1IQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C5' | C6' | sing | 1.42Å | 1.51Å | Aromatic |
| C5' | CA' | doub | 1.40Å | 1.40Å | Aromatic |
| C5' | C4' | sing | 1.41Å | 1.42Å | Aromatic |
| C6' | C7' | doub | 1.41Å | 1.42Å | Aromatic |
| C6' | N1' | sing | 1.34Å | 1.42Å | Aromatic |
| C7' | C8' | sing | 1.36Å | 1.40Å | Aromatic |
| C7' | H7' | sing | 1.08Å | 1.10Å | |
| C8' | C9' | doub | 1.39Å | 1.39Å | Aromatic |
| C8' | H8' | sing | 1.08Å | 1.10Å | |
| C9' | CA' | sing | 1.36Å | 1.45Å | Aromatic |
| C9' | H9' | sing | 1.08Å | 1.10Å | |
| CA' | H10' | sing | 1.08Å | 1.10Å | |
| N1' | C2' | doub | 1.32Å | 1.40Å | Aromatic |
| C4' | C3' | doub | 1.39Å | 1.42Å | Aromatic |
| C4' | H4' | sing | 1.08Å | 1.10Å | |
| C3' | C2' | sing | 1.41Å | 1.44Å | Aromatic |
| C3' | CB' | sing | 1.48Å | 1.57Å | |
| C2' | C2 | sing | 1.48Å | 1.49Å | |
| CB' | OC' | sing | 1.35Å | 1.22Å | |
| CB' | OD' | doub | 1.22Å | 1.23Å | |
| OC' | H12' | sing | 0.97Å | 0.95Å | |
| N3 | C2 | doub | 1.29Å | 1.34Å | |
| N3 | C4 | sing | 1.47Å | 1.44Å | |
| C2 | N1 | sing | 1.38Å | 1.35Å | |
| N1 | C5 | sing | 1.35Å | 1.38Å | |
| N1 | HN1 | sing | 0.97Å | 1.02Å | |
| C5 | C4 | sing | 1.52Å | 1.50Å | |
| C5 | O6 | doub | 1.21Å | 1.21Å | |
| C4 | C8 | sing | 1.53Å | 1.60Å | |
| C4 | C7 | sing | 1.53Å | 1.55Å | |
| C8 | C10 | sing | 1.53Å | 1.54Å | |
| C8 | C9 | sing | 1.53Å | 1.55Å | |
| C8 | H8 | sing | 1.09Å | 1.11Å | |
| C7 | H71 | sing | 1.09Å | 1.12Å | |
| C7 | H72 | sing | 1.09Å | 1.12Å | |
| C7 | H73 | sing | 1.09Å | 1.11Å | |
| C10 | H101 | sing | 1.09Å | 1.11Å | |
| C10 | H102 | sing | 1.09Å | 1.12Å | |
| C10 | H103 | sing | 1.09Å | 1.11Å | |
| C9 | H91 | sing | 1.09Å | 1.11Å | |
| C9 | H92 | sing | 1.09Å | 1.12Å | |
| C9 | H93 | sing | 1.09Å | 1.12Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C6' | C5' | CA' | 118.4° | 119.6° |
| C6' | C5' | C4' | 117.4° | 119.3° |
| C5' | C6' | C7' | 119.3° | 119.0° |
| C5' | C6' | N1' | 118.8° | 120.3° |
| CA' | C5' | C4' | 124.2° | 121.1° |
| C5' | CA' | C9' | 118.9° | 119.6° |
| C5' | CA' | H10' | 118.9° | 120.2° |
| C5' | C4' | C3' | 122.2° | 118.1° |
| C5' | C4' | H4' | 118.9° | 120.9° |
| C7' | C6' | N1' | 121.9° | 120.7° |
| C6' | C7' | C8' | 120.9° | 119.8° |
| C6' | C7' | H7' | 120.3° | 120.1° |
| C6' | N1' | C2' | 121.4° | 121.7° |
| C8' | C7' | H7' | 118.8° | 120.1° |
| C7' | C8' | C9' | 119.8° | 121.1° |
| C7' | C8' | H8' | 120.2° | 119.5° |
| C9' | C8' | H8' | 120.1° | 119.5° |
| C8' | C9' | CA' | 122.7° | 120.9° |
| C8' | C9' | H9' | 116.7° | 119.5° |
