R5K
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL20 | C19 | sing | 1.74Å | 1.78Å | |
| C19 | C18 | doub | 1.38Å | 1.53Å | Aromatic |
| C19 | C21 | sing | 1.38Å | 1.32Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.31Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.53Å | Aromatic |
| C17 | C16 | doub | 1.39Å | 1.53Å | Aromatic |
| C22 | C16 | sing | 1.39Å | 1.32Å | Aromatic |
| C16 | N15 | sing | 1.40Å | 1.47Å | |
| N15 | C13 | sing | 1.35Å | 1.48Å | |
| C13 | O14 | doub | 1.21Å | 1.18Å | |
| C13 | C12 | sing | 1.49Å | 1.54Å | |
| O11 | C12 | doub | 1.21Å | 1.19Å | |
| C12 | N10 | sing | 1.35Å | 1.48Å | |
| N10 | C09 | sing | 1.46Å | 1.45Å | |
| C23 | C09 | sing | 1.53Å | 1.48Å | |
| C23 | C24 | sing | 1.53Å | 1.47Å | |
| C09 | C08 | sing | 1.53Å | 1.58Å | |
| C24 | C25 | sing | 1.53Å | 1.50Å | |
| C08 | N07 | sing | 1.47Å | 1.37Å | |
| N07 | C25 | sing | 1.47Å | 1.35Å | |
| N07 | C06 | sing | 1.47Å | 1.30Å | |
| C25 | C30 | sing | 1.53Å | 1.56Å | |
| C25 | C26 | sing | 1.53Å | 1.57Å | |
| C30 | C29 | sing | 1.53Å | 1.54Å | |
| C29 | C28 | sing | 1.53Å | 1.51Å | |
| C06 | C05 | sing | 1.53Å | 1.57Å | |
| C26 | C27 | sing | 1.53Å | 1.55Å | |
| C05 | N04 | sing | 1.47Å | 1.50Å | |
| N04 | C02 | sing | 1.35Å | 1.48Å | |
| C28 | C27 | sing | 1.53Å | 1.52Å | |
| C02 | C01 | sing | 1.51Å | 1.55Å | |
| C02 | O03 | doub | 1.21Å | 1.19Å | |
| NH2 | CZ | doub | 1.30Å | 1.25Å | |
| C01 | CB | sing | 1.53Å | 1.56Å | |
| CG | CB | sing | 1.53Å | 1.56Å | |
| CG | CD | sing | 1.53Å | 1.56Å | |
| CZ | NH1 | sing | 1.37Å | 1.27Å | |
| CZ | NE | sing | 1.38Å | 1.49Å | |
| CD | NE | sing | 1.46Å | 1.47Å | |
| CB | H1 | sing | 1.09Å | 1.10Å | |
| CB | H2 | sing | 1.09Å | 1.10Å | |
| CG | H3 | sing | 1.09Å | 1.10Å | |
| CG | H4 | sing | 1.09Å | 1.10Å | |
| CD | H5 | sing | 1.09Å | 1.10Å | |
| CD | H6 | sing | 1.09Å | 1.10Å | |
| NE | H7 | sing | 0.97Å | 1.00Å | |
| NH1 | H8 | sing | 0.97Å | 1.00Å | |
| NH1 | H9 | sing | 0.97Å | 1.00Å | |
| NH2 | H10 | sing | 0.97Å | 1.00Å | |
| C01 | H11 | sing | 1.09Å | 1.10Å | |
| C01 | H12 | sing | 1.09Å | 1.10Å | |
| C05 | H13 | sing | 1.09Å | 1.10Å | |
| C05 | H14 | sing | 1.09Å | 1.10Å | |
| C06 | H15 | sing | 1.09Å | 1.10Å | |
| C06 | H16 | sing | 1.09Å | 1.10Å | |
| C08 | H17 | sing | 1.09Å | 1.10Å | |
| C08 | H18 | sing | 1.09Å | 1.10Å | |
| C09 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.08Å | 1.08Å | |
| C18 | H21 | sing | 1.08Å | 1.08Å | |
| C21 | H22 | sing | 1.08Å | 1.08Å | |
| C22 | H23 | sing | 1.08Å | 1.08Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C24 | H26 | sing | 1.09Å | 1.10Å | |
| C24 | H27 | sing | 1.09Å | 1.10Å | |
| C26 | H28 | sing | 1.09Å | 1.10Å | |
