PRD_000382
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | O | doub | 1.21Å | 1.24Å | |
| C | CA | sing | 1.51Å | 1.52Å | |
| CA | CB1 | sing | 1.53Å | 1.47Å | |
| CA | CB2 | sing | 1.53Å | 1.55Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB1 | C1A | sing | 1.51Å | 1.59Å | |
| CB1 | HB11 | sing | 1.09Å | 1.10Å | |
| CB1 | HB12 | sing | 1.09Å | 1.10Å | |
| C1A | C2A | doub | 1.36Å | 1.40Å | Aromatic |
| C1A | C12 | sing | 1.41Å | 1.41Å | Aromatic |
| C2A | C3A | sing | 1.39Å | 1.39Å | Aromatic |
| C2A | H2A | sing | 1.08Å | 1.08Å | |
| C3A | C4A | doub | 1.36Å | 1.39Å | Aromatic |
| C3A | H3A | sing | 1.08Å | 1.08Å | |
| C4A | C11 | sing | 1.41Å | 1.39Å | Aromatic |
| C4A | H4A | sing | 1.08Å | 1.08Å | |
| C11 | C5A | doub | 1.40Å | 1.40Å | Aromatic |
| C11 | C12 | sing | 1.42Å | 1.40Å | Aromatic |
| C5A | C6A | sing | 1.36Å | 1.40Å | Aromatic |
| C5A | H5A | sing | 1.08Å | 1.08Å | |
| C6A | C7A | doub | 1.39Å | 1.40Å | Aromatic |
| C6A | H6A | sing | 1.08Å | 1.08Å | |
| C7A | C8A | sing | 1.36Å | 1.40Å | Aromatic |
| C7A | H7A | sing | 1.08Å | 1.08Å | |
| C8A | C12 | doub | 1.41Å | 1.40Å | Aromatic |
| C8A | H8A | sing | 1.08Å | 1.08Å | |
| CB2 | C1B | sing | 1.51Å | 1.52Å | |
| CB2 | HB21 | sing | 1.09Å | 1.10Å | |
| CB2 | HB22 | sing | 1.09Å | 1.10Å | |
| C1B | C2B | doub | 1.36Å | 1.40Å | Aromatic |
| C1B | C14 | sing | 1.41Å | 1.43Å | Aromatic |
| C2B | C3B | sing | 1.39Å | 1.38Å | Aromatic |
| C2B | H2B | sing | 1.08Å | 1.08Å | |
| C3B | C4B | doub | 1.36Å | 1.38Å | Aromatic |
| C3B | H3B | sing | 1.08Å | 1.08Å | |
| C4B | C13 | sing | 1.41Å | 1.40Å | Aromatic |
| C4B | H4B | sing | 1.08Å | 1.08Å | |
| C13 | C5B | doub | 1.40Å | 1.42Å | Aromatic |
| C13 | C14 | sing | 1.42Å | 1.46Å | Aromatic |
| C5B | C6B | sing | 1.36Å | 1.42Å | Aromatic |
| C5B | H5B | sing | 1.08Å | 1.08Å | |
| C6B | C7B | doub | 1.39Å | 1.35Å | Aromatic |
| C6B | H6B | sing | 1.08Å | 1.08Å | |
| C7B | C8B | sing | 1.36Å | 1.38Å | Aromatic |
| C7B | H7B | sing | 1.08Å | 1.08Å | |
| C8B | C14 | doub | 1.40Å | 1.38Å | Aromatic |
| C8B | H8B | sing | 1.08Å | 1.08Å | |
| N | CA1 | sing | 1.46Å | 1.47Å | |
| N | H | sing | 0.97Å | 1.00Å | |
| CA1 | C1 | sing | 1.51Å | 1.52Å | |
| CA1 | CB | sing | 1.53Å | 1.52Å | |
| CA1 | HA1 | sing | 1.09Å | 1.10Å | |
| C1 | O1 | doub | 1.21Å | 1.24Å | |
| CB | CG | sing | 1.51Å | 1.52Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CB | HB3 | sing | 1.09Å | 1.10Å | |
| CG | ND1 | sing | 1.34Å | 1.40Å | Aromatic |
| CG | CD2 | doub | 1.35Å | 1.35Å | Aromatic |
| ND1 | CE1 | doub | 1.31Å | 1.34Å | Aromatic |
| ND1 | HD1 | sing | 0.97Å | 1.00Å | |
| CD2 | NE2 | sing | 1.37Å | 1.36Å | Aromatic |
| CD2 | HD2 | sing | 1.08Å | 1.08Å | |
| CE1 | NE2 | sing | 1.35Å | 1.32Å | Aromatic |
| CE1 | HE1 | sing | 1.08Å | 1.08Å | |
| NE2 | HE2 | sing | 0.97Å | 1.00Å | |
| N1 | CA2 | sing | 1.46Å | 1.47Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| CA2 | CB3 | sing | 1.53Å | 1.54Å | |
| CA2 | CH | sing | 1.53Å | 1.55Å | |
| CA2 | HA2 | sing | 1.09Å | 1.10Å | |
| CB3 | CG1 | sing | 1.53Å | 1.54Å | |
| CB3 | HB23 | sing | 1.09Å | 1.10Å | |
| CB3 | HB31 | sing | 1.09Å | 1.10Å | |
| CG1 | CD1 | sing | 1.53Å | 1.54Å | |
| CG1 | CD21 | sing | 1.53Å | 1.41Å | |
| CG1 | HG | sing | 1.09Å | 1.10Å | |
| CD1 | CE11 | sing | 1.53Å | 1.53Å | |
| CD1 | HD12 | sing | 1.09Å | 1.10Å | |
| CD1 | HD13 | sing | 1.09Å | 1.10Å | |
| CD21 | CE2 | sing | 1.53Å | 1.54Å | |
| CD21 | HD23 | sing | 1.09Å | 1.10Å | |
| CD21 | HD22 | sing | 1.09Å | 1.10Å | |
| CE11 | CZ | sing | 1.53Å | 1.52Å | |
| CE11 | HE12 | sing | 1.09Å | 1.10Å | |
| CE11 | HE13 | sing | 1.09Å | 1.10Å | |
| CE2 | CZ | sing | 1.53Å | 1.52Å | |
| CE2 | HE23 | sing | 1.09Å | 1.10Å | |
| CE2 | HE22 | sing | 1.09Å | 1.10Å | |
| CZ | HZ2 | sing | 1.09Å | 1.10Å | |
| CZ | HZ3 | sing | 1.09Å | 1.10Å | |
| CH | OH | sing | 1.43Å | 1.42Å | |
| CH | CM | sing | 1.53Å | 1.55Å | |
| CH | HH | sing | 1.09Å | 1.10Å | |
| OH | HO | sing | 0.97Å | 0.95Å | |
| CM | CA21 | sing | 1.53Å | 1.49Å | |
| CM | HM1 | sing | 1.09Å | 1.10Å | |
| CM | HM2 | sing | 1.09Å | 1.10Å | |
| CA21 | CB21 | sing | 1.53Å | 1.48Å | |
| CA21 | C2 | sing | 1.51Å | 1.32Å | |
| CA21 | HA21 | sing | 1.09Å | 1.10Å | |
| CB21 | CG2 | sing | 1.53Å | 1.53Å | |
| CB21 | HB24 | sing | 1.09Å | 1.10Å | |
| CB21 | HB25 | sing | 1.09Å | 1.10Å | |
| CG2 | CD3 | sing | 1.53Å | 1.53Å | |
| CG2 | CD4 | sing | 1.53Å | 1.53Å | |
| CG2 | HG2 | sing | 1.09Å | 1.10Å | |
| CD3 | HD31 | sing | 1.09Å | 1.10Å | |
| CD3 | HD32 | sing | 1.09Å | 1.10Å | |
| CD3 | HD33 | sing | 1.09Å | 1.10Å | |
