H60A | 36.2° | 59.3° |
C60 | C18 | C19 | N24 | 155.3° | 140.2° |
C18 | C60 | C61 | H60 | 120.2° | 120.0° |
C18 | C60 | C61 | H60A | 120.3° | 120.0° |
C18 | C60 | C61 | N62 | 126.9° | 168.2° |
C18 | C60 | C61 | O63 | 54.0° | 11.9° |
C60 | C18 | C19 | H19 | 38.8° | 20.6° |
C18 | C60 | H60 | H60A | 119.3° | 120.0° |
N24 | C19 | C18 | H18 | 85.0° | 95.7° |
C1R | N1B | C2B | C8B | 173.3° | 179.8° |
N1B | C1R | C2R | O6R | 120.2° | 119.4° |
N1B | C1R | C2R | H1R | 122.1° | 121.0° |
N1B | C1R | O6R | H1R | 119.3° | 121.0° |
C1R | N1B | C2B | N3B | 173.1° | 180.0° |
N1B | C1R | C2R | C3R | 86.0° | 117.4° |
N1B | C1R | C2R | O7R | 32.5° | 1.3° |
N1B | C1R | O6R | C4R | 106.9° | 92.9° |
C1R | N1B | C8B | C7B | 11.2° | 0.1° |
C1R | N1B | C8B | C9B | 171.1° | 179.8° |
C1R | N1B | C2B | H2B | 6.9° | 0.0° |
N1B | C1R | C2R | H2R | 157.3° | 123.9° |
C2B | N1B | C1R | C2R | 109.9° | 95.0° |
C2B | N1B | C1R | O6R | 8.8° | 22.9° |
N1B | C2B | N3B | H2B | 180.0° | 180.0° |
N1B | C2B | N3B | C9B | 0.1° | 0.0° |
C2B | N1B | C8B | C7B | 177.2° | 179.7° |
C2B | N1B | C8B | C9B | 0.6° | 0.4° |
C2B | N1B | C1R | H1R | 128.6° | 144.0° |
C8B | N1B | C1R | C2R | 79.5° | 85.3° |
C8B | N1B | C1R | O6R | 161.8° | 156.9° |
C8B | N1B | C2B | N3B | 0.3° | 0.2° |
N1B | C8B | C9B | N3B | 0.6° | 0.4° |
N1B | C8B | C9B | N4B | 179.7° | 179.8° |
N1B | C8B | C7B | N6B | 178.9° | 179.2° |
N1B | C8B | C7B | N7A | 1.6° | 0.2° |
N1B | C8B | C7B | C9B | 177.7° | 179.9° |
C8B | N1B | C1R | H1R | 42.0° | 35.8° |
C8B | N1B | C2B | H2B | 179.7° | 179.8° |
C2P | C1P | N59 | H1P | 120.3° | 120.0° |
C2P | C1P | N59 | H1PA | 120.3° | 120.1° |
C2P | C1P | N59 | C57 | 117.6° | 173.5° |
C2P | C1P | H1P | H1PA | 119.1° | 120.0° |
C1P | C2P | H2P | H2PA | 119.8° | 120.0° |
C2P | C1P | N59 | HN59 | 62.4° | 6.5° |
C1P | N59 | C57 | C56 | 173.0° | 174.9° |
C1P | N59 | C57 | O58 | 6.8° | 5.2° |
C1P | N59 | C57 | HN59 | 180.0° | 179.9° |
N59 | C1P | H1P | H1PA | 119.1° | 120.0° |
N59 | C1P | C2P | H2P | 56.7° | 54.9° |
N59 | C1P | C2P | H2PA | 176.6° | 174.9° |
C2R | C1R | O6R | H1R | 116.7° | 119.5° |
C1R | C2R | C3R | O7R | 117.7° | 118.7° |
C1R | C2R | C3R | H2R | 116.6° | 118.7° |
C1R | C2R | O7R | H2R | 123.8° | 122.6° |
C1R | C2R | C3R | C4R | 37.6° | 20.9° |
C2R | C1R | O6R | C4R | 17.1° | 26.5° |
