BLI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C1 | sing | 1.48Å | 1.45Å | |
| N1 | C5 | sing | 1.35Å | 1.34Å | |
| N1 | C01 | sing | 1.47Å | 1.46Å | |
| C1 | C2 | sing | 1.52Å | 1.52Å | |
| C1 | C06 | sing | 1.55Å | 1.53Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C2 | N3 | sing | 1.47Å | 1.46Å | |
| C2 | H21 | sing | 1.09Å | 1.10Å | |
| C2 | H22 | sing | 1.09Å | 1.10Å | |
| N3 | C4 | sing | 1.47Å | 1.47Å | |
| N3 | S1 | sing | 1.66Å | 1.73Å | |
| C4 | C5 | sing | 1.51Å | 1.53Å | |
| C4 | H41 | sing | 1.09Å | 1.10Å | |
| C4 | H42 | sing | 1.09Å | 1.10Å | |
| C5 | O11 | doub | 1.21Å | 1.24Å | |
| C01 | C09 | sing | 1.51Å | 1.58Å | |
| C01 | C03 | sing | 1.54Å | 1.55Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C09 | O09 | doub | 1.21Å | 1.21Å | |
| C09 | N10 | sing | 1.35Å | 1.36Å | |
| N10 | C1' | sing | 1.47Å | 1.46Å | |
| N10 | H101 | sing | 0.97Å | 1.00Å | |
| C03 | C06 | sing | 1.55Å | 1.54Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| S1 | O2 | doub | 1.42Å | 1.45Å | |
| S1 | C02 | sing | 1.81Å | 1.80Å | |
| S1 | O1 | doub | 1.42Å | 1.41Å | |
| C02 | C6B | sing | 1.51Å | 1.50Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C02 | H022 | sing | 1.09Å | 1.10Å | |
| C1' | C2' | sing | 1.53Å | 1.50Å | |
| C1' | H1'1 | sing | 1.09Å | 1.10Å | |
| C1' | H1'2 | sing | 1.09Å | 1.10Å | |
| C2' | C3' | sing | 1.53Å | 1.51Å | |
| C2' | C4' | sing | 1.53Å | 1.52Å | |
| C2' | H2'1 | sing | 1.09Å | 1.10Å | |
| C3' | C7' | sing | 1.53Å | 1.52Å | |
| C3' | H3'1 | sing | 1.09Å | 1.10Å | |
| C3' | H3'2 | sing | 1.09Å | 1.10Å | |
| C7' | N1' | sing | 1.47Å | 1.47Å | |
| C7' | H7'1 | sing | 1.09Å | 1.10Å | |
| C7' | H7'2 | sing | 1.09Å | 1.10Å | |
| C4' | C5' | sing | 1.54Å | 1.53Å | |
| C4' | H4'1 | sing | 1.09Å | 1.10Å | |
| C4' | H4'2 | sing | 1.09Å | 1.10Å | |
| C5' | N1' | sing | 1.47Å | 1.47Å | |
| C5' | H5'1 | sing | 1.09Å | 1.10Å | |
| C5' | H5'2 | sing | 1.09Å | 1.10Å | |
| N1' | C6' | sing | 1.38Å | 1.40Å | |
| C6' | N2' | sing | 1.38Å | 1.27Å | |
| C6' | N3' | doub | 1.30Å | 1.35Å | |
| N2' | HN21 | sing | 0.97Å | 1.00Å | |
| N2' | HN22 | sing | 0.97Å | 1.00Å | |
| N3' | O3' | sing | 1.42Å | 1.43Å | |
| O3' | HO31 | sing | 0.97Å | 0.95Å | |
| C6B | C1B | doub | 1.38Å | 1.39Å | Aromatic |
| C6B | C5B | sing | 1.38Å | 1.39Å | Aromatic |
| C1B | C2B | sing | 1.38Å | 1.37Å | Aromatic |
| C1B | H1A1 | sing | 1.08Å | 1.08Å | |
