DW6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CU | S | sing | 2.25Å | 2.21Å | |
| S | MO | sing | 2.50Å | 2.27Å | |
| MO | S7' | sing | 2.25Å | 2.46Å | |
| MO | S8' | sing | 2.38Å | 2.47Å | |
| MO | OM2 | sing | 1.70Å | 1.89Å | |
| MO | OM1 | doub | 1.70Å | 1.71Å | |
| N1 | C6 | sing | 1.37Å | 1.42Å | |
| N1 | C1' | sing | 1.50Å | 1.53Å | |
| N1 | C2 | sing | 1.40Å | 1.40Å | |
| C2 | N3 | sing | 1.36Å | 1.38Å | |
| C2 | O2 | doub | 1.24Å | 1.21Å | |
| N3 | C4 | doub | 1.34Å | 1.38Å | |
| C4 | C5 | sing | 1.42Å | 1.46Å | |
| C4 | N4 | sing | 1.33Å | 1.31Å | |
| C5 | C6 | doub | 1.34Å | 1.36Å | |
| C1' | C2D | sing | 1.54Å | 1.59Å | |
| C1' | O4D | sing | 1.41Å | 1.43Å | |
| C2D | C3' | sing | 1.54Å | 1.54Å | |
| C2D | O2' | sing | 1.42Å | 1.46Å | |
| C3' | C4D | sing | 1.54Å | 1.50Å | |
| C3' | O3' | sing | 1.42Å | 1.49Å | |
| C4D | O4D | sing | 1.44Å | 1.49Å | |
| C4D | C5' | sing | 1.51Å | 1.57Å | |
| C5' | O5' | sing | 1.45Å | 1.45Å | |
| O5' | PA | sing | 1.58Å | 1.60Å | |
| PA | O2A | doub | 1.48Å | 1.52Å | |
| PA | O1A | sing | 1.52Å | 1.51Å | |
| PA | O3A | sing | 1.59Å | 1.63Å | |
| O3A | PB | sing | 1.59Å | 1.61Å | |
| PB | O3B | sing | 1.59Å | 1.63Å | |
| PB | O1B | doub | 1.48Å | 1.49Å | |
| PB | O2B | sing | 1.52Å | 1.50Å | |
| O3B | C10 | sing | 1.44Å | 1.42Å | |
| C10 | C9' | sing | 1.53Å | 1.50Å | |
| C9' | C8' | sing | 1.52Å | 1.55Å | |
| C9' | O9' | sing | 1.44Å | 1.47Å | |
| C8' | S8' | sing | 1.68Å | 1.81Å | |
| C8' | C7' | doub | 1.35Å | 1.34Å | |
| C7' | C6' | sing | 1.53Å | 1.58Å | |
| C7' | S7' | sing | 1.68Å | 1.78Å | |
| C6' | N5' | sing | 1.46Å | 1.52Å | |
| C6' | C7 | sing | 1.56Å | 1.49Å | |
| C7 | N8' | sing | 1.46Å | 1.47Å | |
| C7 | O9' | sing | 1.44Å | 1.41Å | |
| N5' | C4A | sing | 1.39Å | 1.44Å | |
| C4A | C4B | doub | 1.41Å | 1.37Å | |
| C4A | C4' | sing | 1.44Å | 1.47Å | |
| N8' | C4B | sing | 1.36Å | 1.39Å | |
| C4B | N1' | sing | 1.36Å | 1.41Å | |
| N1' | C2' | doub | 1.34Å | 1.34Å | |
| C2' | N2' | sing | 1.33Å | 1.36Å | |
| C2' | N3' | sing | 1.37Å | 1.36Å | |
| N3' | C4' | sing | 1.39Å | 1.42Å | |
| C4' | O4' | doub | 1.23Å | 1.20Å | |
| OM2 | H1 | sing | 0.87Å | 0.95Å | |
| C5 | H3 | sing | 0.94Å | 1.08Å | |
| C6 | H4 | sing | 0.94Å | 1.08Å | |
| N4 | H5 | sing | 0.88Å | 1.00Å | |
| N4 | H6 | sing | 0.88Å | 1.00Å | |
| C1' | H7 | sing | 0.99Å | 1.10Å | |
| C2D | H8 | sing | 0.98Å | 1.10Å | |
| O2' | H9 | sing | 0.84Å | 0.95Å | |
| C3' | H10 | sing | 0.99Å | 1.10Å | |
| C4D | H11 | sing | 0.99Å | 1.10Å | |