| CD4 | HD41 | sing | 1.09Å | 1.10Å | |
| CD4 | HD42 | sing | 1.09Å | 1.10Å | |
| CD4 | HD43 | sing | 1.09Å | 1.10Å | |
| C2 | O2 | doub | 1.21Å | 1.24Å | |
| N2 | CA3 | sing | 1.46Å | 1.45Å | |
| N2 | HN1 | sing | 0.97Å | 1.00Å | |
| CA3 | CB4 | sing | 1.53Å | 1.52Å | |
| CA3 | HA11 | sing | 1.09Å | 1.10Å | |
| CA3 | HA22 | sing | 1.09Å | 1.10Å | |
| CB4 | CG11 | sing | 1.53Å | 1.53Å | |
| CB4 | CG21 | sing | 1.53Å | 1.53Å | |
| CB4 | HB | sing | 1.09Å | 1.10Å | |
| CG11 | CD11 | sing | 1.53Å | 1.53Å | |
| CG11 | HG11 | sing | 1.09Å | 1.10Å | |
| CG11 | HG12 | sing | 1.09Å | 1.10Å | |
| CG21 | HG21 | sing | 1.09Å | 1.10Å | |
| CG21 | HG22 | sing | 1.09Å | 1.10Å | |
| CG21 | HG23 | sing | 1.09Å | 1.10Å | |
| CD11 | HD11 | sing | 1.09Å | 1.10Å | |
| CD11 | HD21 | sing | 1.09Å | 1.10Å | |
| CD11 | HD3 | sing | 1.09Å | 1.10Å | |
| C | N | sing | 1.35Å | 1.31Å | |
| C1 | N1 | sing | 1.35Å | 1.26Å | |
| C2 | N2 | sing | 1.35Å | 1.31Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | CA | 120.8° | 120.0° |
| O | C | N | 128.0° | 119.9° |
| C | CA | CB1 | 111.5° | 109.5° |
| C | CA | CB2 | 104.6° | 109.5° |
| C | CA | HA | 111.7° | 109.5° |
| CA | C | N | 111.2° | 120.0° |
| CB1 | CA | CB2 | 110.6° | 109.4° |
| CB1 | CA | HA | 105.9° | 109.4° |
| CA | CB1 | C1A | 109.4° | 109.5° |
| CA | CB1 | HB11 | 109.5° | 109.5° |
| CA | CB1 | HB12 | 109.5° | 109.4° |
| CB2 | CA | HA | 112.6° | 109.5° |
| CA | CB2 | C1B | 114.5° | 109.5° |
| CA | CB2 | HB21 | 107.8° | 109.5° |
| CA | CB2 | HB22 | 106.7° | 109.5° |
| C1A | CB1 | HB11 | 109.5° | 109.5° |
| C1A | CB1 | HB12 | 109.5° | 109.5° |
| CB1 | C1A | C2A | 118.4° | 120.2° |
| CB1 | C1A | C12 | 123.5° | 120.2° |
| HB11 | CB1 | HB12 | 109.4° | 109.5° |
| C2A | C1A | C12 | 118.1° | 119.6° |
| C1A | C2A | C3A | 121.4° | 121.1° |
| C1A | C2A | H2A | 119.3° | 119.4° |
| C1A | C12 | C11 | 120.2° | 119.4° |
| C1A | C12 | C8A | 120.2° | 121.3° |
| C3A | C2A | H2A | 119.3° | 119.5° |
| C2A | C3A | C4A | 120.1° | 121.0° |
| C2A | C3A | H3A | 120.0° | 119.6° |
| C4A | C3A | H3A | 120.0° | 119.5° |
| C3A | C4A | C11 | 119.8° | 119.7° |
| C3A | C4A | H4A | 120.1° | 120.2° |
| C11 | C4A | H4A | 120.1° | 120.2° |
| C4A | C11 | C5A | 118.5° | 121.3° |
| C4A | C11 | C12 | 120.6° | 119.3° |
| C5A | C11 | C12 | 120.9° | 119.4° |
| C11 | C5A | C6A | 119.3° | 119.6° |
| C11 | C5A | H5A | 120.3° | 120.2° |
| C11 | C12 | C8A | 119.6° | 119.3° |
| C6A | C5A | H5A | 120.4° | 120.2° |
| C5A | C6A | C7A | 120.2° | 121.1° |
| C5A | C6A | H6A | 119.9° | 119.5° |
| C7A | C6A | H6A | 119.9° | 119.5° |
| C6A | C7A | C8A | 120.2° | 120.9° |
| C6A | C7A | H7A | 119.9° | 119.5° |
| C8A | C7A | H7A | 119.9° | 119.5° |
| C7A | C8A | C12 | 119.8° | 119.7° |
| C7A | C8A | H8A | 120.1° | 120.1° |
| C12 | C8A | H8A | 120.1° | 120.2° |
| C1B | CB2 | HB21 | 107.8° | 109.4° |
| C1B | CB2 | HB22 | 106.7° | 109.4° |
| CB2 | C1B | C2B | 117.8° | 120.2° |
| CB2 | C1B | C14 | 118.8° | 120.2° |
| HB21 | CB2 | HB22 | 113.5° | 109.5° |
| C2B | C1B | C14 | 123.4° | 119.7° |
| C1B | C2B | C3B | 120.3° | 121.0° |
| C1B | C2B | H2B | 119.8° | 119.5° |
| C1B | C14 | C13 | 113.7° | 119.4° |
| C1B | C14 | C8B | 123.5° | 121.3° |
| C3B | C2B | H2B | 119.9° | 119.5° |
| C2B | C3B | C4B | 119.5° | 121.0° |
| C2B | C3B | H3B | 120.2° | 119.5° |
| C4B | C3B | H3B | 120.2° | 119.5° |
| C3B | C4B | C13 | 121.7° | 119.7° |
| C3B | C4B | H4B | 119.1° | 120.2° |
| C13 | C4B | H4B | 119.1° | 120.1° |
| C4B | C13 | C5B | 123.5° | 121.3° |
| C4B | C13 | C14 | 121.3° | 119.3° |
| C5B | C13 | C14 | 115.2° | 119.4° |
| C13 | C5B | C6B | 119.6° | 119.7° |
| C13 | C5B | H5B | 120.2° | 120.2° |
| C13 | C14 | C8B | 122.7° | 119.3° |
| C6B | C5B | H5B | 120.2° | 120.1° |
| C5B | C6B | C7B | 122.9° | 121.0° |
| C5B | C6B | H6B | 118.5° | 119.5° |
| C7B | C6B | H6B | 118.6° | 119.5° |
| C6B | C7B | C8B | 120.2° | 121.0° |
| C6B | C7B | H7B | 119.9° | 119.5° |
| C8B | C7B | H7B | 119.9° | 119.5° |
| C7B | C8B | C14 | 119.4° | 119.7° |
| C7B | C8B | H8B | 120.3° | 120.2° |
| C14 | C8B | H8B | 120.3° | 120.1° |
| CA1 | N | H | 117.6° | 120.0° |
| N | CA1 | C1 | 108.7° | 109.5° |
| N | CA1 | CB | 117.6° | 109.5° |
| N | CA1 | HA1 | 101.2° | 109.5° |
| CA1 | N | C | 124.8° | 120.0° |
| H | N | C | 117.6° | 120.0° |
| C1 | CA1 | CB | 95.7° | 109.5° |
| C1 | CA1 | HA1 | 121.5° | 109.4° |
| CA1 | C1 | O1 | 119.9° | 120.0° |
| CA1 | C1 | N1 | 117.4° | 120.1° |
| CB | CA1 | HA1 | 113.2° | 109.5° |
| CA1 | CB | CG | 122.8° | 109.5° |
| CA1 | CB | HB2 | 105.3° | 109.4° |
| CA1 | CB | HB3 | 102.1° | 109.5° |
| O1 | C1 | N1 | 122.6° | 119.9° |