| C2B | C3B | doub | 1.38Å | 1.38Å | Aromatic |
| C2B | H2A1 | sing | 1.08Å | 1.08Å | |
| C3B | C4B | sing | 1.38Å | 1.39Å | Aromatic |
| C3B | H3A1 | sing | 1.08Å | 1.08Å | |
| C4B | C5B | doub | 1.38Å | 1.37Å | Aromatic |
| C4B | H4A1 | sing | 1.08Å | 1.08Å | |
| C5B | H5A1 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N1 | C5 | 122.4° | 125.8° |
| C1 | N1 | C01 | 114.0° | 106.1° |
| N1 | C1 | C2 | 112.8° | 111.2° |
| N1 | C1 | C06 | 102.1° | 103.7° |
| N1 | C1 | H11 | 115.3° | 110.5° |
| C5 | N1 | C01 | 123.0° | 128.1° |
| N1 | C5 | C4 | 112.4° | 120.8° |
| N1 | C5 | O11 | 124.0° | 119.2° |
| N1 | C01 | C09 | 113.3° | 109.9° |
| N1 | C01 | C03 | 101.4° | 107.2° |
| N1 | C01 | H011 | 114.4° | 110.0° |
| C2 | C1 | C06 | 117.4° | 110.2° |
| C2 | C1 | H11 | 99.4° | 110.5° |
| C1 | C2 | N3 | 111.1° | 109.4° |
| C1 | C2 | H21 | 108.5° | 109.5° |
| C1 | C2 | H22 | 108.9° | 109.5° |
| C06 | C1 | H11 | 110.6° | 110.6° |
| C1 | C06 | C03 | 101.1° | 102.8° |
| C1 | C06 | H061 | 114.1° | 110.7° |
| C1 | C06 | H062 | 112.4° | 110.8° |
| N3 | C2 | H21 | 108.6° | 109.5° |
| N3 | C2 | H22 | 108.9° | 109.5° |
| C2 | N3 | C4 | 117.5° | 119.0° |
| C2 | N3 | S1 | 120.6° | 120.4° |
| H21 | C2 | H22 | 110.8° | 109.5° |
| C4 | N3 | S1 | 116.5° | 120.5° |
| N3 | C4 | C5 | 115.1° | 108.7° |
| N3 | C4 | H41 | 106.4° | 109.6° |
| N3 | C4 | H42 | 107.7° | 109.6° |
| N3 | S1 | O2 | 104.5° | 102.7° |
| N3 | S1 | C02 | 106.5° | 103.2° |
| N3 | S1 | O1 | 104.2° | 102.8° |
| C5 | C4 | H41 | 106.4° | 109.5° |
| C5 | C4 | H42 | 107.6° | 109.6° |
| C4 | C5 | O11 | 123.5° | 120.0° |
| H41 | C4 | H42 | 113.9° | 109.7° |
| C09 | C01 | C03 | 114.9° | 109.9° |
| C09 | C01 | H011 | 100.7° | 109.9° |
| C01 | C09 | O09 | 119.5° | 120.0° |
| C01 | C09 | N10 | 118.2° | 120.0° |
| C03 | C01 | H011 | 112.8° | 109.9° |
| C01 | C03 | C06 | 105.2° | 105.0° |
| C01 | C03 | H031 | 111.8° | 110.3° |
| C01 | C03 | H032 | 110.9° | 110.3° |
| O09 | C09 | N10 | 122.3° | 120.0° |
| C09 | N10 | C1' | 120.3° | 120.0° |
| C09 | N10 | H101 | 119.8° | 120.0° |
| C1' | N10 | H101 | 119.8° | 120.0° |
| N10 | C1' | C2' | 105.5° | 109.5° |
| N10 | C1' | H1'1 | 111.7° | 109.4° |
| N10 | C1' | H1'2 | 110.8° | 109.4° |
| C06 | C03 | H031 | 111.9° | 110.3° |
| C06 | C03 | H032 | 110.9° | 110.4° |
| C03 | C06 | H061 | 114.1° | 110.7° |
| C03 | C06 | H062 | 112.3° | 110.8° |
| H031 | C03 | H032 | 106.2° | 110.4° |
