KHK
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O76 | N74 | doub | 0.00Å | 1.19Å | |
O75 | N74 | doub | 0.00Å | 1.32Å | |
N74 | C01 | sing | 0.00Å | 1.44Å | |
C01 | C02 | doub | 0.00Å | 1.41Å | Aromatic |
C01 | C04 | sing | 0.00Å | 1.42Å | Aromatic |
C02 | C03 | sing | 0.00Å | 1.40Å | Aromatic |
C04 | C05 | doub | 0.00Å | 1.40Å | Aromatic |
C03 | C06 | doub | 0.00Å | 1.40Å | Aromatic |
C05 | C06 | sing | 0.00Å | 1.44Å | Aromatic |
C05 | N07 | sing | 0.00Å | 1.31Å | Aromatic |
C06 | N10 | sing | 0.00Å | 1.30Å | Aromatic |
N07 | C08 | doub | 0.00Å | 1.35Å | Aromatic |
C41 | C40 | doub | 0.00Å | 1.44Å | Aromatic |
C41 | C42 | sing | 0.00Å | 1.29Å | Aromatic |
C40 | C39 | sing | 0.00Å | 1.35Å | Aromatic |
N10 | C09 | doub | 0.00Å | 1.35Å | Aromatic |
C08 | C09 | sing | 0.00Å | 1.43Å | Aromatic |
C08 | C11 | sing | 0.00Å | 1.40Å | Aromatic |
C09 | C18 | sing | 0.00Å | 1.39Å | Aromatic |
C42 | C44 | doub | 0.00Å | 1.48Å | Aromatic |
C42 | C43 | sing | 0.00Å | 1.44Å | Aromatic |
C39 | N38 | doub | 0.00Å | 1.41Å | Aromatic |
C44 | C45 | sing | 0.00Å | 1.37Å | Aromatic |
C12 | C11 | doub | 0.00Å | 1.36Å | Aromatic |
C12 | C13 | sing | 0.00Å | 1.50Å | Aromatic |
C11 | C16 | sing | 0.00Å | 1.38Å | Aromatic |
C18 | C23 | doub | 0.00Å | 1.36Å | Aromatic |
C18 | C17 | sing | 0.00Å | 1.37Å | Aromatic |
C13 | C14 | doub | 0.00Å | 1.34Å | Aromatic |
C23 | C22 | sing | 0.00Å | 1.49Å | Aromatic |
C43 | N38 | sing | 0.00Å | 1.39Å | Aromatic |
C43 | C47 | doub | 0.00Å | 1.33Å | Aromatic |
C45 | C46 | doub | 0.00Å | 1.48Å | Aromatic |
N38 | RU19 | sing | 0.00Å | 1.99Å | |
C16 | C17 | sing | 0.00Å | 1.40Å | Aromatic |
C16 | N15 | doub | 0.00Å | 1.40Å | Aromatic |
C17 | N20 | doub | 0.00Å | 1.39Å | Aromatic |
C14 | N15 | sing | 0.00Å | 1.41Å | Aromatic |
N15 | RU19 | sing | 0.00Å | 2.00Å | |
C22 | C21 | doub | 0.00Å | 1.35Å | Aromatic |
C47 | C46 | sing | 0.00Å | 1.44Å | Aromatic |
C47 | N48 | sing | 0.00Å | 1.38Å | Aromatic |
N20 | C21 | sing | 0.00Å | 1.41Å | Aromatic |
N20 | RU19 | sing | 0.00Å | 2.01Å | |
C46 | C49 | sing | 0.00Å | 1.30Å | Aromatic |
RU19 | N48 | sing | 0.00Å | 2.01Å | |
RU19 | N24 | sing | 0.00Å | 2.01Å | |
RU19 | N37 | sing | 0.00Å | 1.99Å | |
C25 | N24 | doub | 0.00Å | 1.41Å | Aromatic |
C25 | C26 | sing | 0.00Å | 1.35Å | Aromatic |
N48 | C51 | doub | 0.00Å | 1.41Å | Aromatic |
C49 | C50 | doub | 0.00Å | 1.44Å | Aromatic |
N24 | C28 | sing | 0.00Å | 1.38Å | Aromatic |
C26 | C27 | doub | 0.00Å | 1.44Å | Aromatic |
C51 | C50 | sing | 0.00Å | 1.35Å | Aromatic |
N37 | C35 | doub | 0.00Å | 1.41Å | Aromatic |
N37 | C36 | sing | 0.00Å | 1.38Å | Aromatic |
C35 | C34 | sing | 0.00Å | 1.34Å | Aromatic |
C28 | C36 | doub | 0.00Å | 1.35Å | Aromatic |
C28 | C29 | sing | 0.00Å | 1.43Å | Aromatic |
C27 | C29 | sing | 0.00Å | 1.31Å | Aromatic |
C36 | C32 | sing | 0.00Å | 1.43Å | Aromatic |
C29 | C30 | doub | 0.00Å | 1.49Å | Aromatic |
C34 | C33 | doub | 0.00Å | 1.44Å | Aromatic |
C32 | C33 | sing | 0.00Å | 1.30Å | Aromatic |
C32 | C31 | doub | 0.00Å | 1.48Å | Aromatic |