| CG | CB | HB2 | 105.2° | 109.4° |
| CG | CB | HB3 | 102.1° | 109.5° |
| CB | CG | ND1 | 125.7° | 126.0° |
| CB | CG | CD2 | 126.8° | 125.9° |
| HB2 | CB | HB3 | 120.6° | 109.5° |
| ND1 | CG | CD2 | 107.5° | 108.1° |
| CG | ND1 | CE1 | 107.0° | 109.2° |
| CG | ND1 | HD1 | 126.5° | 125.4° |
| CG | CD2 | NE2 | 106.9° | 106.8° |
| CG | CD2 | HD2 | 126.5° | 126.6° |
| CE1 | ND1 | HD1 | 126.5° | 125.4° |
| ND1 | CE1 | NE2 | 108.9° | 108.7° |
| ND1 | CE1 | HE1 | 125.5° | 125.7° |
| NE2 | CD2 | HD2 | 126.6° | 126.6° |
| CD2 | NE2 | CE1 | 109.7° | 107.2° |
| CD2 | NE2 | HE2 | 125.1° | 126.4° |
| NE2 | CE1 | HE1 | 125.5° | 125.6° |
| CE1 | NE2 | HE2 | 125.1° | 126.4° |
| CA2 | N1 | H1 | 117.4° | 120.0° |
| N1 | CA2 | CB3 | 108.8° | 109.5° |
| N1 | CA2 | CH | 109.2° | 109.4° |
| N1 | CA2 | HA2 | 111.0° | 109.5° |
| CA2 | N1 | C1 | 125.1° | 120.0° |
| H1 | N1 | C1 | 117.4° | 119.9° |
| CB3 | CA2 | CH | 112.1° | 109.5° |
| CB3 | CA2 | HA2 | 108.1° | 109.5° |
| CA2 | CB3 | CG1 | 112.1° | 109.5° |
| CA2 | CB3 | HB23 | 108.6° | 109.5° |
| CA2 | CB3 | HB31 | 108.0° | 109.5° |
| CH | CA2 | HA2 | 107.7° | 109.5° |
| CA2 | CH | OH | 109.6° | 109.5° |
| CA2 | CH | CM | 109.7° | 109.5° |
| CA2 | CH | HH | 109.1° | 109.4° |
| CG1 | CB3 | HB23 | 108.6° | 109.5° |
| CG1 | CB3 | HB31 | 108.0° | 109.5° |
| CB3 | CG1 | CD1 | 108.4° | 109.4° |
| CB3 | CG1 | CD21 | 110.0° | 109.5° |
| CB3 | CG1 | HG | 110.6° | 109.5° |
| HB23 | CB3 | HB31 | 111.6° | 109.5° |
| CD1 | CG1 | CD21 | 111.6° | 109.5° |
| CD1 | CG1 | HG | 108.9° | 109.4° |
| CG1 | CD1 | CE11 | 111.4° | 109.4° |
| CG1 | CD1 | HD12 | 108.8° | 109.5° |
| CG1 | CD1 | HD13 | 108.4° | 109.5° |
| CD21 | CG1 | HG | 107.3° | 109.5° |
| CG1 | CD21 | CE2 | 111.3° | 109.5° |
| CG1 | CD21 | HD23 | 108.9° | 109.5° |
| CG1 | CD21 | HD22 | 108.5° | 109.4° |
| CE11 | CD1 | HD12 | 108.9° | 109.4° |
| CE11 | CD1 | HD13 | 108.4° | 109.5° |
| CD1 | CE11 | CZ | 109.3° | 109.5° |
| CD1 | CE11 | HE12 | 109.5° | 109.5° |
| CD1 | CE11 | HE13 | 109.6° | 109.5° |
| HD12 | CD1 | HD13 | 111.0° | 109.5° |
| CE2 | CD21 | HD23 | 108.9° | 109.5° |
| CE2 | CD21 | HD22 | 108.5° | 109.5° |
| CD21 | CE2 | CZ | 110.4° | 109.4° |
| CD21 | CE2 | HE23 | 109.2° | 109.4° |
| CD21 | CE2 | HE22 | 109.0° | 109.5° |
| HD23 | CD21 | HD22 | 110.9° | 109.5° |
| CZ | CE11 | HE12 | 109.5° | 109.5° |
| CZ | CE11 | HE13 | 109.6° | 109.4° |
| CE11 | CZ | CE2 | 109.0° | 109.5° |
| CE11 | CZ | HZ2 | 109.6° | 109.5° |
| CE11 | CZ | HZ3 | 109.7° | 109.5° |
| HE12 | CE11 | HE13 | 109.3° | 109.5° |
| CZ | CE2 | HE23 | 109.2° | 109.5° |
| CZ | CE2 | HE22 | 109.0° | 109.5° |
| CE2 | CZ | HZ2 | 109.6° | 109.5° |
| CE2 | CZ | HZ3 | 109.8° | 109.5° |
| HE23 | CE2 | HE22 | 110.2° | 109.5° |
| HZ2 | CZ | HZ3 | 109.1° | 109.4° |
| OH | CH | CM | 109.1° | 109.5° |
| OH | CH | HH | 109.7° | 109.5° |
| CH | OH | HO | 109.5° | 114.0° |
| CM | CH | HH | 109.6° | 109.4° |
| CH | CM | CA21 | 112.6° | 109.5° |
| CH | CM | HM1 | 108.5° | 109.4° |
| CH | CM | HM2 | 107.7° | 109.5° |
| CA21 | CM | HM1 | 108.4° | 109.5° |
| CA21 | CM | HM2 | 107.8° | 109.5° |
| CM | CA21 | CB21 | 110.0° | 109.5° |
| CM | CA21 | C2 | 110.5° | 109.5° |
| CM | CA21 | HA21 | 107.7° | 109.4° |
| HM1 | CM | HM2 | 111.9° | 109.4° |
| CB21 | CA21 | C2 | 107.1° | 109.5° |
| CB21 | CA21 | HA21 | 111.0° | 109.5° |
| CA21 | CB21 | CG2 | 110.9° | 109.5° |
| CA21 | CB21 | HB24 | 109.0° | 109.5° |
| CA21 | CB21 | HB25 | 108.7° | 109.5° |
| C2 | CA21 | HA21 | 110.5° | 109.5° |
| CA21 | C2 | O2 | 120.4° | 120.0° |
| CA21 | C2 | N2 | 114.9° | 120.0° |
| CG2 | CB21 | HB24 | 109.0° | 109.5° |
| CG2 | CB21 | HB25 | 108.7° | 109.5° |
| CB21 | CG2 | CD3 | 109.9° | 109.5° |
| CB21 | CG2 | CD4 | 110.0° | 109.5° |
| CB21 | CG2 | HG2 | 108.6° | 109.5° |
| HB24 | CB21 | HB25 | 110.5° | 109.5° |
| CD3 | CG2 | CD4 | 108.8° | 109.5° |
| CD3 | CG2 | HG2 | 109.8° | 109.5° |
| CG2 | CD3 | HD31 | 109.5° | 109.5° |
| CG2 | CD3 | HD32 | 109.5° | 109.5° |
| CG2 | CD3 | HD33 | 109.5° | 109.5° |
| CD4 | CG2 | HG2 | 109.7° | 109.5° |
| CG2 | CD4 | HD41 | 109.5° | 109.5° |
| CG2 | CD4 | HD42 | 109.4° | 109.4° |
| CG2 | CD4 | HD43 | 109.4° | 109.5° |
| HD31 | CD3 | HD32 | 109.5° | 109.5° |
| HD31 | CD3 | HD33 | 109.4° | 109.5° |
| HD32 | CD3 | HD33 | 109.5° | 109.4° |
| HD41 | CD4 | HD42 | 109.5° | 109.4° |
| HD41 | CD4 | HD43 | 109.5° | 109.5° |
| HD42 | CD4 | HD43 | 109.5° | 109.5° |
| O2 | C2 | N2 | 124.7° | 120.0° |
| CA3 | N2 | HN1 | 119.3° | 120.0° |
| N2 | CA3 | CB4 | 111.3° | 109.5° |
| N2 | CA3 | HA11 | 108.9° | 109.5° |
| N2 | CA3 | HA22 | 108.4° | 109.5° |