| CA' | C9' | H9' | 120.6° | 119.6° |
| C9' | CA' | H10' | 122.2° | 120.2° |
| N1' | C2' | C3' | 120.6° | 121.3° |
| N1' | C2' | C2 | 113.8° | 119.3° |
| C3' | C4' | H4' | 118.9° | 121.0° |
| C4' | C3' | C2' | 119.6° | 119.4° |
| C4' | C3' | CB' | 120.2° | 120.3° |
| C2' | C3' | CB' | 120.2° | 120.3° |
| C3' | C2' | C2 | 125.6° | 119.4° |
| C3' | CB' | OC' | 124.1° | 120.0° |
| C3' | CB' | OD' | 115.9° | 120.0° |
| C2' | C2 | N3 | 119.6° | 123.6° |
| C2' | C2 | N1 | 121.6° | 123.5° |
| OC' | CB' | OD' | 120.1° | 120.0° |
| CB' | OC' | H12' | 124.1° | 120.0° |
| C2 | N3 | C4 | 101.6° | 107.6° |
| N3 | C2 | N1 | 118.8° | 112.8° |
| N3 | C4 | C5 | 108.2° | 104.0° |
| N3 | C4 | C8 | 107.9° | 110.5° |
| N3 | C4 | C7 | 108.7° | 110.6° |
| C2 | N1 | C5 | 106.1° | 110.6° |
| C2 | N1 | HN1 | 126.2° | 124.7° |
| C5 | N1 | HN1 | 127.7° | 124.7° |
| N1 | C5 | C4 | 105.2° | 104.9° |
| N1 | C5 | O6 | 123.5° | 127.5° |
| C4 | C5 | O6 | 131.3° | 127.6° |
| C5 | C4 | C8 | 117.3° | 110.5° |
| C5 | C4 | C7 | 113.6° | 110.6° |
| C8 | C4 | C7 | 100.6° | 110.5° |
| C4 | C8 | C10 | 111.4° | 109.5° |
| C4 | C8 | C9 | 112.5° | 109.5° |
| C4 | C8 | H8 | 105.2° | 109.5° |
| C4 | C7 | H71 | 112.5° | 109.5° |
| C4 | C7 | H72 | 108.7° | 109.5° |
| C4 | C7 | H73 | 112.5° | 109.5° |
| C10 | C8 | C9 | 106.9° | 109.5° |
| C10 | C8 | H8 | 111.0° | 109.4° |
| C8 | C10 | H101 | 111.5° | 109.5° |
| C8 | C10 | H102 | 111.4° | 109.4° |
| C8 | C10 | H103 | 111.5° | 109.5° |
| C9 | C8 | H8 | 109.8° | 109.5° |
| C8 | C9 | H91 | 111.0° | 109.4° |
| C8 | C9 | H92 | 112.5° | 109.4° |
| C8 | C9 | H93 | 111.1° | 109.4° |
| H71 | C7 | H72 | 112.5° | 109.5° |
| H71 | C7 | H73 | 98.0° | 109.5° |
| H72 | C7 | H73 | 112.5° | 109.4° |
| H101 | C10 | H102 | 111.5° | 109.5° |
| H101 | C10 | H103 | 98.9° | 109.5° |
| H102 | C10 | H103 | 111.5° | 109.5° |
| H91 | C9 | H92 | 111.1° | 109.5° |
| H91 | C9 | H93 | 99.3° | 109.5° |
| H92 | C9 | H93 | 111.1° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C6' | C5' | CA' | C4' | 179.8° | 180.0° |
| C5' | C6' | C7' | N1' | 179.5° | 180.0° |
| C5' | C6' | C7' | C8' | 0.1° | 0.0° |
| C5' | C6' | C7' | H7' | 179.9° | 179.9° |
| C6' | C5' | CA' | C9' | 0.2° | 0.0° |
| C6' | C5' | CA' | H10' | 179.8° | 180.0° |
| C5' | C6' | N1' | C2' | 0.2° | 0.0° |
| C6' | C5' | C4' | C3' | 0.0° | 0.2° |
| C6' | C5' | C4' | H4' | 180.0° | 180.0° |
| CA' | C5' | C6' | C7' | 0.0° | 0.0° |
| CA' | C5' | C6' | N1' | 179.5° | 180.0° |
| C5' | CA' | C9' | C8' | 0.4° | 0.0° |
| C5' | CA' | C9' | H10' | 180.0° | 180.0° |
| C5' | CA' | C9' | H9' | 179.6° | 180.0° |