| O3' | H12 | sing | 0.84Å | 0.95Å | |
| C5' | H13 | sing | 0.99Å | 1.10Å | |
| C5' | H14 | sing | 0.99Å | 1.10Å | |
| O1A | H15 | sing | 0.89Å | 0.95Å | |
| O2B | H16 | sing | 0.89Å | 0.95Å | |
| C10 | H17 | sing | 0.98Å | 1.10Å | |
| C10 | H18 | sing | 0.98Å | 1.10Å | |
| C9' | H19 | sing | 0.99Å | 1.10Å | |
| C6' | H20 | sing | 0.99Å | 1.10Å | |
| C7 | H21 | sing | 0.99Å | 1.10Å | |
| N5' | H22 | sing | 0.87Å | 1.00Å | |
| N2' | H25 | sing | 0.88Å | 1.00Å | |
| N2' | H26 | sing | 0.88Å | 1.00Å | |
| N3' | H27 | sing | 0.88Å | 1.00Å | |
| H2 | N8' | sing | 0.88Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CU | S | MO | 113.2° | 124.5° |
| S | MO | S7' | 85.9° | 93.6° |
| S | MO | S8' | 150.4° | 174.8° |
| S | MO | OM2 | 95.7° | 90.3° |
| S | MO | OM1 | 107.5° | 89.8° |
| S7' | MO | S8' | 79.3° | 81.3° |
| S7' | MO | OM2 | 151.3° | 175.8° |
| S7' | MO | OM1 | 101.7° | 89.1° |
| MO | S7' | C7' | 108.0° | 103.9° |
| S8' | MO | OM2 | 85.9° | 94.8° |
| S8' | MO | OM1 | 100.6° | 89.9° |
| MO | S8' | C8' | 109.8° | 102.8° |
| OM2 | MO | OM1 | 105.1° | 89.3° |
| MO | OM2 | H1 | 109.5° | 109.8° |
| C6 | N1 | C1' | 117.9° | 122.1° |
| C6 | N1 | C2 | 125.5° | 119.6° |
| N1 | C6 | C5 | 117.9° | 121.7° |
| N1 | C6 | H4 | 121.1° | 118.9° |
| C1' | N1 | C2 | 116.1° | 118.3° |
| N1 | C1' | C2D | 109.0° | 113.3° |
| N1 | C1' | O4D | 105.7° | 109.4° |
| N1 | C1' | H7 | 112.6° | 109.5° |
| N1 | C2 | N3 | 113.1° | 119.0° |
| N1 | C2 | O2 | 119.8° | 119.9° |
| N3 | C2 | O2 | 126.7° | 121.2° |
| C2 | N3 | C4 | 126.0° | 121.0° |
| N3 | C4 | C5 | 117.5° | 120.9° |
| N3 | C4 | N4 | 121.8° | 118.0° |
| C5 | C4 | N4 | 120.4° | 121.1° |
| C4 | C5 | C6 | 119.8° | 117.8° |
| C4 | C5 | H3 | 120.1° | 121.2° |
| C4 | N4 | H5 | 120.0° | 120.0° |
| C4 | N4 | H6 | 120.0° | 120.6° |
| C6 | C5 | H3 | 120.1° | 121.0° |
| C5 | C6 | H4 | 121.1° | 119.3° |
| C2D | C1' | O4D | 103.1° | 108.6° |
| C1' | C2D | C3' | 102.0° | 102.6° |
| C1' | C2D | O2' | 105.9° | 109.5° |
| C2D | C1' | H7 | 111.7° | 108.0° |
| C1' | C2D | H8 | 109.5° | 110.0° |
| C1' | O4D | C4D | 111.0° | 110.1° |
| O4D | C1' | H7 | 114.2° | 107.9° |
| C3' | C2D | O2' | 117.6° | 114.5° |
| C2D | C3' | C4D | 104.6° | 103.1° |
| C2D | C3' | O3' | 105.3° | 112.0° |
| C3' | C2D | H8 | 110.0° | 109.9° |
| C2D | C3' | H10 | 111.8° | 109.2° |
| O2' | C2D | H8 | 111.2° | 110.1° |
| C2D | O2' | H9 | 109.5° | 110.8° |
| C4D | C3' | O3' | 109.5° | 111.3° |
| C3' | C4D | O4D | 106.5° | 104.4° |