C1R | C2R | C3R | H3R | 154.5° | 97.4° |
C1R | C2R | O7R | HO7R | 180.0° | 61.4° |
O6R | C1R | C2R | C3R | 34.2° | 2.0° |
O6R | C1R | C2R | O7R | 152.7° | 120.7° |
C1R | O6R | C4R | C3R | 7.5° | 40.1° |
C1R | O6R | C4R | C5R | 115.6° | 158.6° |
O6R | C1R | C2R | H2R | 82.5° | 116.7° |
C1R | O6R | C4R | H4R | 124.7° | 78.5° |
C26 | C27 | O28 | N29 | 178.9° | 180.0° |
C27 | C26 | H26 | H26A | 116.7° | 120.0° |
C26 | C27 | N29 | HN29 | 179.0° | 0.0° |
C26 | C27 | N29 | HN2A | 1.1° | 180.0° |
O28 | C27 | C26 | H26 | 131.7° | 117.8° |
O28 | C27 | C26 | H26A | 110.4° | 122.1° |
O28 | C27 | N29 | HN29 | 0.0° | 180.0° |
O28 | C27 | N29 | HN2A | 180.0° | 0.0° |
N29 | C27 | C26 | H26 | 47.2° | 62.2° |
N29 | C27 | C26 | H26A | 70.7° | 57.9° |
C27 | N29 | HN29 | HN2A | 180.0° | 180.0° |
C2B | N3B | C9B | N4B | 179.5° | 179.9° |
C2B | N3B | C9B | C8B | 0.4° | 0.2° |
C3R | C2R | O7R | H2R | 124.9° | 122.6° |
C2R | C3R | C4R | H3R | 116.9° | 118.2° |
C2R | C3R | C4R | C5R | 90.8° | 155.5° |
C2R | C3R | C4R | O6R | 28.9° | 37.0° |
C3R | C2R | C1R | H1R | 151.9° | 121.6° |
C2R | C3R | C4R | H4R | 146.8° | 81.7° |
C3R | C2R | O7R | HO7R | 68.6° | 176.2° |
O7R | C2R | C3R | C4R | 155.3° | 97.8° |
O7R | C2R | C1R | H1R | 89.5° | 119.7° |
O7R | C2R | C3R | H3R | 87.8° | 143.9° |
C30 | C31 | C32 | H31 | 120.4° | 120.0° |
C30 | C31 | C32 | H31A | 120.4° | 120.1° |
C30 | C31 | C32 | N33 | 141.7° | 180.0° |
C30 | C31 | C32 | O34 | 37.9° | 0.1° |
C31 | C30 | C3 | H3 | 20.5° | 51.3° |
C31 | C30 | H30 | H30A | 118.2° | 120.0° |
C30 | C31 | H31 | H31A | 118.9° | 120.0° |
C31 | C32 | N33 | O34 | 179.6° | 179.9° |
C32 | C31 | C30 | H30 | 66.9° | 60.0° |
C32 | C31 | C30 | H30A | 52.0° | 59.9° |
C32 | C31 | H31 | H31A | 118.8° | 120.0° |
C31 | C32 | N33 | HN33 | 179.6° | 0.1° |
C31 | C32 | N33 | HN3A | 0.4° | 180.0° |
N33 | C32 | C31 | H31 | 97.9° | 60.0° |
N33 | C32 | C31 | H31A | 21.4° | 59.9° |
C32 | N33 | HN33 | HN3A | 180.0° | 180.0° |
O34 | C32 | C31 | H31 | 82.5° | 120.0° |
O34 | C32 | C31 | H31A | 158.2° | 120.0° |
O34 | C32 | N33 | HN33 | 0.0° | 180.0° |
O34 | C32 | N33 | HN3A | 180.0° | 0.1° |
C37 | C38 | O39 | N40 | 177.0° | 180.0° |
C38 | C37 | H37 | H37A | 118.7° | 120.1° |
C37 | C38 | N40 | HN40 | 177.0° | 0.0° |
C37 | C38 | N40 | HN4A | 3.0° | 180.0° |
