EKW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OM1 | MO | doub | 1.66Å | 1.70Å | |
| MO | OR1 | sing | 1.66Å | 1.81Å | |
| MO | S7' | sing | 2.30Å | 2.37Å | |
| MO | S8' | sing | 2.28Å | 2.47Å | |
| MO | OM2 | sing | 1.66Å | 1.79Å | |
| N1 | C6 | sing | 1.37Å | 1.36Å | |
| N1 | C1' | sing | 1.50Å | 1.48Å | |
| N1 | C2 | sing | 1.40Å | 1.37Å | |
| C2 | N3 | sing | 1.36Å | 1.35Å | |
| C2 | O2 | doub | 1.24Å | 1.27Å | |
| N3 | C4 | doub | 1.34Å | 1.36Å | |
| C4 | C5 | sing | 1.42Å | 1.36Å | |
| C4 | N4 | sing | 1.33Å | 1.35Å | |
| C5 | C6 | doub | 1.34Å | 1.35Å | |
| C1' | O4D | sing | 1.41Å | 1.34Å | |
| C1' | C2D | sing | 1.54Å | 1.52Å | |
| C2D | C3' | sing | 1.54Å | 1.51Å | |
| C2D | O2' | sing | 1.42Å | 1.39Å | |
| C3' | C4D | sing | 1.54Å | 1.53Å | |
| C3' | O3' | sing | 1.42Å | 1.44Å | |
| C4D | O4D | sing | 1.44Å | 1.44Å | |
| C4D | C5' | sing | 1.51Å | 1.52Å | |
| C5' | O5' | sing | 1.45Å | 1.45Å | |
| O5' | PA | sing | 1.59Å | 1.59Å | |
| PA | O2A | doub | 1.48Å | 1.47Å | |
| PA | O1A | sing | 1.52Å | 1.49Å | |
| PA | O3A | sing | 1.59Å | 1.58Å | |
| O3A | PB | sing | 1.59Å | 1.60Å | |
| PB | O3B | sing | 1.59Å | 1.56Å | |
| PB | O1B | doub | 1.48Å | 1.48Å | |
| PB | O2B | sing | 1.52Å | 1.52Å | |
| O3B | C10 | sing | 1.44Å | 1.41Å | |
| C10 | C9' | sing | 1.53Å | 1.50Å | |
| C9' | O9' | sing | 1.44Å | 1.44Å | |
| C9' | C8' | sing | 1.52Å | 1.46Å | |
| C8' | S8' | sing | 1.68Å | 1.77Å | |
| C8' | C7' | doub | 1.36Å | 1.38Å | |
| C7' | S7' | sing | 1.68Å | 1.75Å | |
| C7' | C6' | sing | 1.54Å | 1.48Å | |
| C6' | N5' | sing | 1.46Å | 1.45Å | |
| C6' | C7 | sing | 1.56Å | 1.52Å | |
| C7 | N8' | sing | 1.46Å | 1.41Å | |
| C7 | O9' | sing | 1.44Å | 1.42Å | |
| N5' | C4A | sing | 1.39Å | 1.37Å | |
| C4A | C4B | doub | 1.41Å | 1.43Å | |
| C4A | C4' | sing | 1.44Å | 1.41Å | |
| N8' | C4B | sing | 1.36Å | 1.37Å | |
| C4B | N1' | sing | 1.36Å | 1.33Å | |
| N1' | C2' | doub | 1.34Å | 1.34Å | |
| C2' | N2' | sing | 1.33Å | 1.35Å | |
| C2' | N3' | sing | 1.37Å | 1.36Å | |
| N3' | C4' | sing | 1.39Å | 1.35Å | |
| C4' | O4' | doub | 1.23Å | 1.26Å | |
| OR1 | H2 | sing | 0.87Å | 0.95Å | |
| OM2 | H3 | sing | 0.87Å | 0.95Å | |
| C5 | H4 | sing | 0.94Å | 1.08Å | |
| C6 | H5 | sing | 0.94Å | 1.08Å | |
| N4 | H6 | sing | 0.88Å | 1.00Å | |
| N4 | H7 | sing | 0.88Å | 1.00Å | |
| C1' | H8 | sing | 0.99Å | 1.10Å | |
| C2D | H9 | sing | 0.98Å | 1.10Å | |
| O2' | H10 | sing | 0.84Å | 0.95Å | |
| C3' | H11 | sing | 0.99Å | 1.10Å | |
| C4D | H12 | sing | 0.99Å | 1.10Å | |