| C3' | C4D | C5' | 111.8° | 116.0° |
| C4D | C3' | H10 | 112.5° | 111.1° |
| C3' | C4D | H11 | 110.1° | 109.4° |
| O3' | C3' | H10 | 112.6° | 109.9° |
| C3' | O3' | H12 | 109.5° | 110.8° |
| O4D | C4D | C5' | 108.9° | 110.1° |
| O4D | C4D | H11 | 110.3° | 108.9° |
| C4D | C5' | O5' | 106.6° | 109.3° |
| C5' | C4D | H11 | 109.2° | 107.9° |
| C4D | C5' | H13 | 110.2° | 109.5° |
| C4D | C5' | H14 | 110.2° | 109.8° |
| C5' | O5' | PA | 121.0° | 122.9° |
| O5' | C5' | H13 | 110.2° | 109.8° |
| O5' | C5' | H14 | 110.2° | 109.9° |
| O5' | PA | O2A | 110.2° | 115.1° |
| O5' | PA | O1A | 105.1° | 107.8° |
| O5' | PA | O3A | 105.0° | 104.1° |
| O2A | PA | O1A | 120.3° | 114.2° |
| O2A | PA | O3A | 103.5° | 109.6° |
| O1A | PA | O3A | 111.9° | 105.1° |
| PA | O1A | H15 | 109.5° | 113.2° |
| PA | O3A | PB | 129.5° | 132.1° |
| O3A | PB | O3B | 99.1° | 102.7° |
| O3A | PB | O1B | 109.1° | 109.3° |
| O3A | PB | O2B | 107.7° | 104.0° |
| O3B | PB | O1B | 110.0° | 115.0° |
| O3B | PB | O2B | 107.5° | 110.3° |
| PB | O3B | C10 | 122.9° | 124.5° |
| O1B | PB | O2B | 121.1° | 114.2° |
| PB | O2B | H16 | 109.5° | 113.8° |
| O3B | C10 | C9' | 104.2° | 109.7° |
| O3B | C10 | H17 | 110.8° | 110.1° |
| O3B | C10 | H18 | 110.8° | 110.0° |
| C10 | C9' | C8' | 106.3° | 113.9° |
| C10 | C9' | O9' | 110.3° | 106.8° |
| C9' | C10 | H17 | 110.8° | 109.5° |
| C9' | C10 | H18 | 110.8° | 109.5° |
| C10 | C9' | H19 | 112.3° | 108.5° |
| C8' | C9' | O9' | 103.3° | 112.4° |
| C9' | C8' | S8' | 116.7° | 120.0° |
| C9' | C8' | C7' | 126.3° | 121.7° |
| C8' | C9' | H19 | 111.5° | 106.6° |
| C9' | O9' | C7 | 114.9° | 119.7° |
| O9' | C9' | H19 | 112.7° | 108.6° |
| S8' | C8' | C7' | 116.6° | 118.3° |
| C8' | C7' | C6' | 120.6° | 122.6° |
| C8' | C7' | S7' | 123.7° | 120.8° |
| C6' | C7' | S7' | 115.6° | 116.5° |
| C7' | C6' | N5' | 102.3° | 111.2° |
| C7' | C6' | C7 | 105.1° | 111.9° |
| C7' | C6' | H20 | 110.9° | 107.2° |
| N5' | C6' | C7 | 113.8° | 112.2° |
| C6' | N5' | C4A | 106.8° | 122.3° |
| N5' | C6' | H20 | 111.7° | 107.7° |
| C6' | N5' | H22 | 110.2° | 119.6° |
| C6' | C7 | N8' | 108.9° | 112.7° |
| C6' | C7 | O9' | 112.5° | 110.3° |
| C7 | C6' | H20 | 112.3° | 106.2° |
| C6' | C7 | H21 | 108.8° | 108.8° |
| N8' | C7 | O9' | 107.8° | 108.7° |
| C7 | N8' | C4B | 117.9° | 122.8° |
| N8' | C7 | H21 | 109.0° | 107.6° |
| C7 | N8' | H2 | 107.3° | 119.0° |
| O9' | C7 | H21 | 109.7° | 108.8° |
| N5' | C4A | C4B | 127.5° | 119.4° |
| N5' | C4A | C4' | 113.8° | 121.3° |
| C4A | N5' | H22 | 110.1° | 118.1° |
| C4B | C4A | C4' | 118.6° | 119.2° |
| C4A | C4B | N8' | 118.9° | 121.1° |
| C4A | C4B | N1' | 126.6° | 122.3° |
| C4A | C4' | N3' | 111.8° | 114.9° |
| C4A | C4' | O4' | 127.3° | 125.3° |
| N8' | C4B | N1' | 114.2° | 116.5° |
| C4B | N8' | H2 | 107.3° | 118.2° |
| C4B | N1' | C2' | 113.7° | 118.0° |
| N1' | C2' | N2' | 117.2° | 119.1° |
| N1' | C2' | N3' | 123.5° | 123.0° |
| N2' | C2' | N3' | 119.1° | 117.9° |
| C2' | N2' | H25 | 120.0° | 120.2° |
| C2' | N2' | H26 | 120.0° | 120.6° |
| C2' | N3' | C4' | 125.4° | 122.5° |
| C2' | N3' | H27 | 117.3° | 119.1° |
| N3' | C4' | O4' | 120.9° | 119.8° |
| C4' | N3' | H27 | 117.3° | 118.4° |
| H5 | N4 | H6 | 120.0° | 119.3° |
| H13 | C5' | H14 | 109.5° | 108.4° |
| H17 | C10 | H18 | 109.5° | 107.9° |
| H25 | N2' | H26 | 120.0° | 119.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CU | S | MO | S7' | 137.2° | 4.2° |
| CU | S | MO | S8' | 77.5° | 2.2° |
| CU | S | MO | OM2 | 14.1° | 174.1° |
| CU | S | MO | OM1 | 121.9° | 84.9° |
| S | MO | S7' | S8' | 154.2° | 179.8° |
| S | MO | S7' | OM2 | 94.2° | 156.8° |
| S | MO | S7' | OM1 | 107.0° | 89.8° |
| S | MO | S8' | OM2 | 94.2° | 176.3° |
| S | MO | S8' | OM1 | 161.2° | 87.0° |
| S | MO | OM2 | OM1 | 109.9° | 89.8° |
| S | MO | S8' | C8' | 75.2° | 25.4° |
| S | MO | S7' | C7' | 166.9° | 149.5° |
| S | MO | OM2 | H1 | 109.9° | 35.0° |
| S7' | MO | S8' | OM2 | 155.3° | 178.3° |
| S7' | MO | S8' | OM1 | 100.0° | 89.1° |
| S7' | MO | OM2 | OM1 | 158.4° | 67.0° |
| S7' | MO | S8' | C8' | 14.1° | 27.4° |
| MO | S7' | C7' | C8' | 9.9° | 31.6° |
| MO | S7' | C7' | C6' | 165.8° | 145.4° |
| S7' | MO | OM2 | H1 | 158.4° | 168.2° |
| S8' | MO | OM2 | OM1 | 99.9° | 89.8° |
| MO | S8' | C8' | C9' | 172.5° | 160.8° |
| MO | S8' | C8' | C7' | 13.7° | 18.5° |
| S8' | MO | S7' | C7' | 12.6° | 30.3° |
| S8' | MO | OM2 | H1 | 99.8° | 145.4° |
| OM2 | MO | S8' | C8' | 169.4° | 150.9° |
| OM2 | MO | S7' | C7' | 72.7° | 7.3° |
| OM1 | MO | S8' | C8' | 86.0° | 61.7° |
| OM1 | MO | S7' | C7' | 86.1° | 59.7° |
| OM1 | MO | OM2 | H1 | 0.0° | 124.8° |
| C6 | N1 | C1' | C2 | 172.3° | 179.4° |
| C6 | N1 | C2 | N3 | 4.8° | 0.4° |
| C6 | N1 | C2 | O2 | 167.9° | 179.7° |
| N1 | C6 | C5 | C4 | 3.2° | 0.2° |
| N1 | C6 | C5 | H4 | 180.0° | 180.0° |
| C6 | N1 | C1' | C2D | 61.2° | 85.8° |
| C6 | N1 | C1' | O4D | 48.9° | 35.6° |
| N1 | C6 | C5 | H3 | 176.8° | 179.8° |
| C6 | N1 | C1' | H7 | 174.3° | 153.6° |
| C1' | N1 | C2 | N3 | 166.9° | 179.9° |
| C1' | N1 | C2 | O2 | 20.5° | 0.3° |
| C1' | N1 | C6 | C5 | 170.0° | 179.8° |
| N1 | C1' | C2D | O4D | 111.9° | 121.8° |
| N1 | C1' | C2D | H7 | 125.0° | 121.5° |
| N1 | C1' | O4D | H7 | 124.3° | 119.0° |
| N1 | C1' | C2D | C3' | 146.6° | 108.4° |
| N1 | C1' | C2D | O2' | 89.9° | 129.7° |
| N1 | C1' | O4D | C4D | 138.2° | 132.2° |
| C1' | N1 | C6 | H4 | 10.0° | 0.2° |
| N1 | C1' | C2D | H8 | 30.1° | 8.5° |
| N1 | C2 | N3 | O2 | 172.0° | 179.9° |
| N1 | C2 | N3 | C4 | 3.5° | 0.2° |
| C2 | N1 | C6 | C5 | 1.5° | 0.4° |
| C2 | N1 | C1' | C2D | 111.1° | 93.7° |
| C2 | N1 | C1' | O4D | 138.8° | 145.0° |
| C2 | N1 | C6 | H4 | 178.5° | 179.6° |
| C2 | N1 | C1' | H7 | 13.4° | 26.9° |
| C2 | N3 | C4 | C5 | 0.7° | 0.0° |
| C2 | N3 | C4 | N4 | 173.1° | 180.0° |
| O2 | C2 | N3 | C4 | 168.5° | 179.9° |
| N3 | C4 | C5 | N4 | 173.9° | 180.0° |
| N3 | C4 | C5 | C6 | 4.3° | 0.0° |
| N3 | C4 | C5 | H3 | 175.7° | 180.0° |
| N3 | C4 | N4 | H5 | 0.0° | 0.0° |
| N3 | C4 | N4 | H6 | 180.0° | 179.9° |
| C4 | C5 | C6 | H3 | 180.0° | 180.0° |
| C4 | C5 | C6 | H4 | 176.8° | 179.8° |
| C5 | C4 | N4 | H5 | 173.6° | 180.0° |
| C5 | C4 | N4 | H6 | 6.4° | 0.1° |
| N4 | C4 | C5 | C6 | 169.6° | 180.0° |
| N4 | C4 | C5 | H3 | 10.4° | 0.0° |
| C4 | N4 | H5 | H6 | 180.0° | 179.9° |
| C2D | C1' | O4D | H7 | 121.4° | 116.8° |
| C1' | C2D | C3' | O2' | 115.2° | 118.5° |
| C1' | C2D | C3' | H8 | 116.1° | 117.0° |
| C1' | C2D | O2' | H8 | 118.8° | 121.1° |
| C1' | C2D | C3' | C4D | 33.0° | 28.1° |
| C1' | C2D | C3' | O3' | 82.4° | 147.9° |
| C2D | C1' | O4D | C4D | 23.9° | 8.1° |
| C1' | C2D | O2' | H9 | 180.0° | 172.3° |
| C1' | C2D | C3' | H10 | 155.0° | 90.2° |
| O4D | C1' | C2D | C3' | 34.7° | 13.4° |
| O4D | C1' | C2D | O2' | 158.2° | 108.6° |
| C1' | O4D | C4D | C3' | 3.2° | 26.4° |
| C1' | O4D | C4D | C5' | 123.9° | 151.5° |
| O4D | C1' | C2D | H8 | 81.8° | 130.3° |
| C1' | O4D | C4D | H11 | 116.2° | 90.4° |
| C3' | C2D | O2' | H8 | 128.1° | 124.4° |
| C2D | C3' | C4D | O3' | 112.4° | 120.2° |
| C2D | C3' | C4D | H10 | 121.6° | 116.9° |
| C2D | C3' | O3' | H10 | 122.1° | 121.5° |
| C2D | C3' | C4D | O4D | 19.7° | 33.6° |
| C2D | C3' | C4D | C5' | 99.1° | 154.9° |
| C3' | C2D | C1' | H7 | 88.3° | 130.2° |
| C3' | C2D | O2' | H9 | 67.0° | 73.2° |
| C2D | C3' | C4D | H11 | 139.3° | 82.8° |
| C2D | C3' | O3' | H12 | 180.0° | 169.7° |
| O2' | C2D | C3' | C4D | 148.2° | 90.5° |
| O2' | C2D | C3' | O3' | 32.8° | 29.3° |
| O2' | C2D | C1' | H7 | 35.1° | 8.2° |