| H061 | C06 | H062 | 103.2° | 110.8° |
| O2 | S1 | C02 | 107.0° | 111.6° |
| O2 | S1 | O1 | 120.1° | 122.1° |
| C02 | S1 | O1 | 113.5° | 111.7° |
| S1 | C02 | C6B | 112.5° | 109.4° |
| S1 | C02 | H021 | 107.8° | 109.4° |
| S1 | C02 | H022 | 108.5° | 109.5° |
| C6B | C02 | H021 | 107.8° | 109.5° |
| C6B | C02 | H022 | 108.5° | 109.5° |
| C02 | C6B | C1B | 121.2° | 120.0° |
| C02 | C6B | C5B | 117.7° | 120.0° |
| H021 | C02 | H022 | 111.9° | 109.5° |
| C2' | C1' | H1'1 | 111.7° | 109.5° |
| C2' | C1' | H1'2 | 110.8° | 109.5° |
| C1' | C2' | C3' | 110.3° | 109.4° |
| C1' | C2' | C4' | 111.9° | 109.5° |
| C1' | C2' | H2'1 | 107.7° | 109.4° |
| H1'1 | C1' | H1'2 | 106.4° | 109.5° |
| C3' | C2' | C4' | 110.8° | 109.5° |
| C3' | C2' | H2'1 | 108.8° | 109.4° |
| C2' | C3' | C7' | 108.4° | 109.3° |
| C2' | C3' | H3'1 | 110.0° | 109.5° |
| C2' | C3' | H3'2 | 109.8° | 109.5° |
| C4' | C2' | H2'1 | 107.1° | 109.5° |
| C2' | C4' | C5' | 107.3° | 109.3° |
| C2' | C4' | H4'1 | 110.7° | 109.5° |
| C2' | C4' | H4'2 | 110.2° | 109.5° |
| C7' | C3' | H3'1 | 110.1° | 109.5° |
| C7' | C3' | H3'2 | 109.8° | 109.5° |
| C3' | C7' | N1' | 114.3° | 108.8° |
| C3' | C7' | H7'1 | 106.8° | 109.6° |
| C3' | C7' | H7'2 | 107.9° | 109.6° |
| H3'1 | C3' | H3'2 | 108.6° | 109.5° |
| N1' | C7' | H7'1 | 106.8° | 109.6° |
| N1' | C7' | H7'2 | 107.9° | 109.5° |
| C7' | N1' | C5' | 117.3° | 118.7° |
| C7' | N1' | C6' | 109.4° | 120.6° |
| H7'1 | C7' | H7'2 | 113.3° | 109.7° |
| C5' | C4' | H4'1 | 110.6° | 109.7° |
| C5' | C4' | H4'2 | 110.2° | 109.4° |
| C4' | C5' | N1' | 115.0° | 108.6° |
| C4' | C5' | H5'1 | 106.4° | 109.6° |
| C4' | C5' | H5'2 | 107.7° | 109.6° |
| H4'1 | C4' | H4'2 | 107.8° | 109.5° |
| N1' | C5' | H5'1 | 106.4° | 109.8° |
| N1' | C5' | H5'2 | 107.7° | 109.5° |
| C5' | N1' | C6' | 114.3° | 120.6° |
| H5'1 | C5' | H5'2 | 113.9° | 109.7° |
| N1' | C6' | N2' | 118.6° | 120.0° |
| N1' | C6' | N3' | 124.5° | 120.0° |
| N2' | C6' | N3' | 116.9° | 120.0° |
| C6' | N2' | HN21 | 124.9° | 120.0° |
| C6' | N2' | HN22 | 110.3° | 120.0° |
| C6' | N3' | O3' | 129.7° | 120.0° |
| HN21 | N2' | HN22 | 124.9° | 120.1° |
| N3' | O3' | HO31 | 109.5° | 106.8° |
| C1B | C6B | C5B | 120.9° | 120.0° |
| C6B | C1B | C2B | 118.5° | 119.9° |
| C6B | C1B | H1A1 | 120.7° | 120.0° |
| C6B | C5B | C4B | 119.1° | 120.0° |
| C6B | C5B | H5A1 | 120.5° | 120.0° |
| C2B | C1B | H1A1 | 120.7° | 120.1° |