| O3' | H13 | sing | 0.84Å | 0.95Å | |
| C5' | H14 | sing | 0.99Å | 1.10Å | |
| C5' | H15 | sing | 0.99Å | 1.10Å | |
| O1A | H16 | sing | 0.89Å | 0.95Å | |
| O2B | H17 | sing | 0.89Å | 0.95Å | |
| C10 | H18 | sing | 0.98Å | 1.10Å | |
| C10 | H19 | sing | 0.98Å | 1.10Å | |
| C9' | H20 | sing | 0.99Å | 1.10Å | |
| C6' | H21 | sing | 0.99Å | 1.10Å | |
| C7 | H22 | sing | 0.99Å | 1.10Å | |
| N8' | H23 | sing | 0.88Å | 1.00Å | |
| N2' | H24 | sing | 0.88Å | 1.00Å | |
| N2' | H25 | sing | 0.88Å | 1.00Å | |
| H1 | N5' | sing | 0.87Å | 1.00Å | |
| H26 | N3' | sing | 0.88Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OM1 | MO | OR1 | 108.2° | 92.1° |
| OM1 | MO | S7' | 104.7° | 89.4° |
| OM1 | MO | S8' | 102.0° | 89.1° |
| OM1 | MO | OM2 | 109.1° | 91.9° |
| OR1 | MO | S7' | 80.6° | 92.5° |
| OR1 | MO | S8' | 147.6° | 175.2° |
| OR1 | MO | OM2 | 98.3° | 91.1° |
| MO | OR1 | H2 | 109.5° | 113.5° |
| S7' | MO | S8' | 80.5° | 82.9° |
| S7' | MO | OM2 | 144.5° | 176.1° |
| MO | S7' | C7' | 109.5° | 108.0° |
| S8' | MO | OM2 | 82.5° | 93.5° |
| MO | S8' | C8' | 107.0° | 108.9° |
| MO | OM2 | H3 | 109.5° | 112.1° |
| C6 | N1 | C1' | 117.5° | 122.2° |
| C6 | N1 | C2 | 121.3° | 119.6° |
| N1 | C6 | C5 | 119.3° | 121.8° |
| N1 | C6 | H5 | 120.3° | 119.0° |
| C1' | N1 | C2 | 121.0° | 118.2° |
| N1 | C1' | O4D | 110.9° | 109.3° |
| N1 | C1' | C2D | 107.5° | 113.4° |
| N1 | C1' | H8 | 108.8° | 109.4° |
| N1 | C2 | N3 | 119.5° | 119.0° |
| N1 | C2 | O2 | 122.7° | 119.8° |
| N3 | C2 | O2 | 117.4° | 121.1° |
| C2 | N3 | C4 | 118.9° | 120.9° |
| N3 | C4 | C5 | 121.8° | 120.9° |
| N3 | C4 | N4 | 118.3° | 118.0° |
| C5 | C4 | N4 | 119.8° | 121.1° |
| C4 | C5 | C6 | 119.0° | 117.8° |
| C4 | C5 | H4 | 120.5° | 121.3° |
| C4 | N4 | H6 | 120.0° | 120.0° |
| C4 | N4 | H7 | 120.0° | 120.6° |
| C6 | C5 | H4 | 120.5° | 120.9° |
| C5 | C6 | H5 | 120.4° | 119.2° |
| O4D | C1' | C2D | 110.4° | 108.6° |
| C1' | O4D | C4D | 109.1° | 110.4° |
| O4D | C1' | H8 | 110.9° | 107.9° |
| C1' | C2D | C3' | 99.6° | 102.6° |
| C1' | C2D | O2' | 114.9° | 109.5° |
| C2D | C1' | H8 | 108.3° | 108.0° |
| C1' | C2D | H9 | 108.5° | 110.0° |
| C3' | C2D | O2' | 114.4° | 114.4° |
| C2D | C3' | C4D | 103.6° | 103.2° |
| C2D | C3' | O3' | 108.7° | 112.0° |
| C3' | C2D | H9 | 108.6° | 109.9° |
| C2D | C3' | H11 | 110.7° | 109.1° |
| O2' | C2D | H9 | 110.3° | 110.1° |
| C2D | O2' | H10 | 109.5° | 110.9° |
| C4D | C3' | O3' | 111.2° | 111.4° |
| C3' | C4D | O4D | 106.1° | 104.7° |