C30 | C31 | sing | 0.00Å | 1.37Å | Aromatic |
C13 | H55 | sing | 0.00Å | 1.08Å | |
C22 | H79 | sing | 0.00Å | 1.08Å | |
C26 | H59 | sing | 0.00Å | 1.08Å | |
C14 | H56 | sing | 0.00Å | 1.08Å | |
C41 | H68 | sing | 0.00Å | 1.08Å | |
C23 | H57 | sing | 0.00Å | 1.08Å | |
C25 | H58 | sing | 0.00Å | 1.08Å | |
C02 | H52 | sing | 0.00Å | 1.08Å | |
C03 | H53 | sing | 0.00Å | 1.08Å | |
C04 | H77 | sing | 0.00Å | 1.08Å | |
C12 | H54 | sing | 0.00Å | 1.08Å | |
C21 | H78 | sing | 0.00Å | 1.08Å | |
C27 | H60 | sing | 0.00Å | 1.08Å | |
C30 | H61 | sing | 0.00Å | 1.08Å | |
C31 | H62 | sing | 0.00Å | 1.08Å | |
C33 | H63 | sing | 0.00Å | 1.08Å | |
C34 | H64 | sing | 0.00Å | 1.08Å | |
C35 | H65 | sing | 0.00Å | 1.08Å | |
C39 | H66 | sing | 0.00Å | 1.08Å | |
C40 | H67 | sing | 0.00Å | 1.08Å | |
C44 | H69 | sing | 0.00Å | 1.08Å | |
C45 | H70 | sing | 0.00Å | 1.08Å | |
C49 | H71 | sing | 0.00Å | 1.08Å | |
C50 | H72 | sing | 0.00Å | 1.08Å | |
C51 | H73 | sing | 0.00Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O76 | N74 | O75 | 118.5° | 90.0° |
O76 | N74 | C01 | 120.4° | 90.0° |
O75 | N74 | C01 | 121.1° | 90.0° |
N74 | C01 | C02 | 120.3° | 90.0° |
N74 | C01 | C04 | 121.0° | 90.0° |
C02 | C01 | C04 | 118.7° | 90.0° |
C01 | C02 | C03 | 121.0° | 90.0° |
C01 | C02 | H52 | 119.5° | 90.0° |
C01 | C04 | C05 | 121.1° | 90.0° |
C01 | C04 | H77 | 119.4° | 90.0° |
C02 | C03 | C06 | 120.7° | 90.0° |
C03 | C02 | H52 | 119.5° | 90.0° |
C02 | C03 | H53 | 119.7° | 90.0° |
C04 | C05 | C06 | 119.2° | 90.0° |
C04 | C05 | N07 | 120.9° | 90.0° |
C05 | C04 | H77 | 119.4° | 90.0° |
C03 | C06 | C05 | 119.3° | 90.0° |
C03 | C06 | N10 | 119.6° | 90.0° |
C06 | C03 | H53 | 119.7° | 90.0° |
C06 | C05 | N07 | 119.9° | 90.0° |
C05 | C06 | N10 | 121.1° | 90.0° |
C05 | N07 | C08 | 120.4° | 90.0° |
C06 | N10 | C09 | 119.5° | 90.0° |
N07 | C08 | C09 | 119.1° | 90.0° |
N07 | C08 | C11 | 120.2° | 90.0° |
C40 | C41 | C42 | 121.5° | 90.0° |
C41 | C40 | C39 | 121.2° | 90.0° |
C40 | C41 | H68 | 119.2° | 90.0° |
C41 | C40 | H67 | 119.4° | 90.0° |
C41 | C42 | C44 | 124.0° | 90.0° |
C41 | C42 | C43 | 119.5° | 90.0° |
C42 | C41 | H68 | 119.3° | 90.0° |
C40 | C39 | N38 | 117.8° | 90.0° |
C40 | C39 | H66 | 121.1° | 90.0° |
C39 | C40 | H67 | 119.4° | 90.0° |
N10 | C09 | C08 | 120.0° | 90.0° |
N10 | C09 | C18 | 118.8° | 90.0° |
C09 | C08 | C11 | 120.7° | 90.0° |
C08 | C09 | C18 | 121.2° | 90.0° |
C08 | C11 | C12 | 124.3° | 90.0° |
C08 | C11 | C16 | 116.9° | 90.0° |
C09 | C18 | C23 | 123.6° | 90.0° |
C09 | C18 | C17 | 117.1° | 90.0° |
C44 | C42 | C43 | 116.5° | 90.0° |
C42 | C44 | C45 | 121.0° | 90.0° |
C42 | C44 | H69 | 119.5° | 90.0° |
C42 | C43 | N38 | 118.9° | 90.0° |
C42 | C43 | C47 | 122.6° | 90.0° |
C39 | N38 | C43 | 121.1° | 90.0° |
C39 | N38 | RU19 | 129.4° | 90.0° |
N38 | C39 | H66 | 121.1° | 90.0° |
C44 | C45 | C46 | 120.7° | 90.0° |
C45 | C44 | H69 | 119.5° | 90.0° |
C44 | C45 | H70 | 119.7° | 90.0° |
C11 | C12 | C13 | 121.3° | 90.0° |
C12 | C11 | C16 | 118.9° | 90.0° |
C11 | C12 | H54 | 119.4° | 90.0° |
C12 | C13 | C14 | 119.1° | 90.0° |
