NAQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| PA | O1A | doub | 1.48Å | 1.50Å | |
| PA | O2A | sing | 1.61Å | 1.55Å | |
| PA | O5' | sing | 1.61Å | 1.59Å | |
| PA | OPP | sing | 1.61Å | 1.56Å | |
| O2A | HOA2 | sing | 0.97Å | 0.95Å | |
| O5' | C5' | sing | 1.43Å | 1.50Å | |
| C5' | C4' | sing | 1.53Å | 1.48Å | |
| C5' | H5'1 | sing | 1.09Å | 1.11Å | |
| C5' | H5'2 | sing | 1.09Å | 1.12Å | |
| C4' | O4' | sing | 1.44Å | 1.48Å | |
| C4' | C3' | sing | 1.54Å | 1.57Å | |
| C4' | H4' | sing | 1.09Å | 1.12Å | |
| O4' | C1' | sing | 1.44Å | 1.34Å | |
| C3' | O3' | sing | 1.43Å | 1.48Å | |
| C3' | C2' | sing | 1.55Å | 1.50Å | |
| C3' | H3' | sing | 1.09Å | 1.11Å | |
| O3' | HO'3 | sing | 0.97Å | 0.95Å | |
| C2' | O2' | sing | 1.43Å | 1.39Å | |
| C2' | C1' | sing | 1.55Å | 1.59Å | |
| C2' | H2' | sing | 1.09Å | 1.11Å | |
| O2' | HO'2 | sing | 0.97Å | 0.95Å | |
| C1' | N9A | sing | 1.46Å | 1.42Å | |
| C1' | H1' | sing | 1.09Å | 1.12Å | |
| N9A | C8A | sing | 1.36Å | 1.39Å | Aromatic |
| N9A | C4A | sing | 1.37Å | 1.39Å | Aromatic |
| C8A | N7A | doub | 1.30Å | 1.32Å | Aromatic |
| C8A | H8A | sing | 1.08Å | 1.10Å | |
| N7A | C5A | sing | 1.36Å | 1.38Å | Aromatic |
| C5A | C6A | sing | 1.41Å | 1.50Å | Aromatic |
| C5A | C4A | doub | 1.41Å | 1.39Å | Aromatic |
| C6A | N6A | sing | 1.38Å | 1.30Å | |
| C6A | N1A | doub | 1.33Å | 1.41Å | Aromatic |
| N6A | H6A1 | sing | 0.97Å | 1.02Å | |
| N6A | H6A2 | sing | 0.97Å | 1.02Å | |
| N1A | C2A | sing | 1.32Å | 1.33Å | Aromatic |
| C2A | N3A | doub | 1.32Å | 1.41Å | Aromatic |
| C2A | H2A | sing | 1.08Å | 1.10Å | |
| N3A | C4A | sing | 1.33Å | 1.43Å | Aromatic |
| OPP | PN | sing | 1.61Å | 1.62Å | |
| PN | O1N | doub | 1.54Å | 1.46Å | |
| PN | O2N | sing | 1.55Å | 1.49Å | |
| PN | O5B | sing | 1.61Å | 1.59Å | |
| O5B | C5B | sing | 1.43Å | 1.46Å | |
| C5B | C4B | sing | 1.53Å | 1.50Å | |
| C5B | H5A1 | sing | 1.09Å | 1.11Å | |
| C5B | H5A2 | sing | 1.09Å | 1.11Å | |
| C4B | O4B | sing | 1.44Å | 1.50Å | |
| C4B | C3B | sing | 1.54Å | 1.58Å | |
| C4B | H4B | sing | 1.09Å | 1.12Å | |
| O4B | C1B | sing | 1.44Å | 1.41Å | |
| C3B | O3B | sing | 1.43Å | 1.37Å | |
| C3B | C2B | sing | 1.55Å | 1.54Å | |
| C3B | H3B | sing | 1.09Å | 1.11Å | |
| O3B | HOA3 | sing | 0.97Å | 0.95Å | |
| C2B | O2B | sing | 1.43Å | 1.38Å | |
| C2B | C1B | sing | 1.54Å | 1.50Å | |
| C2B | H2B | sing | 1.09Å | 1.12Å | |
| O2B | HOB2 | sing | 0.97Å | 0.95Å | |
| C1B | N1N | sing | 1.46Å | 1.49Å | |
| C1B | H1B | sing | 1.09Å | 1.11Å | |
| N1N | C2N | sing | 1.32Å | 1.41Å | Aromatic |
| N1N | C6N | doub | 1.32Å | 1.35Å | Aromatic |
| C2N | C3N | doub | 1.40Å | 1.35Å | Aromatic |
| C2N | H2N | sing | 1.08Å | 1.10Å | |
| C3N | C7N | sing | 1.48Å | 1.61Å | |
| C3N | C4N | sing | 1.40Å | 1.43Å | Aromatic |
| C7N | O7N | doub | 1.22Å | 1.26Å | |
| C7N | N7N | sing | 1.35Å | 1.37Å | |
| N7N | H7N1 | sing | 0.97Å | 1.02Å | |
| N7N | H7N2 | sing | 0.97Å | 1.02Å | |
| C4N | C5N | doub | 1.38Å | 1.45Å | Aromatic |
| C4N | C4P | sing | 1.51Å | 3.61Å | |
| C5N | C6N | sing | 1.38Å | 1.38Å | Aromatic |
| C5N | H5N | sing | 1.08Å | 1.10Å | |
| C6N | H6N | sing | 1.08Å | 1.10Å | |
| C5P | C4P | sing | 1.53Å | 1.53Å | |
| C5P | H5P1 | sing | 1.09Å | 1.11Å | |
| C5P | H5P2 | sing | 1.09Å | 1.11Å | |
| C5P | H5P3 | sing | 1.09Å | 1.12Å | |
| C4P | C3P | sing | 1.51Å | 1.52Å | |
| C4P | H4P | sing | 1.09Å | 1.12Å | |
| C3P | OP | doub | 1.21Å | 1.35Å | |
| C3P | C2P | sing | 1.51Å | 1.54Å | |
| C2P | C1P | sing | 1.53Å | 1.54Å | |
| C2P | H2P1 | sing | 1.09Å | 1.11Å | |
| C2P | H2P2 | sing | 1.09Å | 1.12Å | |
| C1P | H1P1 | sing | 1.09Å | 1.11Å | |
| C1P | H1P2 | sing | 1.09Å | 1.12Å | |
| C1P | H1P3 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1A | PA | O2A | 116.7° | 109.5° |
| O1A | PA | O5' | 110.2° | 109.5° |
| O1A | PA | OPP | 110.3° | 109.5° |
| O2A | PA | O5' | 107.1° | 109.5° |
| O2A | PA | OPP | 111.2° | 109.4° |
| PA | O2A | HOA2 | 116.7° | 106.8° |