| C26 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.09Å | 1.10Å | |
| C27 | H31 | sing | 1.09Å | 1.10Å | |
| C28 | H32 | sing | 1.09Å | 1.10Å | |
| C28 | H33 | sing | 1.09Å | 1.10Å | |
| C29 | H34 | sing | 1.09Å | 1.10Å | |
| C29 | H35 | sing | 1.09Å | 1.10Å | |
| C30 | H36 | sing | 1.09Å | 1.10Å | |
| C30 | H37 | sing | 1.09Å | 1.10Å | |
| N04 | H38 | sing | 0.97Å | 1.00Å | |
| N10 | H40 | sing | 0.97Å | 1.00Å | |
| N15 | H41 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL20 | C19 | C18 | 118.3° | 119.9° |
| CL20 | C19 | C21 | 120.4° | 120.0° |
| C18 | C19 | C21 | 121.2° | 120.1° |
| C19 | C18 | C17 | 119.9° | 120.1° |
| C19 | C18 | H21 | 120.1° | 120.0° |
| C19 | C21 | C22 | 118.9° | 120.1° |
| C19 | C21 | H22 | 120.6° | 119.9° |
| C18 | C17 | C16 | 119.3° | 119.9° |
| C18 | C17 | H20 | 120.4° | 120.1° |
| C17 | C18 | H21 | 120.1° | 119.9° |
| C21 | C22 | C16 | 119.9° | 119.9° |
| C22 | C21 | H22 | 120.5° | 120.0° |
| C21 | C22 | H23 | 120.0° | 120.0° |
| C17 | C16 | C22 | 120.8° | 119.9° |
| C17 | C16 | N15 | 118.1° | 120.0° |
| C16 | C17 | H20 | 120.4° | 120.0° |
| C22 | C16 | N15 | 121.2° | 120.1° |
| C16 | C22 | H23 | 120.0° | 120.1° |
| C16 | N15 | C13 | 120.9° | 120.1° |
| C16 | N15 | H41 | 119.5° | 119.9° |
| N15 | C13 | O14 | 122.2° | 120.0° |
| N15 | C13 | C12 | 119.4° | 120.0° |
| C13 | N15 | H41 | 119.6° | 120.0° |
| O14 | C13 | C12 | 118.4° | 120.0° |
| C13 | C12 | O11 | 120.2° | 120.0° |
| C13 | C12 | N10 | 117.2° | 120.0° |
| O11 | C12 | N10 | 122.6° | 120.0° |
| C12 | N10 | C09 | 123.9° | 120.0° |
| C12 | N10 | H40 | 118.0° | 120.0° |
| N10 | C09 | C23 | 111.0° | 109.6° |
| N10 | C09 | C08 | 105.5° | 109.5° |
| N10 | C09 | H19 | 111.8° | 109.5° |
| C09 | N10 | H40 | 118.1° | 120.0° |
| C09 | C23 | C24 | 115.6° | 109.1° |
| C23 | C09 | C08 | 107.1° | 109.3° |
| C23 | C09 | H19 | 111.3° | 109.5° |
| C09 | C23 | H24 | 108.0° | 109.5° |
| C09 | C23 | H25 | 107.9° | 109.5° |
| C23 | C24 | C25 | 115.2° | 109.3° |
| C24 | C23 | H24 | 107.9° | 109.5° |
| C24 | C23 | H25 | 107.9° | 109.5° |
| C23 | C24 | H26 | 108.0° | 109.5° |
| C23 | C24 | H27 | 108.0° | 109.5° |
| C09 | C08 | N07 | 113.8° | 109.6° |
| C09 | C08 | H17 | 108.4° | 109.4° |
| C09 | C08 | H18 | 108.4° | 109.4° |
| C08 | C09 | H19 | 109.8° | 109.5° |
| C24 | C25 | N07 | 113.1° | 109.6° |
| C24 | C25 | C30 | 109.4° | 109.4° |
| C24 | C25 | C26 | 98.0° | 109.4° |
| C25 | C24 | H26 | 108.0° | 109.5° |
| C25 | C24 | H27 | 108.0° | 109.5° |
| C08 | N07 | C25 | 118.6° | 111.2° |
| C08 | N07 | C06 | 107.1° | 111.0° |
| N07 | C08 | H17 | 108.4° | 109.5° |
| N07 | C08 | H18 | 108.4° | 109.5° |
| C25 | N07 | C06 | 113.2° | 111.0° |
| N07 | C25 | C30 | 103.6° | 109.5° |