O39 | C38 | C37 | H37 | 61.5° | 121.6° |
O39 | C38 | C37 | H37A | 179.4° | 118.3° |
O39 | C38 | N40 | HN40 | 0.0° | 180.0° |
O39 | C38 | N40 | HN4A | 180.0° | 0.0° |
N40 | C38 | C37 | H37 | 115.6° | 58.3° |
N40 | C38 | C37 | H37A | 3.5° | 61.7° |
C38 | N40 | HN40 | HN4A | 180.0° | 180.0° |
N3B | C9B | N4B | C5B | 178.2° | 179.9° |
N3B | C9B | N4B | C8B | 178.8° | 179.8° |
N3B | C9B | C8B | C7B | 177.5° | 179.7° |
C9B | N3B | C2B | H2B | 179.9° | 180.0° |
C3R | C4R | C5R | O6R | 117.4° | 114.1° |
C3R | C4R | C5R | H4R | 122.3° | 122.9° |
C3R | C4R | O6R | H4R | 117.1° | 118.6° |
C3R | C4R | C5R | O8R | 67.8° | 175.0° |
C4R | C3R | C2R | H2R | 79.0° | 139.6° |
C3R | C4R | C5R | H5R | 52.5° | 55.0° |
C3R | C4R | C5R | H5RA | 171.9° | 65.0° |
C41 | C42 | C43 | H42 | 120.4° | 120.0° |
C41 | C42 | C43 | H42A | 120.5° | 120.0° |
C41 | C42 | C43 | O44 | 82.7° | 0.0° |
C41 | C42 | C43 | N45 | 98.7° | 180.0° |
C42 | C41 | C8 | H8 | 65.6° | 43.2° |
C42 | C41 | H41 | H41A | 117.5° | 120.0° |
C41 | C42 | H42 | H42A | 118.6° | 120.0° |
C42 | C43 | O44 | N45 | 178.6° | 180.0° |
C43 | C42 | C41 | H41 | 36.9° | 54.7° |
C43 | C42 | C41 | H41A | 81.5° | 65.2° |
C43 | C42 | H42 | H42A | 118.6° | 120.0° |
C42 | C43 | N45 | HN45 | 178.6° | 0.0° |
C42 | C43 | N45 | HN4B | 1.4° | 180.0° |
O44 | C43 | C42 | H42 | 156.9° | 120.1° |
O44 | C43 | C42 | H42A | 37.8° | 119.9° |
O44 | C43 | N45 | HN45 | 0.0° | 180.0° |
O44 | C43 | N45 | HN4B | 180.0° | 0.0° |
N45 | C43 | C42 | H42 | 21.8° | 60.0° |
N45 | C43 | C42 | H42A | 140.9° | 60.0° |
C43 | N45 | HN45 | HN4B | 180.0° | 180.0° |
C48 | C49 | C50 | H49 | 120.6° | 120.0° |
C48 | C49 | C50 | H49A | 120.6° | 120.0° |
C48 | C49 | C50 | O51 | 7.3° | 5.9° |
C48 | C49 | C50 | N52 | 175.0° | 174.1° |
C49 | C48 | C13 | H13 | 149.0° | 51.7° |
C49 | C48 | H48 | H48A | 116.7° | 120.0° |
C48 | C49 | H49 | H49A | 118.2° | 120.0° |
C49 | C50 | O51 | N52 | 177.6° | 180.0° |
C50 | C49 | C48 | H48 | 81.1° | 62.4° |
C50 | C49 | C48 | H48A | 36.8° | 57.6° |
C50 | C49 | H49 | H49A | 118.2° | 120.0° |
C49 | C50 | N52 | HN52 | 177.7° | 4.8° |
C49 | C50 | N52 | HN5A | 2.3° | 175.1° |
N4B | C5B | N6B | H5B | 180.0° | 179.9° |
N4B | C5B | N6B | C7B | 0.7° | 0.6° |
C5B | N4B | C9B | C8B | 0.7° | 0.2° |
C9B | N4B | C5B | N6B | 0.5° | 0.0° |