| CA3 | N2 | C2 | 121.4° | 120.0° |
| HN1 | N2 | C2 | 119.3° | 120.0° |
| CB4 | CA3 | HA11 | 108.9° | 109.5° |
| CB4 | CA3 | HA22 | 108.4° | 109.4° |
| CA3 | CB4 | CG11 | 112.2° | 109.5° |
| CA3 | CB4 | CG21 | 113.9° | 109.4° |
| CA3 | CB4 | HB | 103.4° | 109.5° |
| HA11 | CA3 | HA22 | 110.9° | 109.4° |
| CG11 | CB4 | CG21 | 106.0° | 109.4° |
| CG11 | CB4 | HB | 111.7° | 109.5° |
| CB4 | CG11 | CD11 | 112.8° | 109.5° |
| CB4 | CG11 | HG11 | 108.4° | 109.5° |
| CB4 | CG11 | HG12 | 107.6° | 109.4° |
| CG21 | CB4 | HB | 109.9° | 109.5° |
| CB4 | CG21 | HG21 | 109.5° | 109.4° |
| CB4 | CG21 | HG22 | 109.5° | 109.4° |
| CB4 | CG21 | HG23 | 109.5° | 109.5° |
| CD11 | CG11 | HG11 | 108.4° | 109.5° |
| CD11 | CG11 | HG12 | 107.6° | 109.5° |
| CG11 | CD11 | HD11 | 109.5° | 109.5° |
| CG11 | CD11 | HD21 | 109.5° | 109.4° |
| CG11 | CD11 | HD3 | 109.4° | 109.4° |
| HG11 | CG11 | HG12 | 112.2° | 109.5° |
| HG21 | CG21 | HG22 | 109.5° | 109.5° |
| HG21 | CG21 | HG23 | 109.5° | 109.5° |
| HG22 | CG21 | HG23 | 109.5° | 109.5° |
| HD11 | CD11 | HD21 | 109.5° | 109.5° |
| HD11 | CD11 | HD3 | 109.4° | 109.5° |
| HD21 | CD11 | HD3 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | CA | N | 178.7° | 179.8° |
| O | C | CA | CB1 | 27.0° | 120.0° |
| O | C | CA | CB2 | 92.7° | 0.0° |
| O | C | CA | HA | 145.2° | 120.1° |
| O | C | N | CA1 | 11.4° | 0.1° |
| O | C | N | H | 168.6° | 180.0° |
| C | CA | CB1 | CB2 | 116.0° | 120.0° |
| C | CA | CB1 | HA | 121.7° | 120.0° |
| C | CA | CB2 | HA | 121.6° | 120.1° |
| C | CA | CB1 | C1A | 67.3° | 173.7° |
| C | CA | CB1 | HB11 | 52.7° | 53.7° |
| C | CA | CB1 | HB12 | 172.6° | 66.3° |
| C | CA | CB2 | C1B | 159.4° | 66.3° |
| C | CA | CB2 | HB21 | 39.4° | 173.7° |
| C | CA | CB2 | HB22 | 82.8° | 53.6° |
| CA | C | N | CA1 | 170.0° | 179.7° |
| CA | C | N | H | 10.0° | 0.3° |
| CB1 | CA | CB2 | HA | 118.2° | 120.0° |
| CA | CB1 | C1A | HB11 | 120.0° | 120.0° |
| CA | CB1 | C1A | HB12 | 120.0° | 120.0° |
| CA | CB1 | HB11 | HB12 | 120.0° | 119.9° |
| CA | CB1 | C1A | C2A | 13.8° | 98.5° |
| CA | CB1 | C1A | C12 | 164.1° | 81.2° |
| CB1 | CA | CB2 | C1B | 39.2° | 173.7° |
| CB1 | CA | CB2 | HB21 | 80.8° | 53.7° |
| CB1 | CA | CB2 | HB22 | 157.0° | 66.3° |
| CB1 | CA | C | N | 151.7° | 60.3° |
| CB2 | CA | CB1 | C1A | 176.7° | 66.3° |
| CB2 | CA | CB1 | HB11 | 63.3° | 173.7° |
| CB2 | CA | CB1 | HB12 | 56.6° | 53.7° |
| CA | CB2 | C1B | HB21 | 120.0° | 120.0° |
| CA | CB2 | C1B | HB22 | 117.8° | 120.0° |
| CA | CB2 | HB21 | HB22 | 117.9° | 120.1° |
| CA | CB2 | C1B | C2B | 91.3° | 104.7° |
| CA | CB2 | C1B | C14 | 89.2° | 75.1° |
| CB2 | CA | C | N | 88.6° | 179.8° |
| HA | CA | CB1 | C1A | 54.4° | 53.7° |
| HA | CA | CB1 | HB11 | 174.4° | 66.3° |
| HA | CA | CB1 | HB12 | 65.6° | 173.8° |
| HA | CA | CB2 | C1B | 79.0° | 53.7° |
| HA | CA | CB2 | HB21 | 161.0° | 66.3° |
| HA | CA | CB2 | HB22 | 38.8° | 173.7° |
| HA | CA | C | N | 33.5° | 59.7° |
| C1A | CB1 | HB11 | HB12 | 120.0° | 120.1° |
| CB1 | C1A | C2A | C12 | 178.1° | 179.7° |
| CB1 | C1A | C2A | C3A | 178.6° | 180.0° |
| CB1 | C1A | C2A | H2A | 1.4° | 0.1° |
| CB1 | C1A | C12 | C11 | 178.6° | 179.7° |
| CB1 | C1A | C12 | C8A | 2.9° | 0.6° |
| HB11 | CB1 | C1A | C2A | 133.8° | 141.5° |
| HB11 | CB1 | C1A | C12 | 44.1° | 38.8° |
| HB12 | CB1 | C1A | C2A | 106.2° | 21.5° |
| HB12 | CB1 | C1A | C12 | 75.9° | 158.8° |
| C1A | C2A | C3A | H2A | 180.0° | 179.9° |
| C1A | C2A | C3A | C4A | 0.2° | 0.1° |
| C1A | C2A | C3A | H3A | 179.8° | 180.0° |
| C2A | C1A | C12 | C11 | 0.7° | 0.6° |
| C2A | C1A | C12 | C8A | 179.1° | 179.7° |
| C12 | C1A | C2A | C3A | 0.6° | 0.3° |
| C12 | C1A | C2A | H2A | 179.4° | 179.8° |
| C1A | C12 | C11 | C4A | 0.4° | 0.6° |
| C1A | C12 | C11 | C5A | 179.0° | 179.7° |
| C1A | C12 | C11 | C8A | 178.5° | 179.2° |
| C1A | C12 | C8A | C7A | 177.6° | 179.7° |
| C1A | C12 | C8A | H8A | 2.4° | 0.5° |
| C2A | C3A | C4A | H3A | 180.0° | 179.9° |
| C2A | C3A | C4A | C11 | 0.0° | 0.1° |
| C2A | C3A | C4A | H4A | 179.9° | 179.9° |
| H2A | C2A | C3A | C4A | 179.8° | 180.0° |
| H2A | C2A | C3A | H3A | 0.2° | 0.1° |
| C3A | C4A | C11 | H4A | 180.0° | 179.9° |
| C3A | C4A | C11 | C5A | 179.4° | 179.9° |
| C3A | C4A | C11 | C12 | 0.0° | 0.3° |
| H3A | C3A | C4A | C11 | 179.9° | 180.0° |
| H3A | C3A | C4A | H4A | 0.1° | 0.1° |
| C4A | C11 | C5A | C12 | 179.4° | 179.7° |
| C4A | C11 | C5A | C6A | 177.5° | 180.0° |
| C4A | C11 | C5A | H5A | 2.5° | 0.1° |
| C4A | C11 | C12 | C8A | 178.9° | 179.8° |
| H4A | C4A | C11 | C5A | 0.6° | 0.1° |
| H4A | C4A | C11 | C12 | 180.0° | 179.8° |
| C11 | C5A | C6A | H5A | 180.0° | 179.9° |