| C3' | C4D | C5' | 114.0° | 116.2° |
| C4D | C3' | H11 | 110.5° | 111.1° |
| C3' | C4D | H12 | 109.6° | 109.2° |
| O3' | C3' | H11 | 111.8° | 109.9° |
| C3' | O3' | H13 | 109.5° | 110.9° |
| O4D | C4D | C5' | 106.4° | 109.8° |
| O4D | C4D | H12 | 110.8° | 108.8° |
| C4D | C5' | O5' | 110.1° | 109.6° |
| C5' | C4D | H12 | 109.8° | 107.9° |
| C4D | C5' | H14 | 109.3° | 109.3° |
| C4D | C5' | H15 | 109.3° | 110.1° |
| C5' | O5' | PA | 122.9° | 123.5° |
| O5' | C5' | H14 | 109.3° | 109.6° |
| O5' | C5' | H15 | 109.3° | 109.9° |
| O5' | PA | O2A | 109.9° | 114.8° |
| O5' | PA | O1A | 103.5° | 109.2° |
| O5' | PA | O3A | 105.7° | 104.5° |
| O2A | PA | O1A | 120.9° | 113.5° |
| O2A | PA | O3A | 105.2° | 108.9° |
| O1A | PA | O3A | 110.8° | 105.1° |
| PA | O1A | H16 | 109.5° | 113.3° |
| PA | O3A | PB | 130.2° | 133.4° |
| O3A | PB | O3B | 101.2° | 104.4° |
| O3A | PB | O1B | 110.2° | 109.2° |
| O3A | PB | O2B | 108.9° | 104.1° |
| O3B | PB | O1B | 110.8° | 114.8° |
| O3B | PB | O2B | 105.8° | 109.3° |
| PB | O3B | C10 | 122.6° | 122.2° |
| O1B | PB | O2B | 118.5° | 114.0° |
| PB | O2B | H17 | 109.5° | 113.9° |
| O3B | C10 | C9' | 110.6° | 112.1° |
| O3B | C10 | H18 | 109.2° | 109.7° |
| O3B | C10 | H19 | 109.2° | 109.7° |
| C10 | C9' | O9' | 106.0° | 106.4° |
| C10 | C9' | C8' | 112.0° | 114.9° |
| C9' | C10 | H18 | 109.2° | 108.9° |
| C9' | C10 | H19 | 109.2° | 108.7° |
| C10 | C9' | H20 | 108.3° | 107.5° |
| O9' | C9' | C8' | 112.4° | 112.4° |
| C9' | O9' | C7 | 112.0° | 119.3° |
| O9' | C9' | H20 | 109.1° | 108.8° |
| C9' | C8' | S8' | 118.6° | 119.2° |
| C9' | C8' | C7' | 122.4° | 121.6° |
| C8' | C9' | H20 | 108.9° | 106.7° |
| S8' | C8' | C7' | 118.7° | 119.2° |
| C8' | C7' | S7' | 120.9° | 120.5° |
| C8' | C7' | C6' | 120.9° | 122.7° |
| S7' | C7' | C6' | 117.9° | 116.8° |
| C7' | C6' | N5' | 108.7° | 111.4° |
| C7' | C6' | C7 | 108.9° | 112.0° |
| C7' | C6' | H21 | 109.4° | 107.2° |
| N5' | C6' | C7 | 111.1° | 111.9° |
| C6' | N5' | C4A | 115.9° | 122.6° |
| N5' | C6' | H21 | 109.8° | 107.7° |
| C6' | N5' | H1 | 107.8° | 119.5° |
| C6' | C7 | N8' | 111.1° | 113.1° |
| C6' | C7 | O9' | 109.7° | 110.1° |
| C7 | C6' | H21 | 108.9° | 106.2° |
| C6' | C7 | H22 | 108.0° | 108.8° |
| N8' | C7 | O9' | 109.2° | 108.4° |
| C7 | N8' | C4B | 118.9° | 122.8° |
| N8' | C7 | H22 | 109.5° | 107.5° |
| C7 | N8' | H23 | 107.0° | 119.0° |
| O9' | C7 | H22 | 109.3° | 108.8° |
| N5' | C4A | C4B | 122.1° | 119.4° |
| N5' | C4A | C4' | 121.4° | 121.4° |