C12 | C13 | H55 | 120.5° | 90.0° |
C13 | C12 | H54 | 119.4° | 90.0° |
C11 | C16 | C17 | 122.1° | 90.0° |
C11 | C16 | N15 | 119.9° | 90.0° |
C23 | C18 | C17 | 119.4° | 90.0° |
C18 | C23 | C22 | 121.1° | 90.0° |
C18 | C23 | H57 | 119.5° | 90.0° |
C18 | C17 | C16 | 122.1° | 90.0° |
C18 | C17 | N20 | 119.4° | 90.0° |
C13 | C14 | N15 | 117.8° | 90.0° |
C14 | C13 | H55 | 120.4° | 90.0° |
C13 | C14 | H56 | 121.1° | 90.0° |
C23 | C22 | C21 | 118.8° | 90.0° |
C23 | C22 | H79 | 120.6° | 90.0° |
C22 | C23 | H57 | 119.4° | 90.0° |
N38 | C43 | C47 | 118.5° | 90.0° |
C43 | N38 | RU19 | 109.5° | 90.0° |
C43 | C47 | C46 | 122.6° | 90.0° |
C43 | C47 | N48 | 119.4° | 90.0° |
C45 | C46 | C47 | 116.6° | 90.0° |
C45 | C46 | C49 | 124.0° | 90.0° |
C46 | C45 | H70 | 119.7° | 90.0° |
N38 | RU19 | N15 | 86.1° | 90.0° |
N38 | RU19 | N20 | 92.3° | 90.0° |
N38 | RU19 | N48 | 83.8° | 90.0° |
N38 | RU19 | N24 | 90.2° | 90.0° |
N38 | RU19 | N37 | 173.4° | 90.0° |
C17 | C16 | N15 | 118.0° | 90.0° |
C16 | C17 | N20 | 118.4° | 90.0° |
C16 | N15 | C14 | 123.1° | 90.0° |
C16 | N15 | RU19 | 109.0° | 90.0° |
C17 | N20 | C21 | 123.3° | 90.0° |
C17 | N20 | RU19 | 108.7° | 90.0° |
C14 | N15 | RU19 | 127.6° | 90.0° |
N15 | C14 | H56 | 121.1° | 90.0° |
N15 | RU19 | N20 | 85.4° | 90.0° |
N15 | RU19 | N48 | 90.9° | 90.0° |
N15 | RU19 | N24 | 176.3° | 90.0° |
N15 | RU19 | N37 | 98.4° | 90.0° |
C22 | C21 | N20 | 117.9° | 90.0° |
C21 | C22 | H79 | 120.6° | 90.0° |
C22 | C21 | H78 | 121.1° | 90.0° |
C46 | C47 | N48 | 118.0° | 90.0° |
C47 | C46 | C49 | 119.3° | 90.0° |
C47 | N48 | RU19 | 108.8° | 90.0° |
C47 | N48 | C51 | 122.7° | 90.0° |
C21 | N20 | RU19 | 127.7° | 90.0° |
N20 | C21 | H78 | 121.0° | 90.0° |
N20 | RU19 | N48 | 174.8° | 90.0° |
N20 | RU19 | N24 | 94.2° | 90.0° |
N20 | RU19 | N37 | 92.8° | 90.0° |
C46 | C49 | C50 | 122.2° | 90.0° |
C46 | C49 | H71 | 118.9° | 90.0° |
N48 | RU19 | N24 | 89.2° | 90.0° |
N48 | RU19 | N37 | 91.4° | 90.0° |
RU19 | N48 | C51 | 128.4° | 90.0° |
N24 | RU19 | N37 | 85.2° | 90.0° |
RU19 | N24 | C25 | 130.1° | 90.0° |
RU19 | N24 | C28 | 107.8° | 90.0° |
RU19 | N37 | C35 | 128.1° | 90.0° |
RU19 | N37 | C36 | 107.8° | 90.0° |
N24 | C25 | C26 | 117.7° | 90.0° |
C25 | N24 | C28 | 122.1° | 90.0° |
N24 | C25 | H58 | 121.1° | 90.0° |
C25 | C26 | C27 | 120.4° | 90.0° |
C25 | C26 | H59 | 119.8° | 90.0° |
C26 | C25 | H58 | 121.2° | 90.0° |
N48 | C51 | C50 | 117.4° | 90.0° |
N48 | C51 | H73 | 121.3° | 90.0° |
C49 | C50 | C51 | 120.4° | 90.0° |
C50 | C49 | H71 | 118.9° | 90.0° |
C49 | C50 | H72 | 119.8° | 90.0° |
N24 | C28 | C36 | 118.9° | 90.0° |
N24 | C28 | C29 | 118.6° | 90.0° |
C26 | C27 | C29 | 121.7° | 90.0° |
C27 | C26 | H59 | 119.8° | 90.0° |
C26 | C27 | H60 | 119.1° | 90.0° |
C51 | C50 | H72 | 119.8° | 90.0° |
C50 | C51 | H73 | 121.3° | 90.0° |
C35 | N37 | C36 | 124.0° | 90.0° |
N37 | C35 | C34 | 116.4° | 90.0° |
N37 | C35 | H65 | 121.8° | 90.0° |
N37 | C36 | C28 | 120.3° | 90.0° |
N37 | C36 | C32 | 117.1° | 90.0° |
C35 | C34 | C33 | 120.6° | 90.0° |
C35 | C34 | H64 | 119.7° | 90.0° |
C34 | C35 | H65 | 121.8° | 90.0° |