N4B | C9B | C8B | C7B | 1.5° | 0.1° |
C9B | N4B | C5B | H5B | 179.5° | 180.0° |
C5R | C4R | O6R | H4R | 119.8° | 122.9° |
C4R | C5R | O8R | H5R | 120.3° | 120.0° |
C4R | C5R | O8R | H5RA | 120.3° | 120.0° |
C5R | C4R | C3R | H3R | 26.1° | 37.3° |
C4R | C5R | H5R | H5RA | 119.1° | 120.0° |
C4R | C5R | O8R | HO8R | 180.0° | 180.0° |
O6R | C4R | C5R | O8R | 174.8° | 70.9° |
C4R | O6R | C1R | H1R | 133.8° | 146.0° |
O6R | C4R | C3R | H3R | 145.8° | 81.2° |
O6R | C4R | C5R | H5R | 64.9° | 169.0° |
O6R | C4R | C5R | H5RA | 54.5° | 49.1° |
O51 | C50 | C49 | H49 | 113.3° | 126.0° |
O51 | C50 | C49 | H49A | 127.9° | 114.0° |
O51 | C50 | N52 | HN52 | 0.0° | 175.2° |
O51 | C50 | N52 | HN5A | 180.0° | 4.9° |
N52 | C50 | C49 | H49 | 64.4° | 54.0° |
N52 | C50 | C49 | H49A | 54.4° | 66.0° |
C50 | N52 | HN52 | HN5A | 180.0° | 179.9° |
C55 | C56 | C57 | H56 | 120.1° | 120.0° |
C55 | C56 | C57 | H56A | 120.1° | 120.0° |
C55 | C56 | C57 | O58 | 39.3° | 7.0° |
C55 | C56 | C57 | N59 | 140.5° | 172.9° |
C56 | C55 | H55 | H55A | 117.8° | 120.0° |
C55 | C56 | H56 | H56A | 119.7° | 120.0° |
C56 | C57 | O58 | N59 | 179.8° | 179.9° |
C57 | C56 | C55 | H55 | 51.6° | 55.8° |
C57 | C56 | C55 | H55A | 67.0° | 64.2° |
C57 | C56 | H56 | H56A | 119.7° | 120.0° |
C56 | C57 | N59 | HN59 | 7.0° | 5.0° |
O58 | C57 | C56 | H56 | 80.8° | 127.0° |
O58 | C57 | C56 | H56A | 159.4° | 113.0° |
O58 | C57 | N59 | HN59 | 173.2° | 174.8° |
C57 | N59 | C1P | H1P | 2.7° | 53.6° |
C57 | N59 | C1P | H1PA | 122.1° | 66.4° |
N59 | C57 | C56 | H56 | 99.4° | 52.8° |
N59 | C57 | C56 | H56A | 20.4° | 67.1° |
C5B | N6B | C7B | N7A | 177.2° | 179.9° |
C5B | N6B | C7B | C8B | 0.3° | 1.0° |
O8R | C5R | C4R | H4R | 54.5° | 52.1° |
O8R | C5R | H5R | H5RA | 119.1° | 120.0° |
C60 | C61 | N62 | O63 | 179.0° | 179.9° |
C61 | C60 | C18 | H18 | 36.7° | 55.2° |
C61 | C60 | H60 | H60A | 119.3° | 120.0° |
C60 | C61 | N62 | HN62 | 179.1° | 0.0° |
C60 | C61 | N62 | HN6A | 0.9° | 180.0° |
N62 | C61 | C60 | H60 | 6.7° | 48.1° |
N62 | C61 | C60 | H60A | 112.8° | 71.9° |
C61 | N62 | HN62 | HN6A | 180.0° | 180.0° |
O63 | C61 | C60 | H60 | 174.2° | 131.9° |
O63 | C61 | C60 | H60A | 66.2° | 108.1° |
O63 | C61 | N62 | HN62 | 0.0° | 180.0° |
O63 | C61 | N62 | HN6A | 180.0° | 0.1° |
N6B | C7B | N7A | C8B | 177.3° | 178.9° |