| C4A | N5' | H1 | 107.9° | 117.8° |
| C4B | C4A | C4' | 116.4° | 119.1° |
| C4A | C4B | N8' | 118.8° | 121.0° |
| C4A | C4B | N1' | 124.4° | 122.4° |
| C4A | C4' | N3' | 115.5° | 115.0° |
| C4A | C4' | O4' | 122.2° | 125.3° |
| N8' | C4B | N1' | 116.8° | 116.5° |
| C4B | N8' | H23 | 107.1° | 118.3° |
| C4B | N1' | C2' | 117.5° | 118.0° |
| N1' | C2' | N2' | 119.2° | 119.1° |
| N1' | C2' | N3' | 120.0° | 122.9° |
| N2' | C2' | N3' | 120.8° | 117.9° |
| C2' | N2' | H24 | 120.0° | 120.2° |
| C2' | N2' | H25 | 120.0° | 120.6° |
| C2' | N3' | C4' | 125.8° | 122.5° |
| C2' | N3' | H26 | 117.1° | 119.1° |
| N3' | C4' | O4' | 122.3° | 119.7° |
| C4' | N3' | H26 | 117.1° | 118.4° |
| H6 | N4 | H7 | 120.0° | 119.4° |
| H14 | C5' | H15 | 109.5° | 108.3° |
| H18 | C10 | H19 | 109.5° | 107.6° |
| H24 | N2' | H25 | 120.0° | 119.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OM1 | MO | OR1 | S7' | 102.5° | 89.5° |
| OM1 | MO | OR1 | S8' | 157.6° | 103.4° |
| OM1 | MO | OR1 | OM2 | 113.4° | 91.9° |
| OM1 | MO | S7' | S8' | 100.0° | 89.1° |
| OM1 | MO | S7' | OM2 | 162.3° | 110.1° |
| OM1 | MO | S8' | OM2 | 108.1° | 91.8° |
| OM1 | MO | S8' | C8' | 88.4° | 92.4° |
| OM1 | MO | S7' | C7' | 84.3° | 94.5° |
| OM1 | MO | OR1 | H2 | 0.0° | 44.0° |
| OM1 | MO | OM2 | H3 | 0.0° | 51.2° |
| OR1 | MO | S7' | S8' | 153.6° | 178.8° |
| OR1 | MO | S7' | OM2 | 91.2° | 157.9° |
| OR1 | MO | S8' | OM2 | 93.7° | 164.6° |
| OR1 | MO | S8' | C8' | 69.9° | 11.1° |
| OR1 | MO | S7' | C7' | 169.3° | 173.5° |
| OR1 | MO | OM2 | H3 | 112.6° | 143.3° |
| S7' | MO | S8' | OM2 | 148.8° | 178.6° |
| S7' | MO | S8' | C8' | 14.8° | 2.9° |
| MO | S7' | C7' | C8' | 15.0° | 8.0° |
| MO | S7' | C7' | C6' | 159.1° | 170.0° |
| S7' | MO | OR1 | H2 | 102.5° | 133.5° |
| S7' | MO | OM2 | H3 | 161.9° | 58.8° |
| MO | S8' | C8' | C9' | 161.6° | 179.7° |
| MO | S8' | C8' | C7' | 11.8° | 0.8° |
| S8' | MO | S7' | C7' | 15.7° | 5.3° |
| S8' | MO | OR1 | H2 | 157.6° | 147.4° |
| S8' | MO | OM2 | H3 | 100.1° | 38.0° |
| OM2 | MO | S8' | C8' | 163.6° | 175.7° |
| OM2 | MO | S7' | C7' | 78.0° | 15.6° |
| OM2 | MO | OR1 | H2 | 113.4° | 48.0° |
| C6 | N1 | C1' | C2 | 174.7° | 179.5° |
| C6 | N1 | C2 | N3 | 3.0° | 0.4° |
| C6 | N1 | C2 | O2 | 169.8° | 179.7° |
| N1 | C6 | C5 | C4 | 1.1° | 0.1° |
| N1 | C6 | C5 | H5 | 180.0° | 180.0° |
| C6 | N1 | C1' | O4D | 49.9° | 34.3° |
| C6 | N1 | C1' | C2D | 70.8° | 87.0° |
| N1 | C6 | C5 | H4 | 178.8° | 179.8° |
| C6 | N1 | C1' | H8 | 172.1° | 152.3° |