| C11 | C5A | C6A | C7A | 2.0° | 0.0° |
| C11 | C5A | C6A | H6A | 178.0° | 180.0° |
| C5A | C11 | C12 | C8A | 0.6° | 0.5° |
| C12 | C11 | C5A | C6A | 2.0° | 0.3° |
| C12 | C11 | C5A | H5A | 178.0° | 179.8° |
| C11 | C12 | C8A | C7A | 0.9° | 0.5° |
| C11 | C12 | C8A | H8A | 179.1° | 179.7° |
| C5A | C6A | C7A | H6A | 180.0° | 180.0° |
| C5A | C6A | C7A | C8A | 0.6° | 0.0° |
| C5A | C6A | C7A | H7A | 179.4° | 180.0° |
| H5A | C5A | C6A | C7A | 178.0° | 179.9° |
| H5A | C5A | C6A | H6A | 2.0° | 0.1° |
| C6A | C7A | C8A | H7A | 180.0° | 179.9° |
| C6A | C7A | C8A | C12 | 0.8° | 0.3° |
| C6A | C7A | C8A | H8A | 179.1° | 179.9° |
| H6A | C6A | C7A | C8A | 179.4° | 180.0° |
| H6A | C6A | C7A | H7A | 0.6° | 0.0° |
| C7A | C8A | C12 | H8A | 180.0° | 179.8° |
| H7A | C7A | C8A | C12 | 179.1° | 179.8° |
| H7A | C7A | C8A | H8A | 0.9° | 0.0° |
| C1B | CB2 | HB21 | HB22 | 118.0° | 119.9° |
| CB2 | C1B | C2B | C14 | 179.5° | 179.8° |
| CB2 | C1B | C2B | C3B | 179.7° | 180.0° |
| CB2 | C1B | C2B | H2B | 0.3° | 0.0° |
| CB2 | C1B | C14 | C13 | 179.4° | 179.8° |
| CB2 | C1B | C14 | C8B | 0.1° | 0.5° |
| HB21 | CB2 | C1B | C2B | 28.7° | 135.3° |
| HB21 | CB2 | C1B | C14 | 150.8° | 44.9° |
| HB22 | CB2 | C1B | C2B | 151.0° | 15.4° |
| HB22 | CB2 | C1B | C14 | 28.6° | 164.9° |
| C1B | C2B | C3B | H2B | 180.0° | 179.9° |
| C1B | C2B | C3B | C4B | 0.0° | 0.0° |
| C1B | C2B | C3B | H3B | 179.9° | 179.9° |
| C2B | C1B | C14 | C13 | 1.1° | 0.4° |
| C2B | C1B | C14 | C8B | 179.4° | 179.7° |
| C14 | C1B | C2B | C3B | 0.8° | 0.2° |
| C14 | C1B | C2B | H2B | 179.2° | 179.7° |
| C1B | C14 | C13 | C4B | 0.8° | 0.5° |
| C1B | C14 | C13 | C5B | 179.1° | 179.7° |
| C1B | C14 | C13 | C8B | 179.5° | 179.3° |
| C1B | C14 | C8B | C7B | 179.2° | 179.7° |
| C1B | C14 | C8B | H8B | 0.8° | 0.5° |
| C2B | C3B | C4B | H3B | 180.0° | 180.0° |
| C2B | C3B | C4B | C13 | 0.4° | 0.0° |
| C2B | C3B | C4B | H4B | 179.6° | 179.9° |
| H2B | C2B | C3B | C4B | 180.0° | 180.0° |
| H2B | C2B | C3B | H3B | 0.0° | 0.0° |
| C3B | C4B | C13 | H4B | 180.0° | 179.9° |
| C3B | C4B | C13 | C5B | 179.8° | 179.9° |
| C3B | C4B | C13 | C14 | 0.1° | 0.2° |
| H3B | C3B | C4B | C13 | 179.6° | 180.0° |
| H3B | C3B | C4B | H4B | 0.4° | 0.1° |
| C4B | C13 | C5B | C14 | 179.9° | 179.8° |
| C4B | C13 | C5B | C6B | 179.9° | 180.0° |
| C4B | C13 | C5B | H5B | 0.2° | 0.0° |
| C4B | C13 | C14 | C8B | 179.8° | 179.8° |
| H4B | C4B | C13 | C5B | 0.2° | 0.0° |
| H4B | C4B | C13 | C14 | 179.9° | 179.8° |
| C13 | C5B | C6B | H5B | 180.0° | 180.0° |
| C13 | C5B | C6B | C7B | 0.0° | 0.0° |
| C13 | C5B | C6B | H6B | 180.0° | 180.0° |
| C5B | C13 | C14 | C8B | 0.3° | 0.4° |
| C14 | C13 | C5B | C6B | 0.2° | 0.2° |
| C14 | C13 | C5B | H5B | 179.8° | 179.8° |
| C13 | C14 | C8B | C7B | 0.2° | 0.5° |
| C13 | C14 | C8B | H8B | 179.8° | 179.8° |
| C5B | C6B | C7B | H6B | 180.0° | 180.0° |
| C5B | C6B | C7B | C8B | 0.1° | 0.0° |
| C5B | C6B | C7B | H7B | 179.9° | 180.0° |
| H5B | C5B | C6B | C7B | 180.0° | 180.0° |
| H5B | C5B | C6B | H6B | 0.0° | 0.1° |
| C6B | C7B | C8B | H7B | 180.0° | 180.0° |
| C6B | C7B | C8B | C14 | 0.0° | 0.2° |
| C6B | C7B | C8B | H8B | 180.0° | 180.0° |
| H6B | C6B | C7B | C8B | 179.9° | 180.0° |
| H6B | C6B | C7B | H7B | 0.1° | 0.0° |
| C7B | C8B | C14 | H8B | 180.0° | 179.8° |
| H7B | C7B | C8B | C14 | 180.0° | 179.8° |
| H7B | C7B | C8B | H8B | 0.0° | 0.0° |
| CA1 | N | H | C | 180.0° | 180.0° |
| N | CA1 | C1 | CB | 121.7° | 120.0° |
| N | CA1 | C1 | HA1 | 116.6° | 120.0° |
| N | CA1 | CB | HA1 | 117.6° | 120.1° |
| N | CA1 | C1 | O1 | 84.0° | 0.0° |
| N | CA1 | CB | CG | 57.3° | 65.0° |
| N | CA1 | CB | HB2 | 62.7° | 55.0° |
| N | CA1 | CB | HB3 | 170.5° | 175.0° |
| N | CA1 | C1 | N1 | 99.8° | 180.0° |
| H | N | CA1 | C1 | 47.4° | 25.0° |
| H | N | CA1 | CB | 59.9° | 95.0° |
| H | N | CA1 | HA1 | 176.3° | 145.0° |
| C1 | CA1 | CB | HA1 | 127.8° | 119.9° |
| CA1 | C1 | O1 | N1 | 176.0° | 180.0° |
| C1 | CA1 | CB | CG | 171.9° | 175.0° |
| C1 | CA1 | CB | HB2 | 51.9° | 65.0° |
| C1 | CA1 | CB | HB3 | 74.9° | 55.0° |
| CA1 | C1 | N1 | CA2 | 178.0° | 175.0° |
| CA1 | C1 | N1 | H1 | 2.0° | 5.0° |
| C1 | CA1 | N | C | 132.6° | 155.0° |
| CB | CA1 | C1 | O1 | 37.7° | 120.0° |
| CA1 | CB | CG | HB2 | 120.0° | 119.9° |
| CA1 | CB | CG | HB3 | 113.2° | 120.0° |
| CA1 | CB | HB2 | HB3 | 114.5° | 120.0° |
| CA1 | CB | CG | ND1 | 4.4° | 95.0° |
| CA1 | CB | CG | CD2 | 177.3° | 85.3° |
| CB | CA1 | N | C | 120.2° | 85.0° |
| CB | CA1 | C1 | N1 | 138.5° | 60.0° |
| HA1 | CA1 | C1 | O1 | 159.4° | 120.0° |
| HA1 | CA1 | CB | CG | 60.3° | 55.1° |