| C1B | C2B | C3B | 119.4° | 120.0° |
| C1B | C2B | H2A1 | 120.3° | 119.9° |
| C3B | C2B | H2A1 | 120.3° | 120.0° |
| C2B | C3B | C4B | 121.3° | 120.0° |
| C2B | C3B | H3A1 | 119.4° | 120.0° |
| C4B | C3B | H3A1 | 119.4° | 120.0° |
| C3B | C4B | C5B | 119.1° | 120.0° |
| C3B | C4B | H4A1 | 120.5° | 120.0° |
| C5B | C4B | H4A1 | 120.5° | 120.0° |
| C4B | C5B | H5A1 | 120.4° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | N1 | C5 | C01 | 170.3° | 178.7° |
| N1 | C1 | C2 | C06 | 118.2° | 114.4° |
| N1 | C1 | C2 | H11 | 122.7° | 123.2° |
| N1 | C1 | C06 | H11 | 123.2° | 118.5° |
| N1 | C1 | C2 | N3 | 48.6° | 40.8° |
| N1 | C1 | C2 | H21 | 70.7° | 160.8° |
| N1 | C1 | C2 | H22 | 168.6° | 79.3° |
| C1 | N1 | C5 | C4 | 9.9° | 12.4° |
| C1 | N1 | C5 | O11 | 172.8° | 166.8° |
| C1 | N1 | C01 | C09 | 122.0° | 94.6° |
| C1 | N1 | C01 | C03 | 1.7° | 24.9° |
| C1 | N1 | C01 | H011 | 123.3° | 144.3° |
| N1 | C1 | C06 | C03 | 37.9° | 36.7° |
| N1 | C1 | C06 | H061 | 160.8° | 155.0° |
| N1 | C1 | C06 | H062 | 82.1° | 81.7° |
| C5 | N1 | C1 | C2 | 36.4° | 21.9° |
| C5 | N1 | C1 | C06 | 163.2° | 140.3° |
| C5 | N1 | C1 | H11 | 76.8° | 101.2° |
| N1 | C5 | C4 | N3 | 44.1° | 21.8° |
| N1 | C5 | C4 | O11 | 177.3° | 179.3° |
| N1 | C5 | C4 | H41 | 161.6° | 141.5° |
| N1 | C5 | C4 | H42 | 75.9° | 98.0° |
| C5 | N1 | C01 | C09 | 49.1° | 86.5° |
| C5 | N1 | C01 | C03 | 172.7° | 154.1° |
| C5 | N1 | C01 | H011 | 65.6° | 34.6° |
| C01 | N1 | C1 | C2 | 152.5° | 157.0° |
| C01 | N1 | C1 | C06 | 25.6° | 38.6° |
| C01 | N1 | C1 | H11 | 94.3° | 79.9° |
| C01 | N1 | C5 | C4 | 160.4° | 166.3° |
| C01 | N1 | C5 | O11 | 16.9° | 14.4° |
| N1 | C01 | C09 | C03 | 115.9° | 117.8° |
| N1 | C01 | C09 | H011 | 122.6° | 121.1° |
| N1 | C01 | C03 | H011 | 122.8° | 119.5° |
| N1 | C01 | C09 | O09 | 10.4° | 0.4° |
| N1 | C01 | C09 | N10 | 169.2° | 179.6° |
| N1 | C01 | C03 | C06 | 23.1° | 1.2° |
| N1 | C01 | C03 | H031 | 144.7° | 120.1° |
| N1 | C01 | C03 | H032 | 96.9° | 117.7° |
| C2 | C1 | C06 | H11 | 113.0° | 122.4° |
| C1 | C2 | N3 | H21 | 119.3° | 120.0° |
| C1 | C2 | N3 | H22 | 120.0° | 120.0° |
| C1 | C2 | H21 | H22 | 119.5° | 120.0° |
| C1 | C2 | N3 | C4 | 15.6° | 58.3° |
| C1 | C2 | N3 | S1 | 137.7° | 121.7° |
| C2 | C1 | C06 | C03 | 161.7° | 155.8° |
| C2 | C1 | C06 | H061 | 75.4° | 85.9° |
| C2 | C1 | C06 | H062 | 41.7° | 37.5° |
| C06 | C1 | C2 | N3 | 166.8° | 155.2° |