| C1' | N1 | C2 | N3 | 171.4° | 179.9° |
| C1' | N1 | C2 | O2 | 15.8° | 0.2° |
| C1' | N1 | C6 | C5 | 170.9° | 179.8° |
| N1 | C1' | O4D | C2D | 119.0° | 124.2° |
| N1 | C1' | O4D | H8 | 121.0° | 119.0° |
| N1 | C1' | C2D | H8 | 117.4° | 121.5° |
| N1 | C1' | C2D | C3' | 153.8° | 107.0° |
| N1 | C1' | C2D | O2' | 83.6° | 131.1° |
| N1 | C1' | O4D | C4D | 139.4° | 130.1° |
| C1' | N1 | C6 | H5 | 9.0° | 0.2° |
| N1 | C1' | C2D | H9 | 40.3° | 10.0° |
| N1 | C2 | N3 | O2 | 173.2° | 179.9° |
| N1 | C2 | N3 | C4 | 0.2° | 0.2° |
| C2 | N1 | C6 | C5 | 3.7° | 0.3° |
| C2 | N1 | C1' | O4D | 135.5° | 146.2° |
| C2 | N1 | C1' | C2D | 103.8° | 92.5° |
| C2 | N1 | C6 | H5 | 176.3° | 179.6° |
| C2 | N1 | C1' | H8 | 13.2° | 28.2° |
| C2 | N3 | C4 | C5 | 2.8° | 0.0° |
| C2 | N3 | C4 | N4 | 173.8° | 180.0° |
| O2 | C2 | N3 | C4 | 173.4° | 179.9° |
| N3 | C4 | C5 | N4 | 176.5° | 180.0° |
| N3 | C4 | C5 | C6 | 2.1° | 0.1° |
| N3 | C4 | C5 | H4 | 177.9° | 180.0° |
| N3 | C4 | N4 | H6 | 0.0° | 0.0° |
| N3 | C4 | N4 | H7 | 180.0° | 180.0° |
| C4 | C5 | C6 | H4 | 180.0° | 179.9° |
| C4 | C5 | C6 | H5 | 178.9° | 179.9° |
| C5 | C4 | N4 | H6 | 176.6° | 180.0° |
| C5 | C4 | N4 | H7 | 3.4° | 0.1° |
| N4 | C4 | C5 | C6 | 174.4° | 180.0° |
| N4 | C4 | C5 | H4 | 5.6° | 0.0° |
| C4 | N4 | H6 | H7 | 180.0° | 180.0° |
| O4D | C1' | C2D | H8 | 121.6° | 116.8° |
| O4D | C1' | C2D | C3' | 32.8° | 14.8° |
| O4D | C1' | C2D | O2' | 155.4° | 107.1° |
| C1' | O4D | C4D | C3' | 1.0° | 24.3° |
| C1' | O4D | C4D | C5' | 120.7° | 149.8° |
| O4D | C1' | C2D | H9 | 80.7° | 131.7° |
| C1' | O4D | C4D | H12 | 120.0° | 92.3° |
| C1' | C2D | C3' | O2' | 123.0° | 118.6° |
| C1' | C2D | C3' | H9 | 113.4° | 117.0° |
| C1' | C2D | O2' | H9 | 123.0° | 121.1° |
| C1' | C2D | C3' | C4D | 30.7° | 28.2° |
| C1' | C2D | C3' | O3' | 87.6° | 148.1° |
| C2D | C1' | O4D | C4D | 20.4° | 5.9° |
| C1' | C2D | O2' | H10 | 180.0° | 172.3° |
| C1' | C2D | C3' | H11 | 149.1° | 89.9° |
| C3' | C2D | O2' | H9 | 122.7° | 124.3° |
| C2D | C3' | C4D | O3' | 116.6° | 120.4° |
| C2D | C3' | C4D | H11 | 118.6° | 116.8° |
| C2D | C3' | O3' | H11 | 122.6° | 121.5° |
| C2D | C3' | C4D | O4D | 21.3° | 32.5° |
| C2D | C3' | C4D | C5' | 95.4° | 153.9° |
| C3' | C2D | C1' | H8 | 88.8° | 131.6° |
| C3' | C2D | O2' | H10 | 65.7° | 73.1° |
| C2D | C3' | C4D | H12 | 141.1° | 83.8° |
| C2D | C3' | O3' | H13 | 180.0° | 169.6° |
| O2' | C2D | C3' | C4D | 153.7° | 90.3° |
| O2' | C2D | C3' | O3' | 35.4° | 29.6° |
| O2' | C2D | C1' | H8 | 33.8° | 9.6° |