N6B | C7B | C8B | C9B | 1.2° | 0.7° |
C7B | N6B | C5B | H5B | 179.3° | 179.3° |
N6B | C7B | N7A | HN7A | 0.0° | 0.0° |
N6B | C7B | N7A | HN7B | 120.0° | 180.0° |
N7A | C7B | C8B | C9B | 176.1° | 179.7° |
C7B | N7A | HN7A | HN7B | 120.0° | 180.0° |
C8B | C7B | N7A | HN7A | 177.3° | 178.9° |
C8B | C7B | N7A | HN7B | 62.7° | 1.1° |
H3 | C3 | C30 | H30 | 100.0° | 171.2° |
H3 | C3 | C30 | H30A | 141.1° | 68.8° |
H8 | C8 | C41 | H41 | 173.6° | 163.2° |
H8 | C8 | C41 | H41A | 55.2° | 76.8° |
H13 | C13 | C48 | H48 | 89.9° | 171.7° |
H13 | C13 | C48 | H48A | 28.0° | 68.3° |
H18 | C18 | C19 | H19 | 158.5° | 144.7° |
H18 | C18 | C60 | H60 | 157.0° | 175.2° |
H18 | C18 | C60 | H60A | 83.5° | 64.8° |
H1P | C1P | C2P | H2P | 63.6° | 65.1° |
H1P | C1P | C2P | H2PA | 56.3° | 54.9° |
H1P | C1P | N59 | HN59 | 177.3° | 126.5° |
H1PA | C1P | C2P | H2P | 177.0° | 174.9° |
H1PA | C1P | C2P | H2PA | 63.2° | 65.1° |
H1PA | C1P | N59 | HN59 | 57.9° | 113.5° |
H1R | C1R | C2R | H2R | 35.2° | 2.9° |
H20 | C20 | H20A | H20B | 120.0° | 120.0° |
H25 | C25 | H25A | H25B | 120.0° | 120.0° |
H2R | C2R | C3R | H3R | 37.9° | 21.4° |
H2R | C2R | O7R | HO7R | 56.2° | 61.2° |
H30 | C30 | C31 | H31 | 172.7° | 180.0° |
H30 | C30 | C31 | H31A | 53.4° | 60.0° |
H30A | C30 | C31 | H31 | 68.4° | 60.0° |
H30A | C30 | C31 | H31A | 172.3° | 180.0° |
H35 | C35 | H35A | H35B | 120.0° | 120.0° |
H36 | C36 | H36A | H36B | 120.0° | 120.0° |
H3R | C3R | C4R | H4R | 96.3° | 160.1° |
H41 | C41 | C42 | H42 | 157.3° | 174.8° |
H41 | C41 | C42 | H42A | 83.6° | 65.2° |
H41A | C41 | C42 | H42 | 38.9° | 54.8° |
H41A | C41 | C42 | H42A | 158.1° | 174.8° |
H46 | C46 | H46A | H46B | 120.0° | 120.0° |
H47 | C47 | H47A | H47B | 120.0° | 120.0° |
H48 | C48 | C49 | H49 | 158.3° | 177.6° |
H48 | C48 | C49 | H49A | 39.5° | 57.6° |
H48A | C48 | C49 | H49 | 83.8° | 62.4° |
H48A | C48 | C49 | H49A | 157.4° | 177.6° |
H4R | C4R | C5R | H5R | 174.8° | 67.9° |
H4R | C4R | C5R | H5RA | 65.8° | 172.1° |
H53 | C53 | H53A | H53B | 120.0° | 120.0° |
H54 | C54 | H54A | H54B | 120.0° | 120.0° |
H55 | C55 | C56 | H56 | 171.7° | 175.8° |
H55 | C55 | C56 | H56A | 68.5° | 64.1° |
H55A | C55 | C56 | H56 | 53.1° | 55.8° |
H55A | C55 | C56 | H56A | 172.9° | 175.8° |
H5R | C5R | O8R | HO8R | 59.7° | 60.0° |
H5RA | C5R | O8R | HO8R | 59.7° | 60.0° |