| CA' | C5' | C4' | C3' | 179.7° | 179.8° |
| CA' | C5' | C4' | H4' | 0.2° | 0.0° |
| C4' | C5' | C6' | C7' | 179.8° | 180.0° |
| C4' | C5' | C6' | N1' | 0.2° | 0.0° |
| C4' | C5' | CA' | C9' | 180.0° | 180.0° |
| C4' | C5' | CA' | H10' | 0.0° | 0.0° |
| C5' | C4' | C3' | H4' | 180.0° | 179.8° |
| C5' | C4' | C3' | C2' | 0.2° | 0.4° |
| C5' | C4' | C3' | CB' | 179.9° | 180.0° |
| C6' | C7' | C8' | H7' | 180.0° | 179.9° |
| C6' | C7' | C8' | C9' | 0.1° | 0.0° |
| C6' | C7' | C8' | H8' | 179.9° | 180.0° |
| C7' | C6' | N1' | C2' | 179.8° | 179.9° |
| N1' | C6' | C7' | C8' | 179.6° | 180.0° |
| N1' | C6' | C7' | H7' | 0.4° | 0.1° |
| C6' | N1' | C2' | C3' | 0.0° | 0.2° |
| C6' | N1' | C2' | C2 | 179.9° | 180.0° |
| C7' | C8' | C9' | H8' | 180.0° | 179.9° |
| C7' | C8' | C9' | CA' | 0.3° | 0.1° |
| C7' | C8' | C9' | H9' | 179.7° | 180.0° |
| H7' | C7' | C8' | C9' | 180.0° | 179.9° |
| H7' | C7' | C8' | H8' | 0.0° | 0.1° |
| C8' | C9' | CA' | H9' | 180.0° | 179.9° |
| C8' | C9' | CA' | H10' | 179.6° | 180.0° |
| H8' | C8' | C9' | CA' | 179.7° | 180.0° |
| H8' | C8' | C9' | H9' | 0.3° | 0.1° |
| H9' | C9' | CA' | H10' | 0.4° | 0.0° |
| N1' | C2' | C3' | C4' | 0.2° | 0.4° |
| N1' | C2' | C3' | C2 | 179.8° | 179.8° |
| N1' | C2' | C3' | CB' | 179.9° | 180.0° |
| N1' | C2' | C2 | N3 | 85.0° | 85.1° |
| N1' | C2' | C2 | N1 | 95.0° | 95.0° |
| C4' | C3' | C2' | CB' | 179.7° | 179.6° |
| C4' | C3' | C2' | C2 | 179.6° | 179.8° |
| C4' | C3' | CB' | OC' | 107.8° | 5.4° |
| C4' | C3' | CB' | OD' | 72.5° | 174.6° |
| H4' | C4' | C3' | C2' | 179.8° | 179.7° |
| H4' | C4' | C3' | CB' | 0.1° | 0.2° |
| C2' | C3' | CB' | OC' | 71.9° | 175.0° |
| C2' | C3' | CB' | OD' | 107.9° | 5.0° |
| C3' | C2' | C2 | N3 | 94.8° | 95.1° |
| C3' | C2' | C2 | N1 | 85.1° | 84.8° |
| CB' | C3' | C2' | C2 | 0.1° | 0.2° |
| C3' | CB' | OC' | OD' | 179.8° | 180.0° |
| C3' | CB' | OC' | H12' | 180.0° | 180.0° |
| C2' | C2 | N3 | N1 | 179.9° | 179.9° |
| C2' | C2 | N3 | C4 | 180.0° | 179.9° |
| C2' | C2 | N1 | C5 | 179.7° | 179.9° |
| C2' | C2 | N1 | HN1 | 0.3° | 0.1° |
| OD' | CB' | OC' | H12' | 0.2° | 0.0° |
| N3 | C2 | N1 | C5 | 0.4° | 0.0° |
| N3 | C2 | N1 | HN1 | 179.6° | 180.0° |
| C2 | N3 | C4 | C5 | 0.2° | 0.1° |
| C2 | N3 | C4 | C8 | 128.1° | 118.6° |
| C2 | N3 | C4 | C7 | 123.6° | 118.8° |
| C4 | N3 | C2 | N1 | 0.1° | 0.0° |
| N3 | C4 | C5 | N1 | 0.4° | 0.1° |
| N3 | C4 | C5 | C8 | 122.3° | 118.7° |
| N3 | C4 | C5 | C7 | 120.9° | 118.7° |
| N3 | C4 | C5 | O6 | 179.7° | 180.0° |
| N3 | C4 | C8 | C7 | 113.8° | 122.7° |