C36 | C28 | C29 | 122.5° | 90.0° |
C28 | C36 | C32 | 122.6° | 90.0° |
C28 | C29 | C27 | 119.4° | 90.0° |
C28 | C29 | C30 | 116.5° | 90.0° |
C27 | C29 | C30 | 124.1° | 90.0° |
C29 | C27 | H60 | 119.1° | 90.0° |
C36 | C32 | C33 | 119.3° | 90.0° |
C36 | C32 | C31 | 116.6° | 90.0° |
C29 | C30 | C31 | 120.8° | 90.0° |
C29 | C30 | H61 | 119.6° | 90.0° |
C34 | C33 | C32 | 122.5° | 90.0° |
C34 | C33 | H63 | 118.7° | 90.0° |
C33 | C34 | H64 | 119.7° | 90.0° |
C33 | C32 | C31 | 124.1° | 90.0° |
C32 | C33 | H63 | 118.7° | 90.0° |
C32 | C31 | C30 | 120.9° | 90.0° |
C32 | C31 | H62 | 119.5° | 90.0° |
C31 | C30 | H61 | 119.6° | 90.0° |
C30 | C31 | H62 | 119.5° | 90.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O76 | N74 | O75 | C01 | 179.0° | 90.0° |
O76 | N74 | C01 | C02 | 144.9° | 90.0° |
O76 | N74 | C01 | C04 | 34.6° | 90.0° |
O75 | N74 | C01 | C02 | 34.1° | 90.0° |
O75 | N74 | C01 | C04 | 146.4° | 90.0° |
N74 | C01 | C02 | C04 | 179.5° | 90.0° |
N74 | C01 | C02 | C03 | 179.8° | 90.0° |
N74 | C01 | C04 | C05 | 179.9° | 90.0° |
N74 | C01 | C02 | H52 | 0.2° | 90.0° |
N74 | C01 | C04 | H77 | 0.1° | 90.0° |
C01 | C02 | C03 | H52 | 180.0° | 90.0° |
C02 | C01 | C04 | C05 | 0.6° | 90.0° |
C01 | C02 | C03 | C06 | 0.1° | 90.0° |
C01 | C02 | C03 | H53 | 179.9° | 90.0° |
C02 | C01 | C04 | H77 | 179.4° | 90.0° |
C04 | C01 | C02 | C03 | 0.3° | 90.0° |
C01 | C04 | C05 | H77 | 180.0° | 90.0° |
C01 | C04 | C05 | C06 | 0.7° | 90.0° |
C01 | C04 | C05 | N07 | 180.0° | 90.0° |
C04 | C01 | C02 | H52 | 179.7° | 90.0° |
C02 | C03 | C06 | H53 | 180.0° | 90.0° |
C02 | C03 | C06 | C05 | 0.1° | 90.0° |
C02 | C03 | C06 | N10 | 180.0° | 90.0° |
C04 | C05 | C06 | C03 | 0.4° | 90.0° |
C04 | C05 | C06 | N07 | 179.3° | 90.0° |
C04 | C05 | C06 | N10 | 179.7° | 90.0° |
C04 | C05 | N07 | C08 | 179.8° | 90.0° |
C03 | C06 | C05 | N10 | 179.9° | 90.0° |
C03 | C06 | C05 | N07 | 179.7° | 90.0° |
C03 | C06 | N10 | C09 | 179.9° | 90.0° |
C06 | C03 | C02 | H52 | 179.9° | 90.0° |
C06 | C05 | N07 | C08 | 0.5° | 90.0° |
C05 | C06 | N10 | C09 | 0.0° | 90.0° |
C05 | C06 | C03 | H53 | 179.9° | 90.0° |
C06 | C05 | C04 | H77 | 179.3° | 90.0° |
N07 | C05 | C06 | N10 | 0.3° | 90.0° |
C05 | N07 | C08 | C09 | 0.4° | 90.0° |
C05 | N07 | C08 | C11 | 179.3° | 90.0° |
N07 | C05 | C04 | H77 | 0.0° | 90.0° |
C06 | N10 | C09 | C08 | 0.1° | 90.0° |
C06 | N10 | C09 | C18 | 180.0° | 90.0° |
N10 | C06 | C03 | H53 | 0.0° | 90.0° |
N07 | C08 | C09 | N10 | 0.0° | 90.0° |
N07 | C08 | C09 | C11 | 179.7° | 90.0° |
N07 | C08 | C09 | C18 | 179.8° | 90.0° |
N07 | C08 | C11 | C12 | 0.4° | 90.0° |
N07 | C08 | C11 | C16 | 179.8° | 90.0° |
C40 | C41 | C42 | H68 | 180.0° | 90.0° |
C41 | C40 | C39 | H67 | 180.0° | 90.0° |
C40 | C41 | C42 | C44 | 179.9° | 90.0° |
C40 | C41 | C42 | C43 | 0.4° | 90.0° |
C41 | C40 | C39 | N38 | 0.5° | 90.0° |
C41 | C40 | C39 | H66 | 179.4° | 90.0° |
C42 | C41 | C40 | C39 | 0.3° | 90.0° |
C41 | C42 | C44 | C43 | 179.5° | 90.0° |
C41 | C42 | C44 | C45 | 179.9° | 90.0° |
C41 | C42 | C43 | N38 | 0.7° | 90.0° |