| O2' | C2D | C3' | H11 | 87.9° | 151.5° |
| C4D | C3' | O3' | H11 | 124.0° | 123.5° |
| C3' | C4D | O4D | C5' | 121.8° | 125.5° |
| C3' | C4D | O4D | H12 | 118.9° | 116.6° |
| C3' | C4D | C5' | H12 | 123.4° | 123.0° |
| C3' | C4D | C5' | O5' | 37.1° | 78.5° |
| C4D | C3' | C2D | H9 | 82.7° | 145.3° |
| C4D | C3' | O3' | H13 | 66.5° | 75.4° |
| C3' | C4D | C5' | H14 | 157.2° | 161.3° |
| C3' | C4D | C5' | H15 | 83.0° | 42.5° |
| O3' | C3' | C4D | O4D | 95.3° | 152.9° |
| O3' | C3' | C4D | C5' | 148.0° | 85.8° |
| O3' | C3' | C2D | H9 | 159.0° | 94.8° |
| O3' | C3' | C4D | H12 | 24.4° | 36.5° |
| O4D | C4D | C5' | H12 | 120.0° | 118.4° |
| O4D | C4D | C5' | O5' | 79.5° | 162.9° |
| C4D | O4D | C1' | H8 | 99.6° | 110.9° |
| O4D | C4D | C3' | H11 | 140.0° | 84.3° |
| O4D | C4D | C5' | H14 | 40.6° | 42.7° |
| O4D | C4D | C5' | H15 | 160.4° | 76.1° |
| C4D | C5' | O5' | H14 | 120.1° | 120.0° |
| C4D | C5' | O5' | H15 | 120.1° | 121.1° |
| C4D | C5' | O5' | PA | 165.9° | 173.7° |
| C5' | C4D | C3' | H11 | 23.2° | 37.1° |
| C4D | C5' | H14 | H15 | 119.7° | 119.9° |
| C5' | O5' | PA | O2A | 62.0° | 173.8° |
| C5' | O5' | PA | O1A | 167.5° | 45.0° |
| C5' | O5' | PA | O3A | 51.0° | 67.0° |
| O5' | C5' | C4D | H12 | 160.5° | 44.5° |
| O5' | C5' | H14 | H15 | 119.7° | 119.9° |
| O5' | PA | O2A | O1A | 120.4° | 126.7° |
| O5' | PA | O2A | O3A | 113.4° | 116.7° |
| O5' | PA | O1A | O3A | 112.9° | 111.7° |
| O5' | PA | O3A | PB | 62.0° | 59.2° |
| PA | O5' | C5' | H14 | 45.8° | 66.3° |
| PA | O5' | C5' | H15 | 74.0° | 52.6° |
| O5' | PA | O1A | H16 | 123.5° | 179.6° |
| O2A | PA | O1A | O3A | 123.7° | 118.8° |
| O2A | PA | O3A | PB | 178.3° | 63.9° |
| O2A | PA | O1A | H16 | 0.0° | 50.9° |
| O1A | PA | O3A | PB | 49.4° | 174.2° |
| PA | O3A | PB | O3B | 153.0° | 30.9° |
| PA | O3A | PB | O1B | 89.8° | 154.1° |
| PA | O3A | PB | O2B | 41.8° | 83.7° |
| O3A | PA | O1A | H16 | 123.6° | 68.0° |
| O3A | PB | O3B | O1B | 116.8° | 119.5° |
| O3A | PB | O3B | O2B | 113.5° | 110.9° |
| O3A | PB | O1B | O2B | 126.3° | 116.0° |
| O3A | PB | O3B | C10 | 89.2° | 170.7° |
| O3A | PB | O2B | H17 | 126.9° | 173.6° |
| O3B | PB | O1B | O2B | 122.6° | 127.2° |
| PB | O3B | C10 | C9' | 128.0° | 170.4° |
| O3B | PB | O2B | H17 | 125.0° | 75.3° |
| PB | O3B | C10 | H18 | 111.9° | 49.3° |
| PB | O3B | C10 | H19 | 7.8° | 68.7° |
| O1B | PB | O3B | C10 | 27.5° | 69.8° |
| O1B | PB | O2B | H17 | 0.0° | 54.7° |
| O2B | PB | O3B | C10 | 157.2° | 59.7° |
| O3B | C10 | C9' | H18 | 120.2° | 121.6° |