| N07 | C25 | C26 | 120.1° | 109.5° |
| N07 | C06 | C05 | 110.3° | 109.5° |
| N07 | C06 | H15 | 109.3° | 109.5° |
| N07 | C06 | H16 | 109.3° | 109.5° |
| C30 | C25 | C26 | 112.6° | 109.5° |
| C25 | C30 | C29 | 109.2° | 109.5° |
| C25 | C30 | H36 | 109.5° | 109.5° |
| C25 | C30 | H37 | 109.5° | 109.5° |
| C25 | C26 | C27 | 111.9° | 109.5° |
| C25 | C26 | H28 | 108.9° | 109.5° |
| C25 | C26 | H29 | 108.9° | 109.5° |
| C30 | C29 | C28 | 112.1° | 109.4° |
| C30 | C29 | H34 | 108.8° | 109.5° |
| C30 | C29 | H35 | 108.8° | 109.5° |
| C29 | C30 | H36 | 109.5° | 109.5° |
| C29 | C30 | H37 | 109.5° | 109.4° |
| C29 | C28 | C27 | 115.5° | 109.5° |
| C29 | C28 | H32 | 107.9° | 109.5° |
| C29 | C28 | H33 | 107.9° | 109.5° |
| C28 | C29 | H34 | 108.8° | 109.5° |
| C28 | C29 | H35 | 108.8° | 109.5° |
| C06 | C05 | N04 | 109.4° | 109.5° |
| C06 | C05 | H13 | 109.5° | 109.5° |
| C06 | C05 | H14 | 109.5° | 109.5° |
| C05 | C06 | H15 | 109.2° | 109.4° |
| C05 | C06 | H16 | 109.3° | 109.5° |
| C26 | C27 | C28 | 109.8° | 109.5° |
| C27 | C26 | H28 | 108.9° | 109.4° |
| C27 | C26 | H29 | 108.8° | 109.5° |
| C26 | C27 | H30 | 109.4° | 109.5° |
| C26 | C27 | H31 | 109.4° | 109.4° |
| C05 | N04 | C02 | 119.6° | 120.0° |
| N04 | C05 | H13 | 109.5° | 109.5° |
| N04 | C05 | H14 | 109.5° | 109.4° |
| C05 | N04 | H38 | 120.2° | 119.9° |
| N04 | C02 | C01 | 119.9° | 120.0° |
| N04 | C02 | O03 | 120.6° | 120.0° |
| C02 | N04 | H38 | 120.2° | 120.1° |
| C28 | C27 | H30 | 109.4° | 109.5° |
| C28 | C27 | H31 | 109.4° | 109.5° |
| C27 | C28 | H32 | 108.0° | 109.5° |
| C27 | C28 | H33 | 108.0° | 109.4° |
| C01 | C02 | O03 | 119.5° | 120.0° |
| C02 | C01 | CB | 108.1° | 109.5° |
| C02 | C01 | H11 | 109.8° | 109.5° |
| C02 | C01 | H12 | 109.8° | 109.5° |
| NH2 | CZ | NH1 | 120.0° | 120.0° |
| NH2 | CZ | NE | 120.0° | 120.0° |
| CZ | NH2 | H10 | 112.0° | 120.0° |
| C01 | CB | CG | 108.6° | 109.5° |
| C01 | CB | H1 | 109.7° | 109.5° |
| C01 | CB | H2 | 109.7° | 109.5° |
| CB | C01 | H11 | 109.8° | 109.5° |
| CB | C01 | H12 | 109.8° | 109.4° |
| CB | CG | CD | 109.7° | 109.5° |
| CG | CB | H1 | 109.7° | 109.5° |
| CG | CB | H2 | 109.7° | 109.5° |
| CB | CG | H3 | 109.4° | 109.5° |
| CB | CG | H4 | 109.4° | 109.4° |
| CG | CD | NE | 110.4° | 109.5° |
| CD | CG | H3 | 109.4° | 109.5° |
| CD | CG | H4 | 109.4° | 109.4° |
| CG | CD | H5 | 109.3° | 109.5° |
| CG | CD | H6 | 109.3° | 109.4° |
| NH1 | CZ | NE | 120.0° | 120.0° |
| CZ | NH1 | H8 | 120.0° | 120.0° |
| CZ | NH1 | H9 | 120.0° | 120.0° |
| CZ | NE | CD | 119.9° | 120.0° |
| CZ | NE | H7 | 120.0° | 120.0° |
| NE | CD | H5 | 109.2° | 109.5° |
| NE | CD | H6 | 109.2° | 109.4° |
| CD | NE | H7 | 120.1° | 120.0° |