| HA1 | CA1 | CB | HB2 | 179.7° | 175.0° |
| HA1 | CA1 | CB | HB3 | 53.0° | 65.0° |
| HA1 | CA1 | N | C | 3.6° | 35.0° |
| HA1 | CA1 | C1 | N1 | 16.9° | 60.0° |
| O1 | C1 | N1 | CA2 | 5.9° | 5.0° |
| O1 | C1 | N1 | H1 | 174.1° | 175.0° |
| CG | CB | HB2 | HB3 | 114.5° | 120.0° |
| CB | CG | ND1 | CD2 | 178.6° | 179.7° |
| CB | CG | ND1 | CE1 | 177.9° | 180.0° |
| CB | CG | ND1 | HD1 | 2.0° | 0.1° |
| CB | CG | CD2 | NE2 | 177.8° | 180.0° |
| CB | CG | CD2 | HD2 | 2.2° | 0.0° |
| HB2 | CB | CG | ND1 | 115.7° | 25.0° |
| HB2 | CB | CG | CD2 | 62.7° | 154.7° |
| HB3 | CB | CG | ND1 | 117.6° | 145.0° |
| HB3 | CB | CG | CD2 | 64.1° | 34.7° |
| CG | ND1 | CE1 | HD1 | 180.0° | 179.9° |
| ND1 | CG | CD2 | NE2 | 0.8° | 0.3° |
| ND1 | CG | CD2 | HD2 | 179.2° | 179.7° |
| CG | ND1 | CE1 | NE2 | 0.3° | 0.2° |
| CG | ND1 | CE1 | HE1 | 179.7° | 180.0° |
| CD2 | CG | ND1 | CE1 | 0.7° | 0.3° |
| CD2 | CG | ND1 | HD1 | 179.3° | 179.8° |
| CG | CD2 | NE2 | HD2 | 180.0° | 180.0° |
| CG | CD2 | NE2 | CE1 | 0.7° | 0.2° |
| CG | CD2 | NE2 | HE2 | 179.3° | 179.9° |
| ND1 | CE1 | NE2 | CD2 | 0.2° | 0.0° |
| ND1 | CE1 | NE2 | HE1 | 180.0° | 179.8° |
| ND1 | CE1 | NE2 | HE2 | 179.7° | 179.8° |
| HD1 | ND1 | CE1 | NE2 | 179.8° | 179.9° |
| HD1 | ND1 | CE1 | HE1 | 0.2° | 0.1° |
| CD2 | NE2 | CE1 | HE2 | 180.0° | 179.7° |
| CD2 | NE2 | CE1 | HE1 | 179.8° | 179.8° |
| HD2 | CD2 | NE2 | CE1 | 179.3° | 179.8° |
| HD2 | CD2 | NE2 | HE2 | 0.7° | 0.1° |
| HE1 | CE1 | NE2 | HE2 | 0.3° | 0.1° |
| CA2 | N1 | H1 | C1 | 180.0° | 180.0° |
| N1 | CA2 | CB3 | CH | 120.9° | 120.0° |
| N1 | CA2 | CB3 | HA2 | 120.6° | 120.0° |
| N1 | CA2 | CH | HA2 | 120.6° | 120.0° |
| N1 | CA2 | CB3 | CG1 | 55.8° | 177.5° |
| N1 | CA2 | CB3 | HB23 | 64.2° | 57.5° |
| N1 | CA2 | CB3 | HB31 | 174.7° | 62.5° |
| N1 | CA2 | CH | OH | 74.3° | 60.0° |
| N1 | CA2 | CH | CM | 45.5° | 60.0° |
| N1 | CA2 | CH | HH | 165.6° | 180.0° |
| H1 | N1 | CA2 | CB3 | 50.2° | 92.5° |
| H1 | N1 | CA2 | CH | 72.5° | 27.5° |
| H1 | N1 | CA2 | HA2 | 169.0° | 147.5° |
| CB3 | CA2 | CH | HA2 | 118.7° | 120.0° |
| CA2 | CB3 | CG1 | HB23 | 120.0° | 120.0° |
| CA2 | CB3 | CG1 | HB31 | 118.9° | 120.0° |
| CA2 | CB3 | HB23 | HB31 | 118.9° | 120.0° |
| CA2 | CB3 | CG1 | CD1 | 67.7° | 176.4° |
| CA2 | CB3 | CG1 | CD21 | 170.0° | 63.6° |
| CA2 | CB3 | CG1 | HG | 51.7° | 56.5° |
| CB3 | CA2 | CH | OH | 46.4° | 60.0° |
| CB3 | CA2 | CH | CM | 166.2° | 180.0° |
| CB3 | CA2 | CH | HH | 73.8° | 60.0° |
| CB3 | CA2 | N1 | C1 | 129.8° | 87.5° |
| CH | CA2 | CB3 | CG1 | 176.7° | 62.5° |
| CH | CA2 | CB3 | HB23 | 56.7° | 177.5° |
| CH | CA2 | CB3 | HB31 | 64.5° | 57.5° |
| CA2 | CH | OH | CM | 120.2° | 120.1° |
| CA2 | CH | OH | HH | 119.8° | 120.0° |
| CA2 | CH | CM | HH | 119.8° | 119.9° |
| CA2 | CH | OH | HO | 156.3° | 60.0° |
| CA2 | CH | CM | CA21 | 147.7° | 174.0° |
| CA2 | CH | CM | HM1 | 92.3° | 66.0° |
| CA2 | CH | CM | HM2 | 29.0° | 53.9° |
| CH | CA2 | N1 | C1 | 107.5° | 152.5° |
| HA2 | CA2 | CB3 | CG1 | 64.8° | 57.5° |
| HA2 | CA2 | CB3 | HB23 | 175.2° | 62.5° |
| HA2 | CA2 | CB3 | HB31 | 54.0° | 177.5° |
| HA2 | CA2 | CH | OH | 165.1° | 180.0° |
| HA2 | CA2 | CH | CM | 75.1° | 59.9° |
| HA2 | CA2 | CH | HH | 45.0° | 60.0° |
| HA2 | CA2 | N1 | C1 | 11.0° | 32.5° |
| CG1 | CB3 | HB23 | HB31 | 118.9° | 120.0° |
| CB3 | CG1 | CD1 | CD21 | 121.3° | 120.0° |
| CB3 | CG1 | CD1 | HG | 120.4° | 120.0° |
| CB3 | CG1 | CD21 | HG | 120.4° | 120.0° |
| CB3 | CG1 | CD1 | CE11 | 177.5° | 180.0° |
| CB3 | CG1 | CD1 | HD12 | 57.4° | 60.0° |
| CB3 | CG1 | CD1 | HD13 | 63.4° | 60.0° |
| CB3 | CG1 | CD21 | CE2 | 177.0° | 180.0° |
| CB3 | CG1 | CD21 | HD23 | 63.0° | 60.0° |
| CB3 | CG1 | CD21 | HD22 | 57.8° | 60.0° |
| HB23 | CB3 | CG1 | CD1 | 172.3° | 63.6° |
| HB23 | CB3 | CG1 | CD21 | 50.0° | 56.4° |
| HB23 | CB3 | CG1 | HG | 68.3° | 176.5° |
| HB31 | CB3 | CG1 | CD1 | 51.2° | 56.4° |
| HB31 | CB3 | CG1 | CD21 | 71.1° | 176.4° |
| HB31 | CB3 | CG1 | HG | 170.5° | 63.5° |
| CD1 | CG1 | CD21 | HG | 119.2° | 120.0° |
| CG1 | CD1 | CE11 | HD12 | 120.0° | 120.0° |
| CG1 | CD1 | CE11 | HD13 | 119.2° | 120.0° |
| CG1 | CD1 | HD12 | HD13 | 119.2° | 120.1° |
| CD1 | CG1 | CD21 | CE2 | 56.6° | 60.0° |
| CD1 | CG1 | CD21 | HD23 | 176.6° | 180.0° |
| CD1 | CG1 | CD21 | HD22 | 62.6° | 60.0° |
| CG1 | CD1 | CE11 | CZ | 55.8° | 60.0° |
| CG1 | CD1 | CE11 | HE12 | 175.8° | 180.0° |
| CG1 | CD1 | CE11 | HE13 | 64.3° | 60.0° |
| CD21 | CG1 | CD1 | CE11 | 56.2° | 60.0° |
| CD21 | CG1 | CD1 | HD12 | 63.8° | 60.0° |
| CD21 | CG1 | CD1 | HD13 | 175.3° | 180.0° |
| CG1 | CD21 | CE2 | HD23 | 120.0° | 120.0° |