C41 | C42 | C43 | C47 | 179.9° | 90.0° |
C42 | C41 | C40 | H67 | 179.7° | 90.0° |
C41 | C42 | C44 | H69 | 0.1° | 90.0° |
C40 | C39 | N38 | H66 | 180.0° | 90.0° |
C40 | C39 | N38 | C43 | 0.9° | 90.0° |
C40 | C39 | N38 | RU19 | 179.2° | 90.0° |
C39 | C40 | C41 | H68 | 179.7° | 90.0° |
N10 | C09 | C08 | C18 | 179.8° | 90.0° |
N10 | C09 | C08 | C11 | 179.7° | 90.0° |
N10 | C09 | C18 | C23 | 0.0° | 90.0° |
N10 | C09 | C18 | C17 | 180.0° | 90.0° |
C09 | C08 | C11 | C12 | 179.9° | 90.0° |
C09 | C08 | C11 | C16 | 0.5° | 90.0° |
C08 | C09 | C18 | C23 | 179.8° | 90.0° |
C08 | C09 | C18 | C17 | 0.2° | 90.0° |
C11 | C08 | C09 | C18 | 0.5° | 90.0° |
C08 | C11 | C12 | C16 | 179.4° | 90.0° |
C08 | C11 | C12 | C13 | 179.7° | 90.0° |
C08 | C11 | C16 | C17 | 0.2° | 90.0° |
C08 | C11 | C16 | N15 | 179.7° | 90.0° |
C08 | C11 | C12 | H54 | 0.3° | 90.0° |
C09 | C18 | C23 | C17 | 180.0° | 90.0° |
C09 | C18 | C23 | C22 | 179.9° | 90.0° |
C09 | C18 | C17 | C16 | 0.1° | 90.0° |
C09 | C18 | C17 | N20 | 179.3° | 90.0° |
C09 | C18 | C23 | H57 | 0.2° | 90.0° |
C42 | C44 | C45 | H69 | 180.0° | 90.0° |
C44 | C42 | C43 | N38 | 179.7° | 90.0° |
C44 | C42 | C43 | C47 | 0.3° | 90.0° |
C42 | C44 | C45 | C46 | 0.3° | 90.0° |
C44 | C42 | C41 | H68 | 0.1° | 90.0° |
C42 | C44 | C45 | H70 | 179.7° | 90.0° |
C42 | C43 | N38 | C39 | 1.0° | 90.0° |
C43 | C42 | C44 | C45 | 0.4° | 90.0° |
C42 | C43 | N38 | C47 | 179.4° | 90.0° |
C42 | C43 | N38 | RU19 | 179.1° | 90.0° |
C42 | C43 | C47 | C46 | 0.1° | 90.0° |
C42 | C43 | C47 | N48 | 178.6° | 90.0° |
C43 | C42 | C41 | H68 | 179.6° | 90.0° |
C43 | C42 | C44 | H69 | 179.6° | 90.0° |
C39 | N38 | C43 | RU19 | 179.9° | 90.0° |
C39 | N38 | C43 | C47 | 179.6° | 90.0° |
C39 | N38 | RU19 | N15 | 88.6° | 90.0° |
C39 | N38 | RU19 | N20 | 3.4° | 90.0° |
C39 | N38 | RU19 | N48 | 180.0° | 90.0° |
C39 | N38 | RU19 | N24 | 90.9° | 90.0° |
C39 | N38 | RU19 | N37 | 137.0° | 90.0° |
N38 | C39 | C40 | H67 | 179.5° | 90.0° |
C44 | C45 | C46 | H70 | 180.0° | 90.0° |
C44 | C45 | C46 | C47 | 0.1° | 90.0° |
C44 | C45 | C46 | C49 | 179.2° | 90.0° |
C11 | C12 | C13 | H54 | 180.0° | 90.0° |
C11 | C12 | C13 | C14 | 0.5° | 90.0° |
C12 | C11 | C16 | C17 | 179.6° | 90.0° |
C12 | C11 | C16 | N15 | 0.9° | 90.0° |
C11 | C12 | C13 | H55 | 179.5° | 90.0° |
C13 | C12 | C11 | C16 | 0.3° | 90.0° |
C12 | C13 | C14 | H55 | 180.0° | 90.0° |
C12 | C13 | C14 | N15 | 1.2° | 90.0° |
C12 | C13 | C14 | H56 | 178.8° | 90.0° |
C11 | C16 | C17 | C18 | 0.0° | 90.0° |
C11 | C16 | C17 | N15 | 179.4° | 90.0° |
C11 | C16 | C17 | N20 | 179.3° | 90.0° |
C11 | C16 | N15 | C14 | 1.7° | 90.0° |
C11 | C16 | N15 | RU19 | 176.0° | 90.0° |
C16 | C11 | C12 | H54 | 179.7° | 90.0° |
C18 | C23 | C22 | H57 | 180.0° | 90.0° |
C23 | C18 | C17 | C16 | 179.9° | 90.0° |
C23 | C18 | C17 | N20 | 0.7° | 90.0° |
C18 | C23 | C22 | C21 | 0.2° | 90.0° |
C18 | C23 | C22 | H79 | 179.8° | 90.0° |
C17 | C18 | C23 | C22 | 0.1° | 90.0° |
C18 | C17 | C16 | N20 | 179.2° | 90.0° |
C18 | C17 | C16 | N15 | 179.4° | 90.0° |
C18 | C17 | N20 | C21 | 1.4° | 90.0° |
C18 | C17 | N20 | RU19 | 176.0° | 90.0° |