| O3B | C10 | C9' | H19 | 120.2° | 121.4° |
| O3B | C10 | C9' | O9' | 44.8° | 85.2° |
| O3B | C10 | C9' | C8' | 167.8° | 39.8° |
| O3B | C10 | H18 | H19 | 119.5° | 119.3° |
| O3B | C10 | C9' | H20 | 72.2° | 158.4° |
| C10 | C9' | O9' | C8' | 122.7° | 126.5° |
| C10 | C9' | O9' | H20 | 116.4° | 115.6° |
| C10 | C9' | C8' | H20 | 119.7° | 119.0° |
| C10 | C9' | C8' | S8' | 42.1° | 53.3° |
| C10 | C9' | C8' | C7' | 131.0° | 127.2° |
| C10 | C9' | O9' | C7 | 168.0° | 166.4° |
| C9' | C10 | H18 | H19 | 119.5° | 117.7° |
| O9' | C9' | C8' | H20 | 121.0° | 119.1° |
| O9' | C9' | C8' | S8' | 161.4° | 175.2° |
| O9' | C9' | C8' | C7' | 11.7° | 5.4° |
| C9' | O9' | C7 | C6' | 67.9° | 57.1° |
| C9' | O9' | C7 | N8' | 170.1° | 178.7° |
| O9' | C9' | C10 | H18 | 75.4° | 36.4° |
| O9' | C9' | C10 | H19 | 165.0° | 153.4° |
| C9' | O9' | C7 | H22 | 50.3° | 62.0° |
| C9' | C8' | S8' | C7' | 173.4° | 179.5° |
| C9' | C8' | C7' | S7' | 174.8° | 174.5° |
| C9' | C8' | C7' | C6' | 0.8° | 7.6° |
| C8' | C9' | O9' | C7 | 45.3° | 39.9° |
| C8' | C9' | C10 | H18 | 47.6° | 161.4° |
| C8' | C9' | C10 | H19 | 72.1° | 81.6° |
| S8' | C8' | C7' | S7' | 1.7° | 6.1° |
| S8' | C8' | C7' | C6' | 172.3° | 171.8° |
| S8' | C8' | C9' | H20 | 77.6° | 65.7° |
| C8' | C7' | S7' | C6' | 174.1° | 178.0° |
| C8' | C7' | C6' | N5' | 100.3° | 116.6° |
| C8' | C7' | C6' | C7 | 20.8° | 9.7° |
| C7' | C8' | C9' | H20 | 109.3° | 113.7° |
| C8' | C7' | C6' | H21 | 139.8° | 125.8° |
| S7' | C7' | C6' | N5' | 73.8° | 65.5° |
| S7' | C7' | C6' | C7 | 165.1° | 168.3° |
| S7' | C7' | C6' | H21 | 46.1° | 52.2° |
| C7' | C6' | N5' | C7 | 119.8° | 126.3° |
| C7' | C6' | N5' | H21 | 119.7° | 117.3° |
| C7' | C6' | C7 | H21 | 119.3° | 116.7° |
| C7' | C6' | C7 | N8' | 173.9° | 160.3° |
| C7' | C6' | C7 | O9' | 53.1° | 38.9° |
| C7' | C6' | N5' | C4A | 161.0° | 154.4° |
| C7' | C6' | C7 | H22 | 66.0° | 80.3° |
| C7' | C6' | N5' | H1 | 40.0° | 25.8° |
| N5' | C6' | C7 | H21 | 121.1° | 117.3° |
| N5' | C6' | C7 | N8' | 54.2° | 34.4° |
| N5' | C6' | C7 | O9' | 66.6° | 87.1° |
| C6' | N5' | C4A | H1 | 121.0° | 179.8° |
| C6' | N5' | C4A | C4B | 14.3° | 9.3° |
| C6' | N5' | C4A | C4' | 170.9° | 167.4° |
| N5' | C6' | C7 | H22 | 174.4° | 153.7° |
| C6' | C7 | N8' | O9' | 121.1° | 122.4° |
| C6' | C7 | N8' | H22 | 119.3° | 120.1° |
| C6' | C7 | O9' | H22 | 118.3° | 119.2° |
| C7 | C6' | N5' | C4A | 41.2° | 28.1° |
| C6' | C7 | N8' | C4B | 40.9° | 25.7° |
| C6' | C7 | N8' | H23 | 80.5° | 154.2° |