| H1 | CB | H2 | 109.4° | 109.5° |
| H3 | CG | H4 | 109.4° | 109.5° |
| H5 | CD | H6 | 109.5° | 109.5° |
| H8 | NH1 | H9 | 120.0° | 120.0° |
| H11 | C01 | H12 | 109.5° | 109.4° |
| H13 | C05 | H14 | 109.5° | 109.5° |
| H15 | C06 | H16 | 109.5° | 109.5° |
| H17 | C08 | H18 | 109.4° | 109.5° |
| H24 | C23 | H25 | 109.5° | 109.6° |
| H26 | C24 | H27 | 109.4° | 109.5° |
| H28 | C26 | H29 | 109.4° | 109.5° |
| H30 | C27 | H31 | 109.5° | 109.5° |
| H32 | C28 | H33 | 109.5° | 109.4° |
| H34 | C29 | H35 | 109.5° | 109.5° |
| H36 | C30 | H37 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL20 | C19 | C18 | C21 | 179.8° | 180.0° |
| CL20 | C19 | C18 | C17 | 179.9° | 180.0° |
| CL20 | C19 | C21 | C22 | 179.9° | 179.7° |
| CL20 | C19 | C18 | H21 | 0.1° | 0.0° |
| CL20 | C19 | C21 | H22 | 0.1° | 0.0° |
| C19 | C18 | C17 | H21 | 180.0° | 180.0° |
| C18 | C19 | C21 | C22 | 0.3° | 0.3° |
| C19 | C18 | C17 | C16 | 0.3° | 0.0° |
| C19 | C18 | C17 | H20 | 179.7° | 180.0° |
| C18 | C19 | C21 | H22 | 179.7° | 179.9° |
| C21 | C19 | C18 | C17 | 0.1° | 0.0° |
| C19 | C21 | C22 | H22 | 180.0° | 179.8° |
| C19 | C21 | C22 | C16 | 0.1° | 0.5° |
| C21 | C19 | C18 | H21 | 179.9° | 180.0° |
| C19 | C21 | C22 | H23 | 179.9° | 180.0° |
| C18 | C17 | C16 | H20 | 180.0° | 180.0° |
| C18 | C17 | C16 | C22 | 0.5° | 0.3° |
| C18 | C17 | C16 | N15 | 179.4° | 180.0° |
| C21 | C22 | C16 | C17 | 0.3° | 0.5° |
| C21 | C22 | C16 | H23 | 180.0° | 179.5° |
| C21 | C22 | C16 | N15 | 179.2° | 179.7° |
| C17 | C16 | C22 | N15 | 178.9° | 179.8° |
| C17 | C16 | N15 | C13 | 137.9° | 35.1° |
| C16 | C17 | C18 | H21 | 179.7° | 180.0° |
| C17 | C16 | C22 | H23 | 179.7° | 180.0° |
| C17 | C16 | N15 | H41 | 42.1° | 144.9° |
| C22 | C16 | N15 | C13 | 41.0° | 145.1° |
| C22 | C16 | C17 | H20 | 179.5° | 179.8° |
| C16 | C22 | C21 | H22 | 179.9° | 179.7° |
| C22 | C16 | N15 | H41 | 139.0° | 34.9° |
| C16 | N15 | C13 | H41 | 180.0° | 180.0° |
| C16 | N15 | C13 | O14 | 1.2° | 4.6° |
| C16 | N15 | C13 | C12 | 179.1° | 175.4° |
| N15 | C16 | C17 | H20 | 0.6° | 0.0° |
| N15 | C16 | C22 | H23 | 0.8° | 0.2° |
| N15 | C13 | O14 | C12 | 179.7° | 179.9° |
| N15 | C13 | C12 | O11 | 0.2° | 0.1° |
| N15 | C13 | C12 | N10 | 179.7° | 180.0° |
| O14 | C13 | C12 | O11 | 179.9° | 179.9° |
| O14 | C13 | C12 | N10 | 0.0° | 0.1° |
| O14 | C13 | N15 | H41 | 178.8° | 175.4° |
| C13 | C12 | O11 | N10 | 179.9° | 179.9° |
| C13 | C12 | N10 | C09 | 179.9° | 179.9° |
| C13 | C12 | N10 | H40 | 0.1° | 0.0° |
| C12 | C13 | N15 | H41 | 0.9° | 4.6° |
| O11 | C12 | N10 | C09 | 0.2° | 0.1° |
| O11 | C12 | N10 | H40 | 179.8° | 179.9° |
| C12 | N10 | C09 | H40 | 180.0° | 180.0° |
| C12 | N10 | C09 | C23 | 56.2° | 85.2° |