C17 | C18 | C23 | H57 | 179.9° | 90.0° |
C13 | C14 | N15 | C16 | 1.9° | 90.0° |
C13 | C14 | N15 | H56 | 180.0° | 90.0° |
C13 | C14 | N15 | RU19 | 175.1° | 90.0° |
C14 | C13 | C12 | H54 | 179.5° | 90.0° |
C23 | C22 | C21 | H79 | 180.0° | 90.0° |
C23 | C22 | C21 | N20 | 0.8° | 90.0° |
C23 | C22 | C21 | H78 | 179.2° | 90.0° |
C43 | N38 | RU19 | N15 | 91.3° | 90.0° |
N38 | C43 | C47 | C46 | 179.5° | 90.0° |
N38 | C43 | C47 | N48 | 0.8° | 90.0° |
C43 | N38 | RU19 | N20 | 176.6° | 90.0° |
C43 | N38 | RU19 | N48 | 0.0° | 90.0° |
C43 | N38 | RU19 | N24 | 89.2° | 90.0° |
C43 | N38 | RU19 | N37 | 43.1° | 90.0° |
C43 | N38 | C39 | H66 | 179.1° | 90.0° |
C43 | C47 | C46 | C45 | 0.1° | 90.0° |
C47 | C43 | N38 | RU19 | 0.4° | 90.0° |
C43 | C47 | C46 | N48 | 178.7° | 90.0° |
C43 | C47 | C46 | C49 | 179.4° | 90.0° |
C43 | C47 | N48 | RU19 | 0.8° | 90.0° |
C43 | C47 | N48 | C51 | 178.7° | 90.0° |
C45 | C46 | C47 | C49 | 179.3° | 90.0° |
C45 | C46 | C47 | N48 | 178.8° | 90.0° |
C45 | C46 | C49 | C50 | 179.8° | 90.0° |
C46 | C45 | C44 | H69 | 179.7° | 90.0° |
C45 | C46 | C49 | H71 | 0.1° | 90.0° |
N38 | RU19 | N15 | C16 | 87.1° | 90.0° |
N38 | RU19 | N20 | C17 | 80.3° | 90.0° |
N38 | RU19 | N15 | C14 | 86.9° | 90.0° |
N38 | RU19 | N15 | N20 | 92.6° | 90.0° |
N38 | RU19 | N15 | N48 | 83.7° | 90.0° |
N38 | RU19 | N15 | N24 | 7.6° | 90.0° |
N38 | RU19 | N15 | N37 | 175.3° | 90.0° |
N38 | RU19 | N48 | C47 | 0.4° | 90.0° |
N38 | RU19 | N20 | C21 | 93.9° | 90.0° |
N38 | RU19 | N20 | N48 | 40.7° | 90.0° |
N38 | RU19 | N20 | N24 | 90.4° | 90.0° |
N38 | RU19 | N20 | N37 | 175.8° | 90.0° |
N38 | RU19 | N48 | N24 | 90.3° | 90.0° |
N38 | RU19 | N48 | N37 | 175.5° | 90.0° |
N38 | RU19 | N24 | N37 | 175.3° | 90.0° |
N38 | RU19 | N24 | C25 | 4.4° | 90.0° |
N38 | RU19 | N48 | C51 | 178.2° | 90.0° |
N38 | RU19 | N24 | C28 | 173.5° | 90.0° |
N38 | RU19 | N37 | C35 | 133.1° | 90.0° |
N38 | RU19 | N37 | C36 | 44.7° | 90.0° |
RU19 | N38 | C39 | H66 | 0.8° | 90.0° |
C17 | C16 | N15 | C14 | 178.8° | 90.0° |
C17 | C16 | N15 | RU19 | 4.5° | 90.0° |
C16 | C17 | N20 | C21 | 179.3° | 90.0° |
C16 | C17 | N20 | RU19 | 4.8° | 90.0° |
N15 | C16 | C17 | N20 | 0.2° | 90.0° |
C16 | N15 | C14 | RU19 | 173.2° | 90.0° |
C16 | N15 | RU19 | N20 | 5.5° | 90.0° |
C16 | N15 | RU19 | N48 | 170.8° | 90.0° |
C16 | N15 | RU19 | N24 | 79.5° | 90.0° |
C16 | N15 | RU19 | N37 | 97.7° | 90.0° |
C16 | N15 | C14 | H56 | 178.1° | 90.0° |
C17 | N20 | RU19 | N15 | 5.6° | 90.0° |
C17 | N20 | C21 | C22 | 1.5° | 90.0° |
C17 | N20 | C21 | RU19 | 173.5° | 90.0° |
C17 | N20 | RU19 | N48 | 39.7° | 90.0° |
C17 | N20 | RU19 | N24 | 170.7° | 90.0° |
C17 | N20 | RU19 | N37 | 103.8° | 90.0° |
C17 | N20 | C21 | H78 | 178.5° | 90.0° |
C14 | N15 | RU19 | N20 | 179.5° | 90.0° |
C14 | N15 | RU19 | N48 | 3.1° | 90.0° |
C14 | N15 | RU19 | N24 | 94.5° | 90.0° |
C14 | N15 | RU19 | N37 | 88.4° | 90.0° |
N15 | C14 | C13 | H55 | 178.8° | 90.0° |
N15 | RU19 | N48 | C47 | 85.6° | 90.0° |
N15 | RU19 | N20 | C21 | 179.9° | 90.0° |
N15 | RU19 | N20 | N48 | 45.3° | 90.0° |