| CG1 | CD21 | CE2 | HD22 | 119.3° | 120.0° |
| CG1 | CD21 | HD23 | HD22 | 119.3° | 120.0° |
| CG1 | CD21 | CE2 | CZ | 59.3° | 60.0° |
| CG1 | CD21 | CE2 | HE23 | 60.7° | 60.0° |
| CG1 | CD21 | CE2 | HE22 | 178.9° | 180.0° |
| HG | CG1 | CD1 | CE11 | 62.1° | 60.0° |
| HG | CG1 | CD1 | HD12 | 177.9° | 180.0° |
| HG | CG1 | CD1 | HD13 | 57.0° | 60.0° |
| HG | CG1 | CD21 | CE2 | 62.6° | 60.0° |
| HG | CG1 | CD21 | HD23 | 57.4° | 60.0° |
| HG | CG1 | CD21 | HD22 | 178.1° | 180.0° |
| CE11 | CD1 | HD12 | HD13 | 119.2° | 120.0° |
| CD1 | CE11 | CZ | HE12 | 120.0° | 120.0° |
| CD1 | CE11 | CZ | HE13 | 120.1° | 120.0° |
| CD1 | CE11 | HE12 | HE13 | 120.1° | 120.0° |
| CD1 | CE11 | CZ | CE2 | 57.7° | 60.0° |
| CD1 | CE11 | CZ | HZ2 | 62.3° | 60.0° |
| CD1 | CE11 | CZ | HZ3 | 177.9° | 180.0° |
| HD12 | CD1 | CE11 | CZ | 64.2° | 60.0° |
| HD12 | CD1 | CE11 | HE12 | 55.8° | 60.0° |
| HD12 | CD1 | CE11 | HE13 | 175.7° | 180.0° |
| HD13 | CD1 | CE11 | CZ | 175.0° | 180.0° |
| HD13 | CD1 | CE11 | HE12 | 65.0° | 60.0° |
| HD13 | CD1 | CE11 | HE13 | 54.9° | 60.0° |
| CE2 | CD21 | HD23 | HD22 | 119.2° | 120.0° |
| CD21 | CE2 | CZ | CE11 | 58.8° | 60.0° |
| CD21 | CE2 | CZ | HE23 | 120.0° | 120.0° |
| CD21 | CE2 | CZ | HE22 | 119.6° | 120.0° |
| CD21 | CE2 | HE23 | HE22 | 119.6° | 120.0° |
| CD21 | CE2 | CZ | HZ2 | 61.2° | 60.1° |
| CD21 | CE2 | CZ | HZ3 | 179.0° | 180.0° |
| HD23 | CD21 | CE2 | CZ | 179.3° | 180.0° |
| HD23 | CD21 | CE2 | HE23 | 59.3° | 60.0° |
| HD23 | CD21 | CE2 | HE22 | 61.1° | 60.0° |
| HD22 | CD21 | CE2 | CZ | 60.0° | 60.0° |
| HD22 | CD21 | CE2 | HE23 | 180.0° | 180.0° |
| HD22 | CD21 | CE2 | HE22 | 59.7° | 60.0° |
| CZ | CE11 | HE12 | HE13 | 120.1° | 120.0° |
| CE11 | CZ | CE2 | HZ2 | 120.0° | 120.1° |
| CE11 | CZ | CE2 | HZ3 | 120.2° | 120.0° |
| CE11 | CZ | CE2 | HE23 | 61.2° | 60.0° |
| CE11 | CZ | CE2 | HE22 | 178.4° | 180.0° |
| CE11 | CZ | HZ2 | HZ3 | 120.2° | 120.0° |
| HE12 | CE11 | CZ | CE2 | 177.7° | 180.0° |
| HE12 | CE11 | CZ | HZ2 | 57.7° | 60.0° |
| HE12 | CE11 | CZ | HZ3 | 62.1° | 60.0° |
| HE13 | CE11 | CZ | CE2 | 62.4° | 60.0° |
| HE13 | CE11 | CZ | HZ2 | 177.6° | 179.9° |
| HE13 | CE11 | CZ | HZ3 | 57.8° | 60.0° |
| CZ | CE2 | HE23 | HE22 | 119.6° | 120.1° |
| CE2 | CZ | HZ2 | HZ3 | 120.2° | 120.0° |
| HE23 | CE2 | CZ | HZ2 | 178.8° | 180.0° |
| HE23 | CE2 | CZ | HZ3 | 59.0° | 60.0° |
| HE22 | CE2 | CZ | HZ2 | 58.5° | 60.0° |
| HE22 | CE2 | CZ | HZ3 | 61.4° | 60.0° |
| OH | CH | CM | HH | 120.1° | 120.0° |
| OH | CH | CM | CA21 | 92.2° | 65.9° |
| OH | CH | CM | HM1 | 27.8° | 54.0° |
| OH | CH | CM | HM2 | 149.2° | 174.0° |
| CM | CH | OH | HO | 83.5° | 60.0° |
| CH | CM | CA21 | HM1 | 120.0° | 120.0° |
| CH | CM | CA21 | HM2 | 118.6° | 120.1° |
| CH | CM | HM1 | HM2 | 118.7° | 120.0° |
| CH | CM | CA21 | CB21 | 177.7° | 65.6° |
| CH | CM | CA21 | C2 | 64.2° | 174.3° |
| CH | CM | CA21 | HA21 | 56.6° | 54.4° |
| HH | CH | OH | HO | 36.6° | 180.0° |
| HH | CH | CM | CA21 | 28.0° | 54.0° |
| HH | CH | CM | HM1 | 148.0° | 174.0° |
| HH | CH | CM | HM2 | 90.7° | 66.0° |
| CA21 | CM | HM1 | HM2 | 118.7° | 120.0° |
| CM | CA21 | CB21 | C2 | 120.2° | 120.0° |
| CM | CA21 | CB21 | HA21 | 119.1° | 119.9° |
| CM | CA21 | C2 | HA21 | 119.1° | 120.0° |
| CM | CA21 | CB21 | CG2 | 116.2° | 51.5° |
| CM | CA21 | CB21 | HB24 | 3.8° | 171.5° |
| CM | CA21 | CB21 | HB25 | 124.4° | 68.5° |
| CM | CA21 | C2 | O2 | 61.0° | 0.3° |
| CM | CA21 | C2 | N2 | 119.6° | 179.8° |
| HM1 | CM | CA21 | CB21 | 57.7° | 54.3° |
| HM1 | CM | CA21 | C2 | 175.7° | 65.7° |
| HM1 | CM | CA21 | HA21 | 63.5° | 174.3° |
| HM2 | CM | CA21 | CB21 | 63.7° | 174.3° |
| HM2 | CM | CA21 | C2 | 54.4° | 54.3° |
| HM2 | CM | CA21 | HA21 | 175.2° | 65.7° |
| CB21 | CA21 | C2 | HA21 | 121.1° | 120.0° |
| CA21 | CB21 | CG2 | HB24 | 120.0° | 120.0° |
| CA21 | CB21 | CG2 | HB25 | 119.4° | 120.0° |
| CA21 | CB21 | HB24 | HB25 | 119.4° | 120.0° |
| CA21 | CB21 | CG2 | CD3 | 86.4° | 67.2° |
| CA21 | CB21 | CG2 | CD4 | 153.8° | 172.8° |
| CA21 | CB21 | CG2 | HG2 | 33.7° | 52.8° |
| CB21 | CA21 | C2 | O2 | 58.8° | 119.8° |
| CB21 | CA21 | C2 | N2 | 120.6° | 60.2° |
| C2 | CA21 | CB21 | CG2 | 123.7° | 68.6° |
| C2 | CA21 | CB21 | HB24 | 116.3° | 51.5° |
| C2 | CA21 | CB21 | HB25 | 4.2° | 171.4° |
| CA21 | C2 | O2 | N2 | 179.3° | 179.9° |
| CA21 | C2 | N2 | CA3 | 177.4° | 175.0° |
| CA21 | C2 | N2 | HN1 | 2.6° | 5.0° |
| HA21 | CA21 | CB21 | CG2 | 2.9° | 171.4° |
| HA21 | CA21 | CB21 | HB24 | 122.9° | 68.6° |
| HA21 | CA21 | CB21 | HB25 | 116.5° | 51.4° |
| HA21 | CA21 | C2 | O2 | 179.9° | 120.2° |
| HA21 | CA21 | C2 | N2 | 0.5° | 59.9° |