| C7 | C6' | N5' | H1 | 79.8° | 152.1° |
| N8' | C7 | O9' | H22 | 119.7° | 116.7° |
| C7 | N8' | C4B | C4A | 13.6° | 6.3° |
| C7 | N8' | C4B | H23 | 121.3° | 179.8° |
| C7 | N8' | C4B | N1' | 168.0° | 170.8° |
| N8' | C7 | C6' | H21 | 66.8° | 83.0° |
| O9' | C7 | N8' | C4B | 80.3° | 96.7° |
| C7 | O9' | C9' | H20 | 75.5° | 78.0° |
| O9' | C7 | C6' | H21 | 172.3° | 155.6° |
| O9' | C7 | N8' | H23 | 158.4° | 83.5° |
| N5' | C4A | C4B | C4' | 175.0° | 176.8° |
| N5' | C4A | C4B | N8' | 1.4° | 3.5° |
| N5' | C4A | C4B | N1' | 176.9° | 179.6° |
| N5' | C4A | C4' | N3' | 178.7° | 178.8° |
| N5' | C4A | C4' | O4' | 0.5° | 2.1° |
| C4A | N5' | C6' | H21 | 79.3° | 88.3° |
| C4A | C4B | N8' | N1' | 178.4° | 177.1° |
| C4A | C4B | N1' | C2' | 6.0° | 2.1° |
| C4B | C4A | C4' | N3' | 3.6° | 2.1° |
| C4B | C4A | C4' | O4' | 175.6° | 178.8° |
| C4A | C4B | N8' | H23 | 107.7° | 173.5° |
| C4B | C4A | N5' | H1 | 106.7° | 170.9° |
| C4' | C4A | C4B | N8' | 173.7° | 179.8° |
| C4' | C4A | C4B | N1' | 8.0° | 2.8° |
| C4A | C4' | N3' | C2' | 2.2° | 0.8° |
| C4A | C4' | N3' | O4' | 179.2° | 179.2° |
| C4' | C4A | N5' | H1 | 68.1° | 12.4° |
| C4A | C4' | N3' | H26 | 177.8° | 179.3° |
| N8' | C4B | N1' | C2' | 175.6° | 179.1° |
| C4B | N8' | C7 | H22 | 160.1° | 145.8° |
| C4B | N1' | C2' | N2' | 178.7° | 179.4° |
| C4B | N1' | C2' | N3' | 0.2° | 0.7° |
| N1' | C4B | N8' | H23 | 70.7° | 9.4° |
| N1' | C2' | N2' | N3' | 178.5° | 180.0° |
| N1' | C2' | N3' | C4' | 4.5° | 0.1° |
| N1' | C2' | N2' | H24 | 0.0° | 0.1° |
| N1' | C2' | N2' | H25 | 180.0° | 179.9° |
| N1' | C2' | N3' | H26 | 175.6° | 180.0° |
| N2' | C2' | N3' | C4' | 177.0° | 179.9° |
| C2' | N2' | H24 | H25 | 180.0° | 180.0° |
| N2' | C2' | N3' | H26 | 3.0° | 0.0° |
| C2' | N3' | C4' | H26 | 180.0° | 179.9° |
| C2' | N3' | C4' | O4' | 178.6° | 180.0° |
| N3' | C2' | N2' | H24 | 178.6° | 179.9° |
| N3' | C2' | N2' | H25 | 1.4° | 0.1° |
| O4' | C4' | N3' | H26 | 1.4° | 0.1° |
| H4 | C5 | C6 | H5 | 1.1° | 0.2° |
| H8 | C1' | C2D | H9 | 157.7° | 111.5° |
| H9 | C2D | O2' | H10 | 57.0° | 51.2° |
| H9 | C2D | C3' | H11 | 35.7° | 27.1° |
| H11 | C3' | C4D | H12 | 100.3° | 159.4° |
| H11 | C3' | O3' | H13 | 57.5° | 48.1° |
| H12 | C4D | C5' | H14 | 79.4° | 75.7° |
| H12 | C4D | C5' | H15 | 40.4° | 165.4° |
| H18 | C10 | C9' | H20 | 167.7° | 80.1° |
| H19 | C10 | C9' | H20 | 48.0° | 36.9° |
| H21 | C6' | C7 | H22 | 53.3° | 36.4° |
| H21 | C6' | N5' | H1 | 159.7° | 91.5° |
| H22 | C7 | N8' | H23 | 38.8° | 34.1° |