N15 | RU19 | N20 | N24 | 176.3° | 90.0° |
N15 | RU19 | N20 | N37 | 98.2° | 90.0° |
N15 | RU19 | N48 | N24 | 176.3° | 90.0° |
N15 | RU19 | N48 | N37 | 98.5° | 90.0° |
N15 | RU19 | N24 | N37 | 177.2° | 90.0° |
N15 | RU19 | N24 | C25 | 3.2° | 90.0° |
N15 | RU19 | N48 | C51 | 92.2° | 90.0° |
N15 | RU19 | N24 | C28 | 178.9° | 90.0° |
N15 | RU19 | N37 | C35 | 0.8° | 90.0° |
N15 | RU19 | N37 | C36 | 178.6° | 90.0° |
RU19 | N15 | C14 | H56 | 4.9° | 90.0° |
C22 | C21 | N20 | H78 | 180.0° | 90.0° |
C22 | C21 | N20 | RU19 | 175.0° | 90.0° |
C21 | C22 | C23 | H57 | 179.8° | 90.0° |
C46 | C47 | N48 | RU19 | 179.5° | 90.0° |
C46 | C47 | N48 | C51 | 2.5° | 90.0° |
C47 | C46 | C49 | C50 | 0.6° | 90.0° |
C47 | C46 | C45 | H70 | 179.9° | 90.0° |
C47 | C46 | C49 | H71 | 179.4° | 90.0° |
C47 | N48 | RU19 | N20 | 40.5° | 90.0° |
N48 | C47 | C46 | C49 | 1.9° | 90.0° |
C47 | N48 | RU19 | C51 | 177.8° | 90.0° |
C47 | N48 | RU19 | N24 | 90.7° | 90.0° |
C47 | N48 | RU19 | N37 | 175.9° | 90.0° |
C47 | N48 | C51 | C50 | 1.7° | 90.0° |
C47 | N48 | C51 | H73 | 178.3° | 90.0° |
C21 | N20 | RU19 | N48 | 134.6° | 90.0° |
C21 | N20 | RU19 | N24 | 3.5° | 90.0° |
C21 | N20 | RU19 | N37 | 81.9° | 90.0° |
N20 | C21 | C22 | H79 | 179.2° | 90.0° |
N20 | RU19 | N48 | N24 | 131.2° | 90.0° |
N20 | RU19 | N48 | N37 | 143.6° | 90.0° |
N20 | RU19 | N24 | N37 | 92.5° | 90.0° |
N20 | RU19 | N24 | C25 | 87.9° | 90.0° |
N20 | RU19 | N48 | C51 | 137.3° | 90.0° |
N20 | RU19 | N24 | C28 | 94.2° | 90.0° |
N20 | RU19 | N37 | C35 | 86.6° | 90.0° |
N20 | RU19 | N37 | C36 | 95.7° | 90.0° |
RU19 | N20 | C21 | H78 | 5.0° | 90.0° |
C46 | C49 | C50 | H71 | 180.0° | 90.0° |
C46 | C49 | C50 | C51 | 0.2° | 90.0° |
C49 | C46 | C45 | H70 | 0.8° | 90.0° |
C46 | C49 | C50 | H72 | 179.8° | 90.0° |
N48 | RU19 | N24 | N37 | 91.4° | 90.0° |
N48 | RU19 | N24 | C25 | 88.2° | 90.0° |
N48 | RU19 | N24 | C28 | 89.7° | 90.0° |
RU19 | N48 | C51 | C50 | 179.3° | 90.0° |
N48 | RU19 | N37 | C35 | 90.3° | 90.0° |
N48 | RU19 | N37 | C36 | 87.4° | 90.0° |
RU19 | N48 | C51 | H73 | 0.8° | 90.0° |
RU19 | N24 | C25 | C28 | 177.6° | 90.0° |
RU19 | N24 | C25 | C26 | 178.6° | 90.0° |
N24 | RU19 | N48 | C51 | 91.5° | 90.0° |
N24 | RU19 | N37 | C35 | 179.4° | 90.0° |
N24 | RU19 | N37 | C36 | 1.6° | 90.0° |
RU19 | N24 | C28 | C36 | 1.5° | 90.0° |
RU19 | N24 | C28 | C29 | 178.9° | 90.0° |
RU19 | N24 | C25 | H58 | 1.5° | 90.0° |
N37 | RU19 | N24 | C25 | 179.6° | 90.0° |
N37 | RU19 | N48 | C51 | 6.3° | 90.0° |
N37 | RU19 | N24 | C28 | 1.7° | 90.0° |
RU19 | N37 | C35 | C36 | 177.4° | 90.0° |
RU19 | N37 | C35 | C34 | 178.5° | 90.0° |
RU19 | N37 | C36 | C28 | 1.3° | 90.0° |
RU19 | N37 | C36 | C32 | 178.9° | 90.0° |
RU19 | N37 | C35 | H65 | 1.5° | 90.0° |
N24 | C25 | C26 | H58 | 180.0° | 90.0° |
N24 | C25 | C26 | C27 | 0.4° | 90.0° |
C25 | N24 | C28 | C36 | 179.6° | 90.0° |
C25 | N24 | C28 | C29 | 0.8° | 90.0° |
N24 | C25 | C26 | H59 | 179.6° | 90.0° |
C26 | C25 | N24 | C28 | 0.9° | 90.0° |
C25 | C26 | C27 | H59 | 180.0° | 90.0° |
C25 | C26 | C27 | C29 | 0.1° | 90.0° |