| O2' | C2D | C3' | H10 | 89.8° | 151.3° |
| C4D | C3' | O3' | H10 | 125.9° | 123.6° |
| C3' | C4D | O4D | C5' | 120.7° | 125.1° |
| C3' | C4D | O4D | H11 | 119.5° | 116.7° |
| C3' | C4D | C5' | H11 | 122.1° | 123.1° |
| C3' | C4D | C5' | O5' | 39.7° | 169.9° |
| C4D | C3' | C2D | H8 | 83.1° | 145.0° |
| C4D | C3' | O3' | H12 | 68.0° | 75.4° |
| C3' | C4D | C5' | H13 | 159.3° | 69.8° |
| C3' | C4D | C5' | H14 | 79.8° | 49.2° |
| O3' | C3' | C4D | O4D | 92.7° | 153.8° |
| O3' | C3' | C4D | C5' | 148.5° | 84.9° |
| O3' | C3' | C2D | H8 | 161.5° | 95.2° |
| O3' | C3' | C4D | H11 | 26.9° | 37.4° |
| O4D | C4D | C5' | H11 | 120.5° | 118.7° |
| O4D | C4D | C5' | O5' | 77.6° | 71.9° |
| C4D | O4D | C1' | H7 | 97.4° | 108.7° |
| O4D | C4D | C3' | H10 | 141.3° | 83.3° |
| O4D | C4D | C5' | H13 | 41.9° | 48.4° |
| O4D | C4D | C5' | H14 | 162.8° | 167.4° |
| C4D | C5' | O5' | H13 | 119.5° | 120.2° |
| C4D | C5' | O5' | H14 | 119.5° | 120.7° |
| C4D | C5' | O5' | PA | 165.9° | 118.2° |
| C5' | C4D | C3' | H10 | 22.5° | 38.0° |
| C4D | C5' | H13 | H14 | 121.3° | 119.8° |
| C5' | O5' | PA | O2A | 63.4° | 52.0° |
| C5' | O5' | PA | O1A | 165.7° | 179.2° |
| C5' | O5' | PA | O3A | 47.5° | 67.9° |
| O5' | C5' | C4D | H11 | 161.8° | 46.8° |
| O5' | C5' | H13 | H14 | 121.4° | 120.1° |
| O5' | PA | O2A | O1A | 122.4° | 125.5° |
| O5' | PA | O2A | O3A | 111.9° | 116.9° |
| O5' | PA | O1A | O3A | 113.5° | 110.6° |
| O5' | PA | O3A | PB | 65.0° | 71.5° |
| PA | O5' | C5' | H13 | 46.4° | 121.6° |
| PA | O5' | C5' | H14 | 74.5° | 2.4° |
| O5' | PA | O1A | H15 | 124.8° | 179.9° |
| O2A | PA | O1A | O3A | 121.7° | 120.1° |
| O2A | PA | O3A | PB | 179.4° | 164.9° |
| O2A | PA | O1A | H15 | 0.0° | 50.8° |
| O1A | PA | O3A | PB | 48.5° | 41.8° |
| PA | O3A | PB | O3B | 158.9° | 52.5° |
| PA | O3A | PB | O1B | 86.0° | 175.0° |
| PA | O3A | PB | O2B | 47.1° | 62.6° |
| O3A | PA | O1A | H15 | 121.7° | 69.3° |
| O3A | PB | O3B | O1B | 114.3° | 118.6° |
| O3A | PB | O3B | O2B | 111.9° | 110.4° |
| O3A | PB | O1B | O2B | 125.8° | 116.1° |
| O3A | PB | O3B | C10 | 94.2° | 155.8° |
| O3A | PB | O2B | H16 | 126.4° | 173.1° |
| O3B | PB | O1B | O2B | 126.4° | 129.1° |
| PB | O3B | C10 | C9' | 129.6° | 99.4° |
| O3B | PB | O2B | H16 | 127.6° | 77.4° |
| PB | O3B | C10 | H17 | 111.2° | 140.1° |
| PB | O3B | C10 | H18 | 10.5° | 21.2° |
| O1B | PB | O3B | C10 | 20.1° | 85.6° |
| O1B | PB | O2B | H16 | 0.0° | 54.0° |
| O2B | PB | O3B | C10 | 153.9° | 45.4° |
| O3B | C10 | C9' | H17 | 119.2° | 121.0° |
| O3B | C10 | C9' | H18 | 119.2° | 120.9° |
| O3B | C10 | C9' | C8' | 162.3° | 99.7° |
| O3B | C10 | C9' | O9' | 51.0° | 135.6° |
| O3B | C10 | H17 | H18 | 122.4° | 120.1° |
| O3B | C10 | C9' | H19 | 75.6° | 18.8° |
| C10 | C9' | C8' | O9' | 116.1° | 121.6° |
| C10 | C9' | C8' | H19 | 122.6° | 119.6° |
| C10 | C9' | O9' | H19 | 126.4° | 116.8° |
| C10 | C9' | C8' | S8' | 50.4° | 57.5° |
| C10 | C9' | C8' | C7' | 136.4° | 123.2° |
| C10 | C9' | O9' | C7 | 164.2° | 162.6° |
| C9' | C10 | H17 | H18 | 122.4° | 119.1° |
| C8' | C9' | O9' | H19 | 120.4° | 117.6° |
| C9' | C8' | S8' | C7' | 173.9° | 179.3° |
| C9' | C8' | C7' | C6' | 8.8° | 10.5° |
| C9' | C8' | C7' | S7' | 175.7° | 172.7° |
| C8' | C9' | O9' | C7 | 51.0° | 37.1° |
| C8' | C9' | C10 | H17 | 43.1° | 21.3° |
| C8' | C9' | C10 | H18 | 78.6° | 139.4° |
| O9' | C9' | C8' | S8' | 166.5° | 179.0° |
| O9' | C9' | C8' | C7' | 20.3° | 1.7° |
| C9' | O9' | C7 | C6' | 74.6° | 56.3° |
| C9' | O9' | C7 | N8' | 165.3° | 179.8° |
| O9' | C9' | C10 | H17 | 68.2° | 103.4° |
| O9' | C9' | C10 | H18 | 170.1° | 14.8° |
| C9' | O9' | C7 | H21 | 46.6° | 62.9° |
| S8' | C8' | C7' | C6' | 178.0° | 168.8° |
| S8' | C8' | C7' | S7' | 2.5° | 8.0° |
| S8' | C8' | C9' | H19 | 72.2° | 62.1° |
| C8' | C7' | C6' | S7' | 175.8° | 176.9° |
| C8' | C7' | C6' | N5' | 97.0° | 117.4° |
| C8' | C7' | C6' | C7 | 22.1° | 8.9° |
| C7' | C8' | C9' | H19 | 101.0° | 117.2° |
| C8' | C7' | C6' | H20 | 143.7° | 125.1° |
| C7' | C6' | N5' | C7 | 112.8° | 126.2° |
| C7' | C6' | N5' | H20 | 118.7° | 117.2° |
| C7' | C6' | C7 | H20 | 120.7° | 116.7° |
| C7' | C6' | C7 | N8' | 171.5° | 160.8° |
| C7' | C6' | C7 | O9' | 52.0° | 39.2° |
| C7' | C6' | N5' | C4A | 158.1° | 155.4° |
| C7' | C6' | C7 | H21 | 69.9° | 80.0° |
| C7' | C6' | N5' | H22 | 38.5° | 24.8° |
| S7' | C7' | C6' | N5' | 78.8° | 65.7° |
| S7' | C7' | C6' | C7 | 162.0° | 168.0° |
| S7' | C7' | C6' | H20 | 40.4° | 51.9° |
| N5' | C6' | C7 | H20 | 128.2° | 117.5° |
| N5' | C6' | C7 | N8' | 60.3° | 35.0° |
| N5' | C6' | C7 | O9' | 59.2° | 86.6° |
| C6' | N5' | C4A | H22 | 119.6° | 179.8° |
| C6' | N5' | C4A | C4B | 10.9° | 9.9° |
| C6' | N5' | C4A | C4' | 171.2° | 166.7° |
| N5' | C6' | C7 | H21 | 179.0° | 154.2° |
| C6' | C7 | N8' | O9' | 122.4° | 122.5° |
| C6' | C7 | N8' | H21 | 118.5° | 119.9° |
| C6' | C7 | O9' | H21 | 121.3° | 119.2° |
| C7 | C6' | N5' | C4A | 45.3° | 29.2° |
| C6' | C7 | N8' | C4B | 39.3° | 25.5° |
| C7 | C6' | N5' | H22 | 74.3° | 151.0° |
| C6' | C7 | N8' | H2 | 81.9° | 154.2° |
| N8' | C7 | O9' | H21 | 118.6° | 116.9° |
| C7 | N8' | C4B | C4A | 6.8° | 5.9° |
| C7 | N8' | C4B | H2 | 121.2° | 179.7° |
| C7 | N8' | C4B | N1' | 166.4° | 171.2° |
| N8' | C7 | C6' | H20 | 67.9° | 82.5° |
| O9' | C7 | N8' | C4B | 83.1° | 97.0° |
| C7 | O9' | C9' | H19 | 69.5° | 80.6° |
| O9' | C7 | C6' | H20 | 172.6° | 155.9° |
| O9' | C7 | N8' | H2 | 155.7° | 83.3° |
| N5' | C4A | C4B | C4' | 177.8° | 176.7° |
| N5' | C4A | C4B | N8' | 8.5° | 3.5° |
| N5' | C4A | C4B | N1' | 179.3° | 179.5° |
| N5' | C4A | C4' | N3' | 177.4° | 178.7° |
| N5' | C4A | C4' | O4' | 1.6° | 2.2° |
| C4A | N5' | C6' | H20 | 83.2° | 87.4° |
| C4A | C4B | N8' | N1' | 173.1° | 177.1° |
| C4A | C4B | N1' | C2' | 1.4° | 2.1° |
| C4B | C4A | C4' | N3' | 0.7° | 2.1° |
| C4B | C4A | C4' | O4' | 179.7° | 178.8° |
| C4B | C4A | N5' | H22 | 108.7° | 170.2° |
| C4A | C4B | N8' | H2 | 114.4° | 173.8° |
| C4' | C4A | C4B | N8' | 169.3° | 179.8° |
| C4' | C4A | C4B | N1' | 2.9° | 2.8° |
| C4A | C4' | N3' | C2' | 6.0° | 0.8° |
| C4A | C4' | N3' | O4' | 179.1° | 179.2° |
| C4' | C4A | N5' | H22 | 69.2° | 13.2° |
| C4A | C4' | N3' | H27 | 174.0° | 179.3° |
| N8' | C4B | N1' | C2' | 171.1° | 179.2° |
| C4B | N8' | C7 | H21 | 157.8° | 145.4° |
| C4B | N1' | C2' | N2' | 178.9° | 179.4° |
| C4B | N1' | C2' | N3' | 4.0° | 0.7° |
| N1' | C4B | N8' | H2 | 72.4° | 9.1° |
| N1' | C2' | N2' | N3' | 175.1° | 179.9° |
| N1' | C2' | N3' | C4' | 8.2° | 0.1° |
| N1' | C2' | N2' | H25 | 0.0° | 0.1° |
| N1' | C2' | N2' | H26 | 180.0° | 180.0° |
| N1' | C2' | N3' | H27 | 171.8° | 180.0° |
| N2' | C2' | N3' | C4' | 177.0° | 180.0° |
| C2' | N2' | H25 | H26 | 180.0° | 179.9° |
| N2' | C2' | N3' | H27 | 3.0° | 0.1° |
| C2' | N3' | C4' | H27 | 180.0° | 179.9° |
| C2' | N3' | C4' | O4' | 174.9° | 180.0° |
| N3' | C2' | N2' | H25 | 175.1° | 180.0° |
| N3' | C2' | N2' | H26 | 4.8° | 0.1° |
| O4' | C4' | N3' | H27 | 5.1° | 0.1° |
| H3 | C5 | C6 | H4 | 3.2° | 0.2° |
| H7 | C1' | C2D | H8 | 155.1° | 113.0° |
| H8 | C2D | O2' | H9 | 61.2° | 51.2° |
| H8 | C2D | C3' | H10 | 38.9° | 26.8° |
| H10 | C3' | C4D | H11 | 99.1° | 160.3° |
| H10 | C3' | O3' | H12 | 57.9° | 48.2° |
| H11 | C4D | C5' | H13 | 78.6° | 167.2° |
| H11 | C4D | C5' | H14 | 42.3° | 73.9° |
| H17 | C10 | C9' | H19 | 165.2° | 139.8° |
| H18 | C10 | C9' | H19 | 43.5° | 102.1° |
| H20 | C6' | C7 | H21 | 50.8° | 36.7° |
| H20 | C6' | N5' | H22 | 157.2° | 92.4° |
| H21 | C7 | N8' | H2 | 36.6° | 34.3° |