| C12 | N10 | C09 | C08 | 171.9° | 155.0° |
| C12 | N10 | C09 | H19 | 68.8° | 34.9° |
| N10 | C09 | C23 | C08 | 114.7° | 120.0° |
| N10 | C09 | C23 | H19 | 125.2° | 120.1° |
| N10 | C09 | C23 | C24 | 125.2° | 177.6° |
| N10 | C09 | C08 | H19 | 120.6° | 120.0° |
| N10 | C09 | C08 | N07 | 172.2° | 179.2° |
| N10 | C09 | C08 | H17 | 67.1° | 60.8° |
| N10 | C09 | C08 | H18 | 51.6° | 59.2° |
| N10 | C09 | C23 | H24 | 4.3° | 57.8° |
| N10 | C09 | C23 | H25 | 113.9° | 62.5° |
| C09 | C23 | C24 | H24 | 120.9° | 119.9° |
| C09 | C23 | C24 | H25 | 120.9° | 119.9° |
| C23 | C09 | C08 | H19 | 121.0° | 119.9° |
| C09 | C23 | C24 | C25 | 36.7° | 57.7° |
| C23 | C09 | C08 | N07 | 53.9° | 59.2° |
| C23 | C09 | C08 | H17 | 174.5° | 179.2° |
| C23 | C09 | C08 | H18 | 66.8° | 60.9° |
| C09 | C23 | H24 | H25 | 117.2° | 120.2° |
| C09 | C23 | C24 | H26 | 84.2° | 177.6° |
| C09 | C23 | C24 | H27 | 157.6° | 62.3° |
| C23 | C09 | N10 | H40 | 123.8° | 94.8° |
| C24 | C23 | C09 | C08 | 10.4° | 57.7° |
| C23 | C24 | C25 | H26 | 120.9° | 119.9° |
| C23 | C24 | C25 | H27 | 120.9° | 120.0° |
| C23 | C24 | C25 | N07 | 46.8° | 59.2° |
| C23 | C24 | C25 | C30 | 68.0° | 179.2° |
| C23 | C24 | C25 | C26 | 174.5° | 60.9° |
| C24 | C23 | C09 | H19 | 109.6° | 62.3° |
| C24 | C23 | H24 | H25 | 117.2° | 120.2° |
| C23 | C24 | H26 | H27 | 117.4° | 120.1° |
| C09 | C08 | N07 | H17 | 120.6° | 120.0° |
| C09 | C08 | N07 | H18 | 120.7° | 120.0° |
| C09 | C08 | N07 | C25 | 48.2° | 61.7° |
| C09 | C08 | N07 | C06 | 177.8° | 174.2° |
| C09 | C08 | H17 | H18 | 118.1° | 119.9° |
| C08 | C09 | C23 | H24 | 110.4° | 62.2° |
| C08 | C09 | C23 | H25 | 131.3° | 177.5° |
| C08 | C09 | N10 | H40 | 8.0° | 25.1° |
| C24 | C25 | N07 | C08 | 2.5° | 61.7° |
| C24 | C25 | N07 | C30 | 118.3° | 120.0° |
| C24 | C25 | N07 | C26 | 115.0° | 120.0° |
| C24 | C25 | N07 | C06 | 124.3° | 174.2° |
| C24 | C25 | C30 | C26 | 107.9° | 119.9° |
| C24 | C25 | C30 | C29 | 59.9° | 59.8° |
| C24 | C25 | C26 | C27 | 123.3° | 59.8° |
| C25 | C24 | C23 | H24 | 157.6° | 62.2° |
| C25 | C24 | C23 | H25 | 84.2° | 177.6° |
| C25 | C24 | H26 | H27 | 117.4° | 120.1° |
| C24 | C25 | C26 | H28 | 116.4° | 179.8° |
| C24 | C25 | C26 | H29 | 2.9° | 60.2° |
| C24 | C25 | C30 | H36 | 60.1° | 60.2° |
| C24 | C25 | C30 | H37 | 179.8° | 179.8° |
| C08 | N07 | C25 | C06 | 126.7° | 124.1° |
| C08 | N07 | C25 | C30 | 115.8° | 178.4° |
| C08 | N07 | C25 | C26 | 117.5° | 58.4° |
| C08 | N07 | C06 | C05 | 80.5° | 66.1° |
| C08 | N07 | C06 | H15 | 39.6° | 174.0° |
| C08 | N07 | C06 | H16 | 159.4° | 54.0° |
| N07 | C08 | H17 | H18 | 118.0° | 120.0° |
| N07 | C08 | C09 | H19 | 67.2° | 60.8° |
| N07 | C25 | C30 | C26 | 131.3° | 120.0° |
| N07 | C25 | C30 | C29 | 179.2° | 179.9° |
| C25 | N07 | C06 | C05 | 146.9° | 169.7° |
| N07 | C25 | C26 | C27 | 114.1° | 179.9° |
| C25 | N07 | C06 | H15 | 93.0° | 49.7° |
| C25 | N07 | C06 | H16 | 26.8° | 70.3° |
| C25 | N07 | C08 | H17 | 168.8° | 178.3° |
| C25 | N07 | C08 | H18 | 72.5° | 58.3° |
| N07 | C25 | C24 | H26 | 74.0° | 179.1° |
| N07 | C25 | C24 | H27 | 167.7° | 60.8° |
| N07 | C25 | C26 | H28 | 6.3° | 60.1° |
| N07 | C25 | C26 | H29 | 125.6° | 59.9° |
| N07 | C25 | C30 | H36 | 60.8° | 59.9° |
| N07 | C25 | C30 | H37 | 59.3° | 60.1° |
| C06 | N07 | C25 | C30 | 117.4° | 54.2° |
| C06 | N07 | C25 | C26 | 9.2° | 65.8° |
| N07 | C06 | C05 | H15 | 120.1° | 120.0° |
| N07 | C06 | C05 | H16 | 120.1° | 120.1° |
| N07 | C06 | C05 | N04 | 42.2° | 180.0° |
| N07 | C06 | C05 | H13 | 77.8° | 60.0° |
| N07 | C06 | C05 | H14 | 162.2° | 60.1° |
| N07 | C06 | H15 | H16 | 119.7° | 120.1° |
| C06 | N07 | C08 | H17 | 61.6° | 54.2° |
| C06 | N07 | C08 | H18 | 57.1° | 65.8° |
| C25 | C30 | C29 | H36 | 119.9° | 120.0° |
| C25 | C30 | C29 | H37 | 119.9° | 120.0° |
| C25 | C30 | C29 | C28 | 58.7° | 60.0° |
| C30 | C25 | C26 | C27 | 8.3° | 60.0° |
| C30 | C25 | C24 | H26 | 171.1° | 60.9° |
| C30 | C25 | C24 | H27 | 52.8° | 59.2° |
| C30 | C25 | C26 | H28 | 128.7° | 59.9° |
| C30 | C25 | C26 | H29 | 112.1° | 179.9° |
| C25 | C30 | C29 | H34 | 61.7° | 180.0° |
| C25 | C30 | C29 | H35 | 179.1° | 60.0° |
| C25 | C30 | H36 | H37 | 120.1° | 120.0° |
| C26 | C25 | C30 | C29 | 48.0° | 60.1° |
| C25 | C26 | C27 | H28 | 120.4° | 120.0° |
| C25 | C26 | C27 | H29 | 120.4° | 120.0° |
| C25 | C26 | C27 | C28 | 55.8° | 60.0° |
| C26 | C25 | C24 | H26 | 53.6° | 59.0° |
| C26 | C25 | C24 | H27 | 64.6° | 179.1° |
| C25 | C26 | H28 | H29 | 118.9° | 120.1° |
| C25 | C26 | C27 | H30 | 64.2° | 180.0° |
| C25 | C26 | C27 | H31 | 175.9° | 60.0° |
| C26 | C25 | C30 | H36 | 167.9° | 179.9° |
| C26 | C25 | C30 | H37 | 72.0° | 59.9° |
| C30 | C29 | C28 | H34 | 120.4° | 120.0° |
| C30 | C29 | C28 | H35 | 120.4° | 120.0° |
| C30 | C29 | C28 | C27 | 10.6° | 60.0° |
| C30 | C29 | C28 | H32 | 131.5° | 60.1° |
| C30 | C29 | C28 | H33 | 110.3° | 180.0° |
| C30 | C29 | H34 | H35 | 118.8° | 120.0° |
| C29 | C30 | H36 | H37 | 120.1° | 120.0° |
| C29 | C28 | C27 | C26 | 46.6° | 60.0° |
| C29 | C28 | C27 | H32 | 120.9° | 120.1° |
| C29 | C28 | C27 | H33 | 120.9° | 120.0° |
| C29 | C28 | C27 | H30 | 73.4° | 180.0° |
| C29 | C28 | C27 | H31 | 166.7° | 60.0° |
| C29 | C28 | H32 | H33 | 117.3° | 120.0° |
| C28 | C29 | H34 | H35 | 118.8° | 120.0° |
| C28 | C29 | C30 | H36 | 178.7° | 180.0° |
| C28 | C29 | C30 | H37 | 61.2° | 60.0° |
| C06 | C05 | N04 | H13 | 120.0° | 120.1° |
| C06 | C05 | N04 | H14 | 120.0° | 120.0° |
| C06 | C05 | N04 | C02 | 69.3° | 180.0° |
| C06 | C05 | H13 | H14 | 120.0° | 120.0° |
| C05 | C06 | H15 | H16 | 119.6° | 120.0° |
| C06 | C05 | N04 | H38 | 110.7° | 0.1° |
| C26 | C27 | C28 | H30 | 120.1° | 120.0° |
| C26 | C27 | C28 | H31 | 120.1° | 120.0° |
| C27 | C26 | H28 | H29 | 118.9° | 120.0° |
| C26 | C27 | H30 | H31 | 119.8° | 120.0° |
| C26 | C27 | C28 | H32 | 74.2° | 60.1° |
| C26 | C27 | C28 | H33 | 167.5° | 180.0° |
| C05 | N04 | C02 | H38 | 180.0° | 180.0° |
| C05 | N04 | C02 | C01 | 179.6° | 180.0° |
| C05 | N04 | C02 | O03 | 0.1° | 0.0° |
| N04 | C05 | H13 | H14 | 120.0° | 119.9° |
| N04 | C05 | C06 | H15 | 162.4° | 60.0° |
| N04 | C05 | C06 | H16 | 77.9° | 59.9° |
| N04 | C02 | C01 | O03 | 179.7° | 180.0° |
| N04 | C02 | C01 | CB | 158.4° | 180.0° |
| N04 | C02 | C01 | H11 | 38.6° | 60.0° |
| N04 | C02 | C01 | H12 | 81.9° | 60.0° |
| C02 | N04 | C05 | H13 | 170.7° | 59.9° |
| C02 | N04 | C05 | H14 | 50.6° | 60.0° |
| C28 | C27 | C26 | H28 | 176.2° | 60.0° |
| C28 | C27 | C26 | H29 | 64.5° | 180.0° |
| C28 | C27 | H30 | H31 | 119.8° | 120.0° |
| C27 | C28 | H32 | H33 | 117.3° | 119.9° |
| C27 | C28 | C29 | H34 | 109.7° | 180.0° |
| C27 | C28 | C29 | H35 | 131.0° | 60.0° |
| C02 | C01 | CB | H11 | 119.8° | 120.1° |
| C02 | C01 | CB | H12 | 119.8° | 120.0° |
| C02 | C01 | CB | CG | 106.6° | 180.0° |
| C02 | C01 | CB | H1 | 133.5° | 59.9° |
| C02 | C01 | CB | H2 | 13.3° | 60.0° |
| C02 | C01 | H11 | H12 | 120.6° | 120.0° |
| C01 | C02 | N04 | H38 | 0.4° | 0.0° |
| O03 | C02 | C01 | CB | 21.3° | 0.0° |
| O03 | C02 | C01 | H11 | 141.1° | 120.0° |
| O03 | C02 | C01 | H12 | 98.5° | 120.0° |
| O03 | C02 | N04 | H38 | 179.9° | 180.0° |
| NH2 | CZ | NH1 | NE | 179.5° | 180.0° |
| NH2 | CZ | NE | CD | 0.5° | 180.0° |
| NH2 | CZ | NE | H7 | 179.5° | 0.1° |
| NH2 | CZ | NH1 | H8 | 179.5° | 180.0° |
| NH2 | CZ | NH1 | H9 | 0.5° | 0.0° |
| C01 | CB | CG | H1 | 119.9° | 120.0° |
| C01 | CB | CG | H2 | 119.9° | 120.0° |
| C01 | CB | CG | CD | 166.6° | 179.9° |
| C01 | CB | H1 | H2 | 120.4° | 120.0° |
| C01 | CB | CG | H3 | 73.4° | 60.0° |
| C01 | CB | CG | H4 | 46.5° | 60.0° |
| CB | C01 | H11 | H12 | 120.7° | 119.9° |
| CB | CG | CD | H3 | 120.1° | 120.0° |
| CB | CG | CD | H4 | 120.0° | 120.0° |
| CB | CG | CD | NE | 73.6° | 180.0° |
| CG | CB | H1 | H2 | 120.4° | 120.0° |
| CB | CG | H3 | H4 | 119.9° | 120.0° |
| CB | CG | CD | H5 | 166.3° | 60.0° |
| CB | CG | CD | H6 | 46.5° | 60.0° |
| CG | CB | C01 | H11 | 13.2° | 60.0° |
| CG | CB | C01 | H12 | 133.7° | 60.0° |
| CG | CD | NE | CZ | 97.1° | 180.0° |
| CG | CD | NE | H5 | 120.1° | 120.0° |
| CG | CD | NE | H6 | 120.1° | 119.9° |
| CD | CG | CB | H1 | 46.7° | 60.0° |
| CD | CG | CB | H2 | 73.6° | 60.0° |
| CD | CG | H3 | H4 | 119.9° | 120.0° |
| CG | CD | H5 | H6 | 119.6° | 120.0° |
| CG | CD | NE | H7 | 82.9° | 0.1° |
| NH1 | CZ | NE | CD | 180.0° | 0.1° |
| NH1 | CZ | NE | H7 | 0.0° | 180.0° |
| CZ | NH1 | H8 | H9 | 180.0° | 179.9° |
| NH1 | CZ | NH2 | H10 | 179.5° | 179.9° |
| CZ | NE | CD | H7 | 180.0° | 179.9° |
| CZ | NE | CD | H5 | 23.0° | 59.9° |
| CZ | NE | CD | H6 | 142.7° | 60.1° |
| NE | CZ | NH1 | H8 | 0.0° | 0.1° |
| NE | CZ | NH1 | H9 | 180.0° | 180.0° |
| NE | CZ | NH2 | H10 | 0.0° | 0.0° |
| NE | CD | CG | H3 | 46.5° | 60.0° |
| NE | CD | CG | H4 | 166.3° | 60.1° |
| NE | CD | H5 | H6 | 119.6° | 120.0° |
| H1 | CB | CG | H3 | 166.7° | 60.0° |
| H1 | CB | CG | H4 | 73.3° | 180.0° |
| H1 | CB | C01 | H11 | 106.7° | 180.0° |
| H1 | CB | C01 | H12 | 13.8° | 60.1° |
| H2 | CB | CG | H3 | 46.5° | NaN° |
| H2 | CB | CG | H4 | 166.4° | 60.0° |
| H2 | CB | C01 | H11 | 133.1° | 60.0° |
| H2 | CB | C01 | H12 | 106.5° | 179.9° |
| H3 | CG | CD | H5 | 73.7° | NaN° |
| H3 | CG | CD | H6 | 166.6° | 60.0° |
| H4 | CG | CD | H5 | 46.2° | 60.0° |
| H4 | CG | CD | H6 | 73.5° | 180.0° |
| H5 | CD | NE | H7 | 157.0° | 119.9° |
| H6 | CD | NE | H7 | 37.3° | 120.0° |
| H13 | C05 | C06 | H15 | 42.4° | 60.0° |
| H13 | C05 | C06 | H16 | 162.1° | 180.0° |
| H13 | C05 | N04 | H38 | 9.3° | 120.0° |
| H14 | C05 | C06 | H15 | 77.7° | 180.0° |
| H14 | C05 | C06 | H16 | 42.1° | 60.0° |
| H14 | C05 | N04 | H38 | 129.3° | 120.0° |
| H17 | C08 | C09 | H19 | 53.5° | 59.3° |
| H18 | C08 | C09 | H19 | 172.2° | 179.2° |
| H19 | C09 | C23 | H24 | 129.5° | 177.9° |
| H19 | C09 | C23 | H25 | 11.3° | 57.6° |
| H19 | C09 | N10 | H40 | 111.2° | 145.1° |
| H20 | C17 | C18 | H21 | 0.3° | 0.1° |
| H22 | C21 | C22 | H23 | 0.0° | 0.2° |
| H24 | C23 | C24 | H26 | 36.7° | 57.7° |
| H24 | C23 | C24 | H27 | 81.5° | 177.8° |
| H25 | C23 | C24 | H26 | 154.9° | 62.5° |
| H25 | C23 | C24 | H27 | 36.7° | 57.6° |
| H28 | C26 | C27 | H30 | 56.1° | 60.0° |
| H28 | C26 | C27 | H31 | 63.7° | 180.0° |
| H29 | C26 | C27 | H30 | 175.4° | 59.9° |
| H29 | C26 | C27 | H31 | 55.5° | 60.1° |
| H30 | C27 | C28 | H32 | 165.7° | 59.9° |
| H30 | C27 | C28 | H33 | 47.5° | 60.0° |
| H31 | C27 | C28 | H32 | 45.8° | 179.9° |
| H31 | C27 | C28 | H33 | 72.4° | 60.0° |
| H32 | C28 | C29 | H34 | 11.2° | 60.0° |
| H32 | C28 | C29 | H35 | 108.1° | 180.0° |
| H33 | C28 | C29 | H34 | 129.4° | 60.0° |
| H33 | C28 | C29 | H35 | 10.1° | 60.0° |
| H34 | C29 | C30 | H36 | 58.3° | 60.0° |
| H34 | C29 | C30 | H37 | 178.4° | 60.0° |
| H35 | C29 | C30 | H36 | 61.0° | 60.1° |
| H35 | C29 | C30 | H37 | 59.1° | 179.9° |