| C06 | C1 | C2 | H21 | 47.5° | 84.8° |
| C06 | C1 | C2 | H22 | 73.2° | 35.1° |
| C1 | C06 | C03 | C01 | 38.3° | 21.4° |
| C1 | C06 | C03 | H061 | 123.0° | 118.3° |
| C1 | C06 | C03 | H062 | 120.0° | 118.4° |
| C1 | C06 | C03 | H031 | 159.9° | 97.4° |
| C1 | C06 | C03 | H032 | 81.7° | 140.3° |
| C1 | C06 | H061 | H062 | 122.2° | 123.3° |
| H11 | C1 | C2 | N3 | 74.1° | 82.4° |
| H11 | C1 | C2 | H21 | 166.6° | 37.6° |
| H11 | C1 | C2 | H22 | 45.9° | 157.6° |
| H11 | C1 | C06 | C03 | 85.3° | 81.8° |
| H11 | C1 | C06 | H061 | 37.6° | 36.5° |
| H11 | C1 | C06 | H062 | 154.7° | 159.8° |
| N3 | C2 | H21 | H22 | 119.6° | 120.1° |
| C2 | N3 | C4 | S1 | 154.4° | 180.0° |
| C2 | N3 | C4 | C5 | 29.7° | 46.8° |
| C2 | N3 | C4 | H41 | 147.2° | 166.5° |
| C2 | N3 | C4 | H42 | 90.3° | 73.0° |
| C2 | N3 | S1 | O2 | 48.0° | 153.9° |
| C2 | N3 | S1 | C02 | 65.0° | 90.0° |
| C2 | N3 | S1 | O1 | 174.8° | 26.2° |
| H21 | C2 | N3 | C4 | 103.7° | 178.3° |
| H21 | C2 | N3 | S1 | 103.0° | 1.7° |
| H22 | C2 | N3 | C4 | 135.6° | 61.7° |
| H22 | C2 | N3 | S1 | 17.7° | 118.3° |
| N3 | C4 | C5 | H41 | 117.5° | 119.8° |
| N3 | C4 | C5 | H42 | 120.0° | 119.8° |
| N3 | C4 | H41 | H42 | 118.4° | 120.4° |
| N3 | C4 | C5 | O11 | 138.7° | 157.5° |
| C4 | N3 | S1 | O2 | 105.5° | 26.2° |
| C4 | N3 | S1 | C02 | 141.5° | 90.0° |
| C4 | N3 | S1 | O1 | 21.3° | 153.8° |
| S1 | N3 | C4 | C5 | 175.9° | 133.3° |
| S1 | N3 | C4 | H41 | 58.4° | 13.5° |
| S1 | N3 | C4 | H42 | 64.1° | 107.0° |
| N3 | S1 | O2 | C02 | 112.7° | 109.9° |
| N3 | S1 | O2 | O1 | 116.2° | 114.2° |
| N3 | S1 | C02 | O1 | 114.0° | 109.8° |
| N3 | S1 | C02 | C6B | 43.5° | 180.0° |
| N3 | S1 | C02 | H021 | 75.2° | 60.1° |
| N3 | S1 | C02 | H022 | 163.5° | 60.0° |
| C5 | C4 | H41 | H42 | 118.4° | 120.3° |
| H41 | C4 | C5 | O11 | 21.1° | 37.7° |
| H42 | C4 | C5 | O11 | 101.3° | 82.7° |
| C09 | C01 | C03 | H011 | 114.7° | 121.1° |
| C01 | C09 | O09 | N10 | 179.6° | 180.0° |
| C01 | C09 | N10 | C1' | 177.7° | 180.0° |
| C01 | C09 | N10 | H101 | 2.3° | 0.0° |
| C09 | C01 | C03 | C06 | 145.7° | 118.2° |
| C09 | C01 | C03 | H031 | 92.7° | 0.6° |
| C09 | C01 | C03 | H032 | 25.7° | 122.9° |
| C03 | C01 | C09 | O09 | 105.5° | 118.2° |
| C03 | C01 | C09 | N10 | 74.9° | 61.8° |
| C01 | C03 | C06 | H031 | 121.6° | 118.9° |
| C01 | C03 | C06 | H032 | 120.0° | 118.9° |
| C01 | C03 | H031 | H032 | 121.1° | 122.2° |