| CG2 | CB21 | HB24 | HB25 | 119.4° | 120.0° |
| CB21 | CG2 | CD3 | CD4 | 120.5° | 120.0° |
| CB21 | CG2 | CD3 | HG2 | 119.4° | 120.0° |
| CB21 | CG2 | CD4 | HG2 | 119.4° | 120.0° |
| CB21 | CG2 | CD3 | HD31 | 166.3° | 45.2° |
| CB21 | CG2 | CD3 | HD32 | 46.3° | 165.3° |
| CB21 | CG2 | CD3 | HD33 | 73.7° | 74.8° |
| CB21 | CG2 | CD4 | HD41 | 21.4° | 60.0° |
| CB21 | CG2 | CD4 | HD42 | 98.6° | 180.0° |
| CB21 | CG2 | CD4 | HD43 | 141.4° | 60.0° |
| HB24 | CB21 | CG2 | CD3 | 33.6° | 52.8° |
| HB24 | CB21 | CG2 | CD4 | 86.2° | 67.2° |
| HB24 | CB21 | CG2 | HG2 | 153.7° | 172.8° |
| HB25 | CB21 | CG2 | CD3 | 154.1° | 172.8° |
| HB25 | CB21 | CG2 | CD4 | 34.4° | 52.8° |
| HB25 | CB21 | CG2 | HG2 | 85.7° | 67.2° |
| CD3 | CG2 | CD4 | HG2 | 120.2° | 120.0° |
| CG2 | CD3 | HD31 | HD32 | 120.0° | 120.1° |
| CG2 | CD3 | HD31 | HD33 | 120.0° | 120.0° |
| CG2 | CD3 | HD32 | HD33 | 120.0° | 120.0° |
| CD3 | CG2 | CD4 | HD41 | 99.0° | 180.0° |
| CD3 | CG2 | CD4 | HD42 | 141.0° | 60.0° |
| CD3 | CG2 | CD4 | HD43 | 21.0° | 60.0° |
| CD4 | CG2 | CD3 | HD31 | 73.2° | 74.7° |
| CD4 | CG2 | CD3 | HD32 | 166.8° | 45.3° |
| CD4 | CG2 | CD3 | HD33 | 46.8° | 165.2° |
| CG2 | CD4 | HD41 | HD42 | 120.0° | 120.0° |
| CG2 | CD4 | HD41 | HD43 | 120.0° | 120.1° |
| CG2 | CD4 | HD42 | HD43 | 120.0° | 120.0° |
| HG2 | CG2 | CD3 | HD31 | 46.9° | 165.2° |
| HG2 | CG2 | CD3 | HD32 | 73.1° | 74.7° |
| HG2 | CG2 | CD3 | HD33 | 166.9° | 45.2° |
| HG2 | CG2 | CD4 | HD41 | 140.8° | 60.0° |
| HG2 | CG2 | CD4 | HD42 | 20.8° | 60.0° |
| HG2 | CG2 | CD4 | HD43 | 99.1° | 180.0° |
| HD31 | CD3 | HD32 | HD33 | 120.0° | 119.9° |
| HD41 | CD4 | HD42 | HD43 | 120.0° | 120.0° |
| O2 | C2 | N2 | CA3 | 3.3° | 5.0° |
| O2 | C2 | N2 | HN1 | 176.7° | 175.0° |
| CA3 | N2 | HN1 | C2 | 180.0° | 180.0° |
| N2 | CA3 | CB4 | HA11 | 120.0° | 120.1° |
| N2 | CA3 | CB4 | HA22 | 119.2° | 120.0° |
| N2 | CA3 | HA11 | HA22 | 119.3° | 120.0° |
| N2 | CA3 | CB4 | CG11 | 151.2° | 175.0° |
| N2 | CA3 | CB4 | CG21 | 30.8° | 65.0° |
| N2 | CA3 | CB4 | HB | 88.4° | 54.9° |
| HN1 | N2 | CA3 | CB4 | 72.7° | 0.0° |
| HN1 | N2 | CA3 | HA11 | 167.3° | 120.0° |
| HN1 | N2 | CA3 | HA22 | 46.5° | 120.0° |
| CB4 | CA3 | HA11 | HA22 | 119.2° | 120.0° |
| CA3 | CB4 | CG11 | CG21 | 124.8° | 119.9° |
| CA3 | CB4 | CG11 | HB | 115.5° | 120.1° |
| CA3 | CB4 | CG21 | HB | 115.4° | 120.0° |
| CA3 | CB4 | CG11 | CD11 | 108.8° | 175.0° |
| CA3 | CB4 | CG11 | HG11 | 131.2° | 65.0° |
| CA3 | CB4 | CG11 | HG12 | 9.8° | 55.1° |
| CA3 | CB4 | CG21 | HG21 | 68.5° | 180.0° |
| CA3 | CB4 | CG21 | HG22 | 171.5° | 60.1° |
| CA3 | CB4 | CG21 | HG23 | 51.5° | 60.0° |
| CB4 | CA3 | N2 | C2 | 107.3° | 180.0° |
| HA11 | CA3 | CB4 | CG11 | 31.1° | 64.9° |
| HA11 | CA3 | CB4 | CG21 | 89.2° | 55.0° |
| HA11 | CA3 | CB4 | HB | 151.6° | 175.0° |
| HA11 | CA3 | N2 | C2 | 12.7° | 60.0° |
| HA22 | CA3 | CB4 | CG11 | 89.6° | 55.0° |
| HA22 | CA3 | CB4 | CG21 | 150.0° | 175.0° |
| HA22 | CA3 | CB4 | HB | 30.8° | 65.0° |
| HA22 | CA3 | N2 | C2 | 133.5° | 60.0° |
| CG11 | CB4 | CG21 | HB | 120.8° | 120.0° |
| CB4 | CG11 | CD11 | HG11 | 120.0° | 120.1° |
| CB4 | CG11 | CD11 | HG12 | 118.5° | 119.9° |
| CB4 | CG11 | HG11 | HG12 | 118.6° | 120.0° |
| CG11 | CB4 | CG21 | HG21 | 55.3° | 60.0° |
| CG11 | CB4 | CG21 | HG22 | 64.7° | 180.0° |
| CG11 | CB4 | CG21 | HG23 | 175.3° | 60.0° |
| CB4 | CG11 | CD11 | HD11 | 152.8° | 59.9° |
| CB4 | CG11 | CD11 | HD21 | 32.8° | 60.1° |
| CB4 | CG11 | CD11 | HD3 | 87.2° | 180.0° |
| CG21 | CB4 | CG11 | CD11 | 126.4° | 65.1° |
| CG21 | CB4 | CG11 | HG11 | 6.4° | 55.0° |
| CG21 | CB4 | CG11 | HG12 | 115.1° | 175.0° |
| CB4 | CG21 | HG21 | HG22 | 120.0° | 119.9° |
| CB4 | CG21 | HG21 | HG23 | 120.0° | 120.0° |
| CB4 | CG21 | HG22 | HG23 | 120.0° | 120.0° |
| HB | CB4 | CG11 | CD11 | 6.8° | 54.9° |
| HB | CB4 | CG11 | HG11 | 113.2° | 175.0° |
| HB | CB4 | CG11 | HG12 | 125.3° | 65.0° |
| HB | CB4 | CG21 | HG21 | 176.1° | 60.0° |
| HB | CB4 | CG21 | HG22 | 56.1° | 60.0° |
| HB | CB4 | CG21 | HG23 | 63.9° | 180.0° |
| CD11 | CG11 | HG11 | HG12 | 118.6° | 120.0° |
| CG11 | CD11 | HD11 | HD21 | 120.0° | 120.0° |
| CG11 | CD11 | HD11 | HD3 | 120.0° | 120.0° |
| CG11 | CD11 | HD21 | HD3 | 120.0° | 119.9° |
| HG11 | CG11 | CD11 | HD11 | 87.2° | NaN° |
| HG11 | CG11 | CD11 | HD21 | 152.8° | 60.0° |
| HG11 | CG11 | CD11 | HD3 | 32.8° | 60.0° |
| HG12 | CG11 | CD11 | HD11 | 34.3° | 60.0° |
| HG12 | CG11 | CD11 | HD21 | 85.7° | 180.0° |
| HG12 | CG11 | CD11 | HD3 | 154.3° | 60.0° |
| HG21 | CG21 | HG22 | HG23 | 120.0° | 120.1° |
| HD11 | CD11 | HD21 | HD3 | 120.0° | 120.1° |