| N3 | C4 | C8 | C10 | 65.3° | 68.4° |
| N3 | C4 | C8 | C9 | 174.6° | 171.6° |
| N3 | C4 | C8 | H8 | 55.1° | 51.6° |
| N3 | C4 | C7 | H71 | 54.7° | 62.6° |
| N3 | C4 | C7 | H72 | 180.0° | 57.4° |
| N3 | C4 | C7 | H73 | 54.7° | 177.3° |
| C2 | N1 | C5 | HN1 | 180.0° | 180.0° |
| C2 | N1 | C5 | C4 | 0.5° | 0.1° |
| C2 | N1 | C5 | O6 | 179.8° | 180.0° |
| N1 | C5 | C4 | O6 | 179.3° | 180.0° |
| N1 | C5 | C4 | C8 | 122.8° | 118.6° |
| N1 | C5 | C4 | C7 | 120.4° | 118.8° |
| HN1 | N1 | C5 | C4 | 179.5° | 179.9° |
| HN1 | N1 | C5 | O6 | 0.2° | 0.0° |
| C5 | C4 | C8 | C7 | 123.7° | 122.7° |
| C5 | C4 | C8 | C10 | 57.1° | 177.0° |
| C5 | C4 | C8 | C9 | 62.9° | 57.0° |
| C5 | C4 | C8 | H8 | 177.5° | 63.0° |
| C5 | C4 | C7 | H71 | 65.8° | 177.3° |
| C5 | C4 | C7 | H72 | 59.4° | 57.3° |
| C5 | C4 | C7 | H73 | 175.3° | 62.6° |
| O6 | C5 | C4 | C8 | 57.9° | 61.4° |
| O6 | C5 | C4 | C7 | 58.9° | 61.2° |
| C4 | C8 | C10 | C9 | 123.3° | 120.0° |
| C4 | C8 | C10 | H8 | 116.9° | 120.0° |
| C4 | C8 | C9 | H8 | 116.8° | 120.0° |
| C8 | C4 | C7 | H71 | 167.9° | 60.0° |
| C8 | C4 | C7 | H72 | 66.8° | 180.0° |
| C8 | C4 | C7 | H73 | 58.5° | 60.0° |
| C4 | C8 | C10 | H101 | 54.8° | 60.0° |
| C4 | C8 | C10 | H102 | 180.0° | 60.0° |
| C4 | C8 | C10 | H103 | 54.7° | 180.0° |
| C4 | C8 | C9 | H91 | 54.8° | 60.0° |
| C4 | C8 | C9 | H92 | 180.0° | 60.0° |
| C4 | C8 | C9 | H93 | 54.7° | 180.0° |
| C7 | C4 | C8 | C10 | 179.2° | 54.3° |
| C7 | C4 | C8 | C9 | 60.8° | 65.7° |
| C7 | C4 | C8 | H8 | 58.8° | 174.3° |
| C4 | C7 | H71 | H72 | 123.2° | 120.0° |
| C4 | C7 | H71 | H73 | 118.4° | 120.0° |
| C4 | C7 | H72 | H73 | 125.2° | 120.0° |
| C10 | C8 | C9 | H8 | 120.6° | 120.0° |
| C8 | C10 | H101 | H102 | 125.2° | 120.0° |
| C8 | C10 | H101 | H103 | 117.4° | 120.0° |
| C8 | C10 | H102 | H103 | 125.3° | 120.0° |
| C10 | C8 | C9 | H91 | 67.9° | 60.0° |
| C10 | C8 | C9 | H92 | 57.4° | 179.9° |
| C10 | C8 | C9 | H93 | 177.3° | 60.0° |
| C9 | C8 | C10 | H101 | 178.1° | 180.0° |
| C9 | C8 | C10 | H102 | 56.7° | 60.0° |
| C9 | C8 | C10 | H103 | 68.6° | 60.0° |
| C8 | C9 | H91 | H92 | 126.0° | 120.0° |
| C8 | C9 | H91 | H93 | 116.9° | 120.0° |
| C8 | C9 | H92 | H93 | 125.3° | 119.9° |
| H8 | C8 | C10 | H101 | 62.1° | 60.0° |
| H8 | C8 | C10 | H102 | 63.1° | 180.0° |
| H8 | C8 | C10 | H103 | 171.6° | 60.0° |
| H8 | C8 | C9 | H91 | 171.6° | 180.0° |
| H8 | C8 | C9 | H92 | 63.2° | 60.0° |
| H8 | C8 | C9 | H93 | 62.1° | 60.0° |
| H71 | C7 | H72 | H73 | 109.5° | 120.0° |
| H101 | C10 | H102 | H103 | 109.4° | 120.0° |
| H91 | C9 | H92 | H93 | 109.5° | 120.1° |