| C01 | C03 | C06 | H061 | 161.2° | 139.8° |
| C01 | C03 | C06 | H062 | 81.7° | 96.9° |
| H011 | C01 | C09 | O09 | 133.0° | 120.8° |
| H011 | C01 | C09 | N10 | 46.6° | 59.3° |
| H011 | C01 | C03 | C06 | 99.6° | 120.7° |
| H011 | C01 | C03 | H031 | 22.0° | 120.5° |
| H011 | C01 | C03 | H032 | 140.4° | 1.8° |
| O09 | C09 | N10 | C1' | 2.7° | 0.0° |
| O09 | C09 | N10 | H101 | 177.3° | 180.0° |
| C09 | N10 | C1' | H101 | 180.0° | 179.9° |
| C09 | N10 | C1' | C2' | 76.4° | 180.0° |
| C09 | N10 | C1' | H1'1 | 45.1° | 60.0° |
| C09 | N10 | C1' | H1'2 | 163.6° | 60.0° |
| N10 | C1' | C2' | H1'1 | 121.5° | 119.9° |
| N10 | C1' | C2' | H1'2 | 120.0° | 120.0° |
| N10 | C1' | H1'1 | H1'2 | 121.1° | 120.0° |
| N10 | C1' | C2' | C3' | 118.2° | 175.0° |
| N10 | C1' | C2' | C4' | 117.9° | 64.9° |
| N10 | C1' | C2' | H2'1 | 0.4° | 55.1° |
| H101 | N10 | C1' | C2' | 103.6° | 0.1° |
| H101 | N10 | C1' | H1'1 | 134.9° | 120.0° |
| H101 | N10 | C1' | H1'2 | 16.4° | 120.0° |
| C06 | C03 | H031 | H032 | 121.2° | 122.3° |
| C03 | C06 | H061 | H062 | 122.2° | 123.3° |
| H031 | C03 | C06 | H061 | 77.2° | 20.9° |
| H031 | C03 | C06 | H062 | 39.9° | 144.2° |
| H032 | C03 | C06 | H061 | 41.3° | 101.4° |
| H032 | C03 | C06 | H062 | 158.3° | 21.9° |
| O2 | S1 | C02 | O1 | 134.7° | 140.6° |
| O2 | S1 | C02 | C6B | 154.8° | 70.3° |
| O2 | S1 | C02 | H021 | 36.1° | 169.7° |
| O2 | S1 | C02 | H022 | 85.2° | 49.7° |
| S1 | C02 | C6B | H021 | 118.7° | 119.9° |
| S1 | C02 | C6B | H022 | 120.0° | 120.0° |
| S1 | C02 | H021 | H022 | 119.2° | 120.1° |
| S1 | C02 | C6B | C1B | 129.1° | 90.0° |
| S1 | C02 | C6B | C5B | 45.1° | 90.3° |
| O1 | S1 | C02 | C6B | 70.4° | 70.3° |
| O1 | S1 | C02 | H021 | 170.8° | 49.7° |
| O1 | S1 | C02 | H022 | 49.5° | 169.8° |
| C6B | C02 | H021 | H022 | 119.1° | 120.0° |
| C02 | C6B | C1B | C5B | 174.0° | 179.7° |
| C02 | C6B | C1B | C2B | 160.0° | 180.0° |
| C02 | C6B | C1B | H1A1 | 20.0° | 0.0° |
| C02 | C6B | C5B | C4B | 159.7° | 179.8° |
| C02 | C6B | C5B | H5A1 | 20.3° | 0.3° |
| H021 | C02 | C6B | C1B | 10.4° | 29.9° |
| H021 | C02 | C6B | C5B | 163.8° | 149.8° |
| H022 | C02 | C6B | C1B | 110.9° | 150.0° |
| H022 | C02 | C6B | C5B | 74.9° | 29.7° |
| C2' | C1' | H1'1 | H1'2 | 121.1° | 120.1° |
| C1' | C2' | C3' | C4' | 124.5° | 120.0° |
| C1' | C2' | C3' | H2'1 | 118.0° | 119.9° |
| C1' | C2' | C4' | H2'1 | 117.9° | 120.0° |
| C1' | C2' | C3' | C7' | 172.4° | 178.6° |