C25 | C26 | C27 | H60 | 179.9° | 90.0° |
N48 | C51 | C50 | C49 | 0.3° | 90.0° |
N48 | C51 | C50 | H73 | 180.0° | 90.0° |
N48 | C51 | C50 | H72 | 179.7° | 90.0° |
C49 | C50 | C51 | H72 | 180.0° | 90.0° |
C49 | C50 | C51 | H73 | 179.7° | 90.0° |
N24 | C28 | C36 | N37 | 0.2° | 90.0° |
N24 | C28 | C36 | C29 | 179.5° | 90.0° |
N24 | C28 | C29 | C27 | 0.3° | 90.0° |
N24 | C28 | C36 | C32 | 179.6° | 90.0° |
N24 | C28 | C29 | C30 | 179.3° | 90.0° |
C28 | N24 | C25 | H58 | 179.1° | 90.0° |
C26 | C27 | C29 | C28 | 0.2° | 90.0° |
C26 | C27 | C29 | H60 | 180.0° | 90.0° |
C26 | C27 | C29 | C30 | 179.7° | 90.0° |
C27 | C26 | C25 | H58 | 179.6° | 90.0° |
C51 | C50 | C49 | H71 | 179.8° | 90.0° |
N37 | C35 | C34 | H65 | 180.0° | 90.0° |
C35 | N37 | C36 | C28 | 179.1° | 90.0° |
C35 | N37 | C36 | C32 | 1.0° | 90.0° |
N37 | C35 | C34 | C33 | 0.4° | 90.0° |
N37 | C35 | C34 | H64 | 179.6° | 90.0° |
C36 | N37 | C35 | C34 | 1.2° | 90.0° |
N37 | C36 | C28 | C32 | 179.8° | 90.0° |
N37 | C36 | C28 | C29 | 179.7° | 90.0° |
N37 | C36 | C32 | C33 | 0.2° | 90.0° |
N37 | C36 | C32 | C31 | 179.3° | 90.0° |
C36 | N37 | C35 | H65 | 178.8° | 90.0° |
C35 | C34 | C33 | H64 | 180.0° | 90.0° |
C35 | C34 | C33 | C32 | 0.4° | 90.0° |
C35 | C34 | C33 | H63 | 179.6° | 90.0° |
C36 | C28 | C29 | C27 | 179.8° | 90.0° |
C36 | C28 | C29 | C30 | 0.2° | 90.0° |
C28 | C36 | C32 | C33 | 180.0° | 90.0° |
C28 | C36 | C32 | C31 | 0.5° | 90.0° |
C28 | C29 | C27 | C30 | 179.5° | 90.0° |
C29 | C28 | C36 | C32 | 0.1° | 90.0° |
C28 | C29 | C30 | C31 | 0.1° | 90.0° |
C28 | C29 | C27 | H60 | 179.8° | 90.0° |
C28 | C29 | C30 | H61 | 179.9° | 90.0° |
C27 | C29 | C30 | C31 | 179.6° | 90.0° |
C29 | C27 | C26 | H59 | 179.9° | 90.0° |
C27 | C29 | C30 | H61 | 0.4° | 90.0° |
C36 | C32 | C33 | C34 | 0.5° | 90.0° |
C36 | C32 | C33 | C31 | 179.4° | 90.0° |
C36 | C32 | C31 | C30 | 0.6° | 90.0° |
C36 | C32 | C31 | H62 | 179.4° | 90.0° |
C36 | C32 | C33 | H63 | 179.5° | 90.0° |
C29 | C30 | C31 | C32 | 0.3° | 90.0° |
C29 | C30 | C31 | H61 | 180.0° | 90.0° |
C30 | C29 | C27 | H60 | 0.3° | 90.0° |
C29 | C30 | C31 | H62 | 179.7° | 90.0° |
C34 | C33 | C32 | H63 | 180.0° | 90.0° |
C34 | C33 | C32 | C31 | 179.9° | 90.0° |
C33 | C34 | C35 | H65 | 179.6° | 90.0° |
C33 | C32 | C31 | C30 | 179.9° | 90.0° |
C33 | C32 | C31 | H62 | 0.0° | 90.0° |
C32 | C33 | C34 | H64 | 179.6° | 90.0° |
C32 | C31 | C30 | H62 | 180.0° | 90.0° |
C32 | C31 | C30 | H61 | 179.6° | 90.0° |
C31 | C32 | C33 | H63 | 0.1° | 90.0° |
H55 | C13 | C14 | H56 | 1.2° | 90.0° |
H55 | C13 | C12 | H54 | 0.5° | 90.0° |
H79 | C22 | C23 | H57 | 0.2° | 90.0° |
H79 | C22 | C21 | H78 | 0.8° | 90.0° |
H59 | C26 | C25 | H58 | 0.4° | 90.0° |
H59 | C26 | C27 | H60 | 0.1° | 90.0° |
H68 | C41 | C40 | H67 | 0.3° | 90.0° |
H52 | C02 | C03 | H53 | 0.0° | 90.0° |
H61 | C30 | C31 | H62 | 0.3° | 90.0° |
H63 | C33 | C34 | H64 | 0.4° | 90.0° |
H64 | C34 | C35 | H65 | 0.4° | 90.0° |
H66 | C39 | C40 | H67 | 0.6° | 90.0° |
H69 | C44 | C45 | H70 | 0.3° | 90.0° |
H71 | C49 | C50 | H72 | 0.2° | 90.0° |
H72 | C50 | C51 | H73 | 0.3° | 90.0° |