15U
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C2 | sing | 1.53Å | 1.53Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C3 | C4 | sing | 1.51Å | 1.52Å | |
| C1 | N | sing | 1.47Å | 1.46Å | |
| C4 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C4 | C9 | sing | 1.38Å | 1.49Å | Aromatic |
| C41 | C51 | sing | 1.53Å | 1.53Å | |
| C41 | C31 | sing | 1.53Å | 1.52Å | |
| C5 | C6 | sing | 1.38Å | 1.40Å | Aromatic |
| C71 | C31 | sing | 1.53Å | 1.52Å | |
| C51 | N2 | sing | 1.47Å | 1.47Å | |
| N | C9 | sing | 1.39Å | 1.36Å | |
| C9 | C8 | doub | 1.40Å | 1.49Å | Aromatic |
| C31 | C21 | sing | 1.53Å | 1.53Å | |
| O | C | doub | 1.21Å | 1.22Å | |
| C6 | C7 | doub | 1.38Å | 1.40Å | Aromatic |
| N2 | C | sing | 1.35Å | 1.34Å | |
| N2 | C11 | sing | 1.47Å | 1.48Å | |
| C | CA | sing | 1.51Å | 1.51Å | |
| C8 | C7 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | S | sing | 1.76Å | 1.61Å | |
| C21 | C11 | sing | 1.53Å | 1.54Å | |
| C11 | C61 | sing | 1.51Å | 1.51Å | |
| NH2 | CZ | doub | 1.30Å | 1.27Å | |
| O11 | C61 | doub | 1.21Å | 1.25Å | |
| N1 | CA | sing | 1.46Å | 1.45Å | |
| N1 | S | sing | 1.66Å | 1.60Å | |
| C61 | O21 | sing | 1.34Å | 1.25Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| S | O1 | doub | 1.42Å | 1.44Å | |
| S | O2 | doub | 1.42Å | 1.44Å | |
| CG | CB | sing | 1.53Å | 1.52Å | |
| CG | CD | sing | 1.53Å | 1.52Å | |
| CZ | NH1 | sing | 1.38Å | 1.33Å | |
| CZ | NE | sing | 1.37Å | 1.33Å | |
| CD | NE | sing | 1.46Å | 1.45Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.08Å | 1.08Å | |
| C6 | H7 | sing | 1.08Å | 1.08Å | |
| C7 | H8 | sing | 1.08Å | 1.08Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| N | H12 | sing | 1.01Å | 1.00Å | |
| N1 | H13 | sing | 0.97Å | 1.00Å | |
| CA | H14 | sing | 1.09Å | 1.10Å | |
| CB | H15 | sing | 1.09Å | 1.10Å | |
| CB | H16 | sing | 1.09Å | 1.10Å | |
| CG | H17 | sing | 1.09Å | 1.10Å | |
| CG | H18 | sing | 1.09Å | 1.10Å | |
| CD | H19 | sing | 1.09Å | 1.10Å | |
| CD | H20 | sing | 1.09Å | 1.10Å | |
| NE | H21 | sing | 0.97Å | 1.00Å | |
| NH1 | H22 | sing | 0.97Å | 1.00Å | |
| NH1 | H23 | sing | 0.97Å | 1.00Å | |
| NH2 | H24 | sing | 0.97Å | 1.00Å | |
| C11 | H26 | sing | 1.09Å | 1.10Å | |
| C21 | H27 | sing | 1.09Å | 1.10Å | |
| C21 | H28 | sing | 1.09Å | 1.10Å | |
| C31 | H29 | sing | 1.09Å | 1.10Å | |
| C41 | H30 | sing | 1.09Å | 1.10Å | |
| C41 | H31 | sing | 1.09Å | 1.10Å | |
| C51 | H32 | sing | 1.09Å | 1.10Å | |
| C51 | H33 | sing | 1.09Å | 1.10Å | |
| O21 | H34 | sing | 0.97Å | 0.95Å | |
| C71 | H35 | sing | 1.09Å | 1.10Å | |
| C71 | H36 | sing | 1.09Å | 1.10Å | |
| C71 | H37 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | C2 | C3 | 111.6° | 109.7° |
| C10 | C2 | C1 | 111.2° | 109.8° |
| C10 | C2 | H3 | 108.0° | 109.7° |
| C2 | C10 | H9 | 109.5° | 109.5° |
| C2 | C10 | H10 | 109.5° | 109.4° |
| C2 | C10 | H11 | 109.5° | 109.4° |
| C3 | C2 | C1 | 109.8° | 108.0° |
| C2 | C3 | C4 | 109.9° | 109.6° |
| C3 | C2 | H3 | 108.0° | 109.8° |
| C2 | C3 | H4 | 109.4° | 109.5° |
| C2 | C3 | H5 | 109.3° | 109.4° |
| C2 | C1 | N | 110.4° | 108.7° |
| C2 | C1 | H1 | 109.2° | 109.6° |
| C2 | C1 | H2 | 109.2° | 109.8° |
| C1 | C2 | H3 | 108.0° | 109.8° |
| C3 | C4 | C5 | 120.4° | 118.1° |
| C3 | C4 | C9 | 120.4° | 122.0° |
| C4 | C3 | H4 | 109.4° | 109.5° |
| C4 | C3 | H5 | 109.4° | 109.4° |
| C1 | N | C9 | 120.4° | 113.1° |
| N | C1 | H1 | 109.2° | 109.6° |
| N | C1 | H2 | 109.2° | 109.5° |
| C1 | N | H12 | 106.7° | 111.0° |
| C5 | C4 | C9 | 119.1° | 119.9° |
| C4 | C5 | C6 | 120.6° | 120.5° |
| C4 | C5 | H6 | 119.7° | 119.8° |
| C4 | C9 | N | 119.6° | 123.0° |
| C4 | C9 | C8 | 118.2° | 119.4° |
| C51 | C41 | C31 | 107.9° | 109.4° |
| C41 | C51 | N2 | 107.5° | 109.0° |
| C51 | C41 | H30 | 109.9° | 109.5° |
| C51 | C41 | H31 | 109.8° | 109.5° |
| C41 | C51 | H32 | 110.0° | 109.6° |
| C41 | C51 | H33 | 110.0° | 109.6° |
| C41 | C31 | C71 | 112.2° | 109.4° |
| C41 | C31 | C21 | 108.6° | 109.5° |
| C41 | C31 | H29 | 107.9° | 109.5° |
| C31 | C41 | H30 | 109.9° | 109.6° |
| C31 | C41 | H31 | 109.9° | 109.3° |
| C5 | C6 | C7 | 122.3° | 119.9° |
| C6 | C5 | H6 | 119.7° | 119.7° |
| C5 | C6 | H7 | 118.8° | 120.1° |
| C71 | C31 | C21 | 112.3° | 109.4° |
| C71 | C31 | H29 | 107.9° | 109.4° |
| C31 | C71 | H35 | 109.5° | 109.5° |
| C31 | C71 | H36 | 109.5° | 109.5° |
| C31 | C71 | H37 | 109.5° | 109.4° |
| C51 | N2 | C | 124.2° | 120.6° |
| C51 | N2 | C11 | 114.8° | 118.7° |
| N2 | C51 | H32 | 110.0° | 109.6° |
| N2 | C51 | H33 | 110.0° | 109.3° |
| N | C9 | C8 | 122.2° | 117.7° |
| C9 | N | H12 | 106.7° | 111.0° |
| C9 | C8 | C7 | 118.1° | 120.5° |
| C9 | C8 | S | 121.9° | 119.8° |
| C31 | C21 | C11 | 113.1° | 109.3° |
| C31 | C21 | H27 | 108.6° | 109.5° |
| C31 | C21 | H28 | 108.6° | 109.5° |
| C21 | C31 | H29 | 107.8° | 109.5° |
| O | C | N2 | 121.3° | 120.0° |
| O | C | CA | 118.7° | 120.0° |
| C6 | C7 | C8 | 121.7° | 119.9° |
| C7 | C6 | H7 | 118.9° | 120.0° |
| C6 | C7 | H8 | 119.1° | 120.0° |
| C | N2 | C11 | 121.0° | 120.6° |
| N2 | C | CA | 120.0° | 120.0° |
| N2 | C11 | C21 | 110.2° | 108.8° |
| N2 | C11 | C61 | 111.1° | 109.6° |
| N2 | C11 | H26 | 107.6° | 109.6° |
| C | CA | N1 | 111.8° | 109.4° |
| C | CA | CB | 113.0° | 109.5° |
| C | CA | H14 | 107.3° | 109.5° |
| C7 | C8 | S | 120.0° | 119.8° |
| C8 | C7 | H8 | 119.1° | 120.1° |
| C8 | S | N1 | 108.1° | 107.2° |
| C8 | S | O1 | 111.9° | 106.4° |
| C8 | S | O2 | 110.0° | 106.4° |
| C21 | C11 | C61 | 113.5° | 109.6° |
| C21 | C11 | H26 | 106.9° | 109.7° |
| C11 | C21 | H27 | 108.6° | 109.5° |
| C11 | C21 | H28 | 108.5° | 109.5° |
| C11 | C61 | O11 | 118.5° | 120.0° |
| C11 | C61 | O21 | 119.3° | 120.0° |
| C61 | C11 | H26 | 107.2° | 109.6° |
| NH2 | CZ | NH1 | 120.1° | 120.0° |
| NH2 | CZ | NE | 121.6° | 120.0° |
| CZ | NH2 | H24 | 112.0° | 120.0° |
| O11 | C61 | O21 | 122.3° | 120.0° |
| CA | N1 | S | 120.0° | 120.0° |
| N1 | CA | CB | 109.2° | 109.5° |
| CA | N1 | H13 | 106.8° | 120.0° |
| N1 | CA | H14 | 108.1° | 109.4° |
| N1 | S | O1 | 108.6° | 106.4° |
| N1 | S | O2 | 109.1° | 106.4° |
| S | N1 | H13 | 106.8° | 120.0° |
| C61 | O21 | H34 | 109.5° | 117.0° |
| CA | CB | CG | 113.5° | 109.5° |
| CB | CA | H14 | 107.1° | 109.5° |
| CA | CB | H15 | 108.5° | 109.4° |
| CA | CB | H16 | 108.5° | 109.4° |
| O1 | S | O2 | 109.1° | 123.1° |
| CB | CG | CD | 110.6° | 109.5° |
| CG | CB | H15 | 108.5° | 109.5° |
| CG | CB | H16 | 108.5° | 109.5° |
| CB | CG | H17 | 109.2° | 109.5° |
| CB | CG | H18 | 109.2° | 109.5° |
| CG | CD | NE | 110.8° | 109.5° |
| CD | CG | H17 | 109.2° | 109.5° |
| CD | CG | H18 | 109.2° | 109.5° |
| CG | CD | H19 | 109.1° | 109.5° |
| CG | CD | H20 | 109.1° | 109.5° |
| NH1 | CZ | NE | 118.3° | 120.0° |
| CZ | NH1 | H22 | 120.0° | 120.0° |
| CZ | NH1 | H23 | 120.0° | 120.0° |
| CZ | NE | CD | 123.6° | 120.0° |
| CZ | NE | H21 | 118.2° | 120.0° |
| NE | CD | H19 | 109.2° | 109.4° |
| NE | CD | H20 | 109.1° | 109.5° |
| CD | NE | H21 | 118.2° | 120.0° |
| H1 | C1 | H2 | 109.5° | 109.6° |
| H4 | C3 | H5 | 109.5° | 109.4° |
| H9 | C10 | H10 | 109.5° | 109.5° |
| H9 | C10 | H11 | 109.5° | 109.5° |
| H10 | C10 | H11 | 109.5° | 109.5° |
| H15 | CB | H16 | 109.5° | 109.5° |
| H17 | CG | H18 | 109.5° | 109.4° |
| H19 | CD | H20 | 109.5° | 109.4° |
| H22 | NH1 | H23 | 120.0° | 120.0° |
| H27 | C21 | H28 | 109.5° | 109.5° |
| H30 | C41 | H31 | 109.5° | 109.5° |
| H32 | C51 | H33 | 109.5° | 109.7° |
| H35 | C71 | H36 | 109.4° | 109.5° |
| H35 | C71 | H37 | 109.5° | 109.4° |
| H36 | C71 | H37 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | C2 | C3 | C1 | 123.8° | 119.6° |
| C10 | C2 | C3 | H3 | 118.7° | 120.7° |
| C10 | C2 | C1 | H3 | 118.4° | 120.7° |
| C10 | C2 | C3 | C4 | 174.6° | 166.9° |
| C10 | C2 | C1 | N | 173.9° | 172.1° |
| C10 | C2 | C1 | H1 | 65.9° | 68.1° |
| C10 | C2 | C1 | H2 | 53.8° | 52.4° |
| C10 | C2 | C3 | H4 | 65.3° | 73.0° |
| C10 | C2 | C3 | H5 | 54.6° | 46.9° |
| C2 | C10 | H9 | H10 | 120.0° | 120.0° |
| C2 | C10 | H9 | H11 | 120.0° | 120.0° |
| C2 | C10 | H10 | H11 | 120.0° | 119.9° |
| C3 | C2 | C1 | H3 | 117.6° | 119.7° |
| C2 | C3 | C4 | H4 | 120.0° | 120.1° |
| C2 | C3 | C4 | H5 | 120.0° | 120.0° |
| C3 | C2 | C1 | N | 62.1° | 68.3° |
| C2 | C3 | C4 | C5 | 158.6° | 164.3° |
| C2 | C3 | C4 | C9 | 21.2° | 15.7° |
| C3 | C2 | C1 | H1 | 58.1° | 51.5° |
| C3 | C2 | C1 | H2 | 177.8° | 172.0° |
| C2 | C3 | H4 | H5 | 119.8° | 119.9° |
| C3 | C2 | C10 | H9 | 180.0° | 60.0° |
| C3 | C2 | C10 | H10 | 60.0° | 180.0° |
| C3 | C2 | C10 | H11 | 60.0° | 60.0° |
| C1 | C2 | C3 | C4 | 50.9° | 47.3° |
| C2 | C1 | N | H1 | 120.1° | 119.8° |
| C2 | C1 | N | H2 | 120.1° | 119.9° |
| C2 | C1 | N | C9 | 41.5° | 53.4° |
| C2 | C1 | H1 | H2 | 119.6° | 120.5° |
| C1 | C2 | C3 | H4 | 170.9° | 167.4° |
| C1 | C2 | C3 | H5 | 69.2° | 72.7° |
| C1 | C2 | C10 | H9 | 57.0° | 178.5° |
| C1 | C2 | C10 | H10 | 63.0° | 61.5° |
| C1 | C2 | C10 | H11 | 177.0° | 58.5° |
| C2 | C1 | N | H12 | 163.0° | 178.9° |
| C3 | C4 | C5 | C9 | 179.8° | 180.0° |
| C3 | C4 | C5 | C6 | 179.8° | 179.8° |
| C3 | C4 | C9 | N | 0.2° | 0.9° |
| C3 | C4 | C9 | C8 | 179.9° | 179.5° |
| C4 | C3 | C2 | H3 | 66.7° | 72.4° |
| C4 | C3 | H4 | H5 | 119.8° | 119.9° |
| C3 | C4 | C5 | H6 | 0.2° | 0.2° |
| C1 | N | C9 | C4 | 10.4° | 20.3° |
| C1 | N | C9 | H12 | 121.5° | 125.5° |
| C1 | N | C9 | C8 | 169.3° | 160.1° |
| N | C1 | H1 | H2 | 119.6° | 120.3° |
| N | C1 | C2 | H3 | 55.5° | 51.4° |
| C4 | C5 | C6 | H6 | 180.0° | 180.0° |
| C5 | C4 | C9 | N | 180.0° | 179.1° |
| C5 | C4 | C9 | C8 | 0.3° | 0.5° |
| C4 | C5 | C6 | C7 | 0.1° | 0.1° |
| C5 | C4 | C3 | H4 | 38.6° | 44.2° |
| C5 | C4 | C3 | H5 | 81.3° | 75.7° |
| C4 | C5 | C6 | H7 | 179.9° | 179.9° |
| C9 | C4 | C5 | C6 | 0.0° | 0.3° |
| C4 | C9 | N | C8 | 179.7° | 179.6° |
| C4 | C9 | C8 | C7 | 0.5° | 0.3° |
| C4 | C9 | C8 | S | 179.6° | 179.7° |
| C9 | C4 | C3 | H4 | 141.2° | 135.8° |
| C9 | C4 | C3 | H5 | 98.8° | 104.3° |
| C9 | C4 | C5 | H6 | 180.0° | 179.7° |
| C4 | C9 | N | H12 | 131.9° | 145.8° |
| C51 | C41 | C31 | H30 | 119.8° | 120.1° |
| C51 | C41 | C31 | H31 | 119.7° | 119.9° |
| C51 | C41 | C31 | C71 | 173.1° | 58.8° |
| C41 | C51 | N2 | H32 | 119.7° | 120.0° |
| C41 | C51 | N2 | H33 | 119.7° | 119.8° |
| C51 | C41 | C31 | C21 | 62.2° | 61.2° |
| C41 | C51 | N2 | C | 120.1° | 126.4° |
| C41 | C51 | N2 | C11 | 61.3° | 53.3° |
| C51 | C41 | C31 | H29 | 54.4° | 178.7° |
| C51 | C41 | H30 | H31 | 120.7° | 120.1° |
| C41 | C51 | H32 | H33 | 120.9° | 120.4° |
| C41 | C31 | C71 | C21 | 122.7° | 120.1° |
| C41 | C31 | C71 | H29 | 118.7° | 120.0° |
| C31 | C41 | C51 | N2 | 64.8° | 54.4° |
| C41 | C31 | C21 | H29 | 116.7° | 120.1° |
| C41 | C31 | C21 | C11 | 54.4° | 61.3° |
| C41 | C31 | C21 | H27 | 174.9° | 178.7° |
| C41 | C31 | C21 | H28 | 66.1° | 58.7° |
| C31 | C41 | H30 | H31 | 120.7° | 119.9° |
| C31 | C41 | C51 | H32 | 175.5° | 174.4° |
| C31 | C41 | C51 | H33 | 54.9° | 65.2° |
| C41 | C31 | C71 | H35 | 180.0° | 180.0° |
| C41 | C31 | C71 | H36 | 60.0° | 59.9° |
| C41 | C31 | C71 | H37 | 60.0° | 60.1° |
| C5 | C6 | C7 | H7 | 180.0° | 179.9° |
| C5 | C6 | C7 | C8 | 0.1° | 0.3° |
| C5 | C6 | C7 | H8 | 179.9° | 179.9° |
| C71 | C31 | C21 | H29 | 118.7° | 119.9° |
| C71 | C31 | C21 | C11 | 179.0° | 58.7° |
| C71 | C31 | C21 | H27 | 60.4° | 61.3° |
| C71 | C31 | C21 | H28 | 58.5° | 178.6° |
| C71 | C31 | C41 | H30 | 53.3° | 61.3° |
| C71 | C31 | C41 | H31 | 67.2° | 178.7° |
| C31 | C71 | H35 | H36 | 120.0° | 120.0° |
| C31 | C71 | H35 | H37 | 120.0° | 120.0° |
| C31 | C71 | H36 | H37 | 120.0° | 120.0° |
| C51 | N2 | C | O | 0.7° | 174.1° |
| C51 | N2 | C | C11 | 178.5° | 179.7° |
| C51 | N2 | C | CA | 179.4° | 5.9° |
| C51 | N2 | C11 | C21 | 52.3° | 53.4° |
| C51 | N2 | C11 | C61 | 74.4° | 173.1° |
| C51 | N2 | C11 | H26 | 168.5° | 66.6° |
| N2 | C51 | C41 | H30 | 175.4° | 174.6° |
| N2 | C51 | C41 | H31 | 54.9° | 65.3° |
| N2 | C51 | H32 | H33 | 120.9° | 120.0° |
| N | C9 | C8 | C7 | 179.8° | 179.3° |
| N | C9 | C8 | S | 0.7° | 0.7° |
| C9 | N | C1 | H1 | 78.7° | 66.4° |
| C9 | N | C1 | H2 | 161.6° | 173.3° |
| C9 | C8 | C7 | C6 | 0.4° | 0.1° |
| C9 | C8 | C7 | S | 179.2° | 180.0° |
| C9 | C8 | S | N1 | 53.1° | 95.8° |
| C9 | C8 | S | O1 | 66.4° | 17.8° |
| C9 | C8 | S | O2 | 172.1° | 150.7° |
| C9 | C8 | C7 | H8 | 179.6° | 179.9° |
| C8 | C9 | N | H12 | 47.8° | 34.6° |
| C31 | C21 | C11 | N2 | 48.0° | 54.6° |
| C31 | C21 | C11 | H27 | 120.6° | 120.0° |
| C31 | C21 | C11 | H28 | 120.6° | 120.0° |
| C31 | C21 | C11 | C61 | 77.3° | 174.4° |
| C31 | C21 | C11 | H26 | 164.7° | 65.2° |
| C31 | C21 | H27 | H28 | 118.4° | 120.0° |
| C21 | C31 | C41 | H30 | 178.0° | 178.7° |
| C21 | C31 | C41 | H31 | 57.6° | 58.7° |
| C21 | C31 | C71 | H35 | 57.3° | 60.0° |
| C21 | C31 | C71 | H36 | 177.3° | 180.0° |
| C21 | C31 | C71 | H37 | 62.7° | 60.0° |
| O | C | N2 | CA | 179.9° | 180.0° |
| O | C | N2 | C11 | 179.2° | 6.2° |
| O | C | CA | N1 | 27.9° | 22.5° |
| O | C | CA | CB | 95.8° | 97.5° |
| O | C | CA | H14 | 146.3° | 142.5° |
| C6 | C7 | C8 | H8 | 180.0° | 179.9° |
| C6 | C7 | C8 | S | 179.6° | 179.9° |
| C7 | C6 | C5 | H6 | 179.9° | 179.9° |
| C | N2 | C11 | C21 | 129.1° | 126.4° |
| C | N2 | C11 | C61 | 104.2° | 6.6° |
| N2 | C | CA | N1 | 152.0° | 157.5° |
| N2 | C | CA | CB | 84.3° | 82.5° |
| N2 | C | CA | H14 | 33.6° | 37.5° |
| C | N2 | C11 | H26 | 12.8° | 113.7° |
| C | N2 | C51 | H32 | 0.4° | 6.4° |
| C | N2 | C51 | H33 | 120.2° | 113.8° |
| C11 | N2 | C | CA | 0.9° | 173.8° |
| N2 | C11 | C21 | C61 | 125.3° | 119.8° |
| N2 | C11 | C21 | H26 | 116.6° | 119.9° |
| N2 | C11 | C61 | H26 | 117.3° | 120.3° |
| N2 | C11 | C61 | O11 | 21.2° | 55.4° |
| N2 | C11 | C61 | O21 | 159.2° | 124.7° |
| N2 | C11 | C21 | H27 | 168.6° | 174.6° |
| N2 | C11 | C21 | H28 | 72.5° | 65.3° |
| C11 | N2 | C51 | H32 | 179.0° | 173.3° |
| C11 | N2 | C51 | H33 | 58.3° | 66.5° |
| C | CA | N1 | CB | 125.9° | 120.0° |
| C | CA | N1 | H14 | 117.9° | 120.0° |
| C | CA | N1 | S | 105.8° | 135.3° |
| C | CA | CB | H14 | 118.0° | 120.0° |
| C | CA | CB | CG | 49.7° | 178.7° |
| C | CA | N1 | H13 | 15.7° | 44.7° |
| C | CA | CB | H15 | 70.9° | 61.3° |
| C | CA | CB | H16 | 170.3° | 58.7° |
| C7 | C8 | S | N1 | 126.0° | 84.2° |
| C7 | C8 | S | O1 | 114.5° | 162.2° |
| C7 | C8 | S | O2 | 7.0° | 29.3° |
| C8 | C7 | C6 | H7 | 179.9° | 179.8° |
| C8 | S | N1 | CA | 66.4° | 65.6° |
| C8 | S | N1 | O1 | 121.6° | 113.6° |
| C8 | S | N1 | O2 | 119.6° | 113.5° |
| C8 | S | O1 | O2 | 122.0° | 123.0° |
| S | C8 | C7 | H8 | 0.4° | 0.1° |
| C8 | S | N1 | H13 | 55.1° | 114.4° |
| C21 | C11 | C61 | H26 | 117.9° | 120.4° |
| C21 | C11 | C61 | O11 | 146.1° | 63.9° |
| C21 | C11 | C61 | O21 | 34.4° | 116.1° |
| C11 | C21 | H27 | H28 | 118.3° | 120.1° |
| C11 | C21 | C31 | H29 | 62.3° | 178.6° |
| C11 | C61 | O11 | O21 | 179.6° | 180.0° |
| C61 | C11 | C21 | H27 | 43.2° | 65.6° |
| C61 | C11 | C21 | H28 | 162.1° | 54.4° |
| C11 | C61 | O21 | H34 | 179.6° | 180.0° |
| NH2 | CZ | NH1 | NE | 180.0° | 180.0° |
| NH2 | CZ | NE | CD | 4.7° | 180.0° |
| NH2 | CZ | NE | H21 | 175.3° | 0.0° |
| NH2 | CZ | NH1 | H22 | 180.0° | 180.0° |
| NH2 | CZ | NH1 | H23 | 0.0° | 0.0° |
| O11 | C61 | C11 | H26 | 96.1° | 175.6° |
| O11 | C61 | O21 | H34 | 0.0° | 0.0° |
| CA | N1 | S | H13 | 121.5° | 180.0° |
| N1 | CA | CB | H14 | 116.9° | 120.0° |
| CA | N1 | S | O1 | 172.0° | 47.9° |
| CA | N1 | S | O2 | 53.2° | 179.2° |
| N1 | CA | CB | CG | 75.5° | 61.3° |
| N1 | CA | CB | H15 | 163.9° | 58.7° |
| N1 | CA | CB | H16 | 45.1° | 178.7° |
| S | N1 | CA | CB | 128.3° | 104.7° |
| N1 | S | O1 | O2 | 118.8° | 122.9° |
| S | N1 | CA | H14 | 12.1° | 15.3° |
| O21 | C61 | C11 | H26 | 83.5° | 4.4° |
| CA | CB | CG | H15 | 120.6° | 120.0° |
| CA | CB | CG | H16 | 120.6° | 120.0° |
| CA | CB | CG | CD | 164.1° | 177.2° |
| CB | CA | N1 | H13 | 110.2° | 75.3° |
| CA | CB | H15 | H16 | 118.2° | 119.9° |
| CA | CB | CG | H17 | 75.7° | 57.1° |
| CA | CB | CG | H18 | 44.0° | 62.8° |
| O1 | S | N1 | H13 | 66.5° | 132.0° |
| O2 | S | N1 | H13 | 174.7° | 0.9° |
| CB | CG | CD | H17 | 120.2° | 120.0° |
| CB | CG | CD | H18 | 120.2° | 120.0° |
| CB | CG | CD | NE | 138.1° | 180.0° |
| CG | CB | CA | H14 | 167.7° | 58.7° |
| CG | CB | H15 | H16 | 118.2° | 120.1° |
| CB | CG | H17 | H18 | 119.5° | 120.0° |
| CB | CG | CD | H19 | 101.7° | 60.0° |
| CB | CG | CD | H20 | 17.9° | 60.0° |
| CG | CD | NE | CZ | 92.1° | 180.0° |
| CG | CD | NE | H19 | 120.2° | 120.0° |
| CG | CD | NE | H20 | 120.2° | 120.1° |
| CD | CG | CB | H15 | 43.5° | 62.8° |
| CD | CG | CB | H16 | 75.3° | 57.2° |
| CD | CG | H17 | H18 | 119.5° | 120.0° |
| CG | CD | H19 | H20 | 119.4° | 120.0° |
| CG | CD | NE | H21 | 87.8° | 0.0° |
| NH1 | CZ | NE | CD | 175.3° | 0.0° |
| NH1 | CZ | NE | H21 | 4.7° | 180.0° |
| CZ | NH1 | H22 | H23 | 180.0° | 180.0° |
| NH1 | CZ | NH2 | H24 | 180.0° | 180.0° |
| CZ | NE | CD | H21 | 180.0° | 180.0° |
| CZ | NE | CD | H19 | 28.0° | 60.0° |
| CZ | NE | CD | H20 | 147.7° | 59.9° |
| NE | CZ | NH1 | H22 | 0.0° | 0.0° |
| NE | CZ | NH1 | H23 | 180.0° | 180.0° |
| NE | CZ | NH2 | H24 | 0.0° | 0.0° |
| NE | CD | CG | H17 | 17.9° | 60.0° |
| NE | CD | CG | H18 | 101.8° | 59.9° |
| NE | CD | H19 | H20 | 119.4° | 120.0° |
| H1 | C1 | C2 | H3 | 175.7° | 171.2° |
| H1 | C1 | N | H12 | 42.9° | 59.1° |
| H2 | C1 | C2 | H3 | 64.6° | 68.4° |
| H2 | C1 | N | H12 | 76.8° | 61.1° |
| H3 | C2 | C3 | H4 | 53.3° | 47.7° |
| H3 | C2 | C3 | H5 | 173.2° | 167.6° |
| H3 | C2 | C10 | H9 | 61.4° | 60.7° |
| H3 | C2 | C10 | H10 | 178.6° | 59.3° |
| H3 | C2 | C10 | H11 | 58.7° | 179.3° |
| H6 | C5 | C6 | H7 | 0.1° | 0.1° |
| H7 | C6 | C7 | H8 | 0.1° | 0.1° |
| H9 | C10 | H10 | H11 | 120.0° | 120.0° |
| H13 | N1 | CA | H14 | 133.6° | 164.7° |
| H14 | CA | CB | H15 | 47.1° | 178.7° |
| H14 | CA | CB | H16 | 71.7° | 61.4° |
| H15 | CB | CG | H17 | 163.7° | 177.1° |
| H15 | CB | CG | H18 | 76.6° | 57.2° |
| H16 | CB | CG | H17 | 44.9° | 62.8° |
| H16 | CB | CG | H18 | 164.6° | 177.2° |
| H17 | CG | CD | H19 | 138.1° | 180.0° |
| H17 | CG | CD | H20 | 102.3° | 60.1° |
| H18 | CG | CD | H19 | 18.4° | 60.0° |
| H18 | CG | CD | H20 | 138.0° | 180.0° |
| H19 | CD | NE | H21 | 152.0° | 120.0° |
| H20 | CD | NE | H21 | 32.4° | 120.0° |
| H26 | C11 | C21 | H27 | 74.8° | 54.7° |
| H26 | C11 | C21 | H28 | 44.1° | 174.8° |
| H27 | C21 | C31 | H29 | 58.3° | 58.6° |
| H28 | C21 | C31 | H29 | 177.2° | 61.4° |
| H29 | C31 | C41 | H30 | 65.3° | 58.6° |
| H29 | C31 | C41 | H31 | 174.2° | 61.4° |
| H29 | C31 | C71 | H35 | 61.3° | 60.0° |
| H29 | C31 | C71 | H36 | 58.7° | 60.0° |
| H29 | C31 | C71 | H37 | 178.6° | 179.9° |
| H30 | C41 | C51 | H32 | 55.7° | 65.4° |
| H30 | C41 | C51 | H33 | 64.9° | 55.0° |
| H31 | C41 | C51 | H32 | 64.7° | 54.7° |
| H31 | C41 | C51 | H33 | 174.6° | 175.1° |
| H35 | C71 | H36 | H37 | 120.0° | 120.0° |