| C1' | C2' | C3' | H3'1 | 67.1° | 61.5° |
| C1' | C2' | C3' | H3'2 | 52.4° | 58.6° |
| C1' | C2' | C4' | C5' | 174.3° | 178.5° |
| C1' | C2' | C4' | H4'1 | 53.4° | 61.4° |
| C1' | C2' | C4' | H4'2 | 65.7° | 58.7° |
| H1'1 | C1' | C2' | C3' | 120.3° | 65.1° |
| H1'1 | C1' | C2' | C4' | 3.6° | 55.0° |
| H1'1 | C1' | C2' | H2'1 | 121.1° | 175.0° |
| H1'2 | C1' | C2' | C3' | 1.8° | 55.0° |
| H1'2 | C1' | C2' | C4' | 122.1° | 175.1° |
| H1'2 | C1' | C2' | H2'1 | 120.4° | 64.9° |
| C3' | C2' | C4' | H2'1 | 118.6° | 120.0° |
| C2' | C3' | C7' | H3'1 | 120.4° | 119.9° |
| C2' | C3' | C7' | H3'2 | 120.0° | 120.0° |
| C2' | C3' | H3'1 | H3'2 | 120.3° | 120.1° |
| C2' | C3' | C7' | N1' | 50.3° | 54.6° |
| C2' | C3' | C7' | H7'1 | 168.2° | 174.4° |
| C2' | C3' | C7' | H7'2 | 69.7° | 65.1° |
| C3' | C2' | C4' | C5' | 62.2° | 61.5° |
| C3' | C2' | C4' | H4'1 | 177.0° | 58.6° |
| C3' | C2' | C4' | H4'2 | 57.8° | 178.7° |
| C4' | C2' | C3' | C7' | 63.1° | 61.3° |
| C4' | C2' | C3' | H3'1 | 57.4° | 58.6° |
| C4' | C2' | C3' | H3'2 | 176.9° | 178.7° |
| C2' | C4' | C5' | H4'1 | 120.9° | 120.0° |
| C2' | C4' | C5' | H4'2 | 120.0° | 119.8° |
| C2' | C4' | H4'1 | H4'2 | 120.6° | 120.0° |
| C2' | C4' | C5' | N1' | 49.6° | 54.9° |
| C2' | C4' | C5' | H5'1 | 68.0° | 65.1° |
| C2' | C4' | C5' | H5'2 | 169.6° | 174.5° |
| H2'1 | C2' | C3' | C7' | 54.5° | 58.7° |
| H2'1 | C2' | C3' | H3'1 | 174.9° | 178.6° |
| H2'1 | C2' | C3' | H3'2 | 65.5° | 61.3° |
| H2'1 | C2' | C4' | C5' | 56.4° | 58.5° |
| H2'1 | C2' | C4' | H4'1 | 64.4° | 178.6° |
| H2'1 | C2' | C4' | H4'2 | 176.4° | 61.3° |
| C7' | C3' | H3'1 | H3'2 | 120.3° | 120.1° |
| C3' | C7' | N1' | H7'1 | 117.9° | 119.9° |
| C3' | C7' | N1' | H7'2 | 120.0° | 119.8° |
| C3' | C7' | H7'1 | H7'2 | 118.6° | 120.4° |
| C3' | C7' | N1' | C5' | 40.3° | 53.8° |
| C3' | C7' | N1' | C6' | 172.5° | 126.4° |
| H3'1 | C3' | C7' | N1' | 70.1° | 65.4° |
| H3'1 | C3' | C7' | H7'1 | 47.8° | 54.5° |
| H3'1 | C3' | C7' | H7'2 | 169.9° | 174.9° |
| H3'2 | C3' | C7' | N1' | 170.3° | 174.6° |
| H3'2 | C3' | C7' | H7'1 | 71.8° | 65.6° |
| H3'2 | C3' | C7' | H7'2 | 50.3° | 54.8° |
| N1' | C7' | H7'1 | H7'2 | 118.7° | 120.3° |
| C7' | N1' | C5' | C4' | 40.4° | 53.8° |
| C7' | N1' | C5' | C6' | 130.0° | 179.8° |
| C7' | N1' | C5' | H5'1 | 77.2° | 66.0° |
| C7' | N1' | C5' | H5'2 | 160.4° | 173.5° |
| C7' | N1' | C6' | N2' | 177.3° | 5.3° |
| C7' | N1' | C6' | N3' | 2.1° | 174.7° |
| H7'1 | C7' | N1' | C5' | 158.1° | 173.6° |
| H7'1 | C7' | N1' | C6' | 69.6° | 6.6° |
| H7'2 | C7' | N1' | C5' | 79.7° | 66.0° |
| H7'2 | C7' | N1' | C6' | 52.5° | 113.8° |
| C5' | C4' | H4'1 | H4'2 | 120.6° | 120.1° |
| C4' | C5' | N1' | H5'1 | 117.6° | 119.8° |
| C4' | C5' | N1' | H5'2 | 120.0° | 119.7° |
| C4' | C5' | H5'1 | H5'2 | 118.5° | 120.4° |
| C4' | C5' | N1' | C6' | 170.3° | 126.4° |
| H4'1 | C4' | C5' | N1' | 170.4° | 65.2° |
| H4'1 | C4' | C5' | H5'1 | 52.9° | 174.9° |
| H4'1 | C4' | C5' | H5'2 | 69.6° | 54.4° |
| H4'2 | C4' | C5' | N1' | 70.5° | 174.7° |
| H4'2 | C4' | C5' | H5'1 | 172.0° | 54.7° |
| H4'2 | C4' | C5' | H5'2 | 49.5° | 65.7° |
| N1' | C5' | H5'1 | H5'2 | 118.4° | 120.4° |
| C5' | N1' | C6' | N2' | 49.0° | 174.9° |
| C5' | N1' | C6' | N3' | 131.7° | 5.1° |
| H5'1 | C5' | N1' | C6' | 52.8° | 113.8° |
| H5'2 | C5' | N1' | C6' | 69.6° | 6.7° |
| N1' | C6' | N2' | N3' | 179.4° | 180.0° |
| N1' | C6' | N2' | HN21 | 0.0° | 5.5° |
| N1' | C6' | N2' | HN22 | 180.0° | 174.1° |
| N1' | C6' | N3' | O3' | 55.0° | 180.0° |
| C6' | N2' | HN21 | HN22 | 180.0° | 179.7° |
| N2' | C6' | N3' | O3' | 124.4° | 0.0° |
| N3' | C6' | N2' | HN21 | 179.4° | 174.5° |
| N3' | C6' | N2' | HN22 | 0.6° | 5.9° |
| C6' | N3' | O3' | HO31 | 151.8° | 180.0° |
| C6B | C1B | C2B | H1A1 | 180.0° | 180.0° |
| C6B | C1B | C2B | C3B | 3.6° | 0.0° |
| C6B | C1B | C2B | H2A1 | 176.4° | 179.9° |
| C1B | C6B | C5B | C4B | 14.5° | 0.5° |
| C1B | C6B | C5B | H5A1 | 165.5° | 180.0° |
| C5B | C6B | C1B | C2B | 14.0° | 0.3° |
| C5B | C6B | C1B | H1A1 | 166.0° | 179.7° |
| C6B | C5B | C4B | C3B | 4.5° | 0.5° |
| C6B | C5B | C4B | H5A1 | 180.0° | 179.5° |
| C6B | C5B | C4B | H4A1 | 175.5° | 179.7° |
| C1B | C2B | C3B | H2A1 | 180.0° | 179.9° |
| C1B | C2B | C3B | C4B | 6.3° | 0.0° |
| C1B | C2B | C3B | H3A1 | 173.7° | 180.0° |
| H1A1 | C1B | C2B | C3B | 176.4° | 180.0° |
| H1A1 | C1B | C2B | H2A1 | 3.6° | 0.1° |
| C2B | C3B | C4B | H3A1 | 180.0° | 180.0° |
| C2B | C3B | C4B | C5B | 5.9° | 0.2° |
| C2B | C3B | C4B | H4A1 | 174.1° | 180.0° |
| H2A1 | C2B | C3B | C4B | 173.7° | 180.0° |
| H2A1 | C2B | C3B | H3A1 | 6.3° | 0.0° |
| C3B | C4B | C5B | H4A1 | 180.0° | 179.8° |
| C3B | C4B | C5B | H5A1 | 175.5° | 180.0° |
| H3A1 | C3B | C4B | C5B | 174.1° | 179.8° |
| H3A1 | C3B | C4B | H4A1 | 5.9° | 0.0° |
| H4A1 | C4B | C5B | H5A1 | 4.5° | 0.2° |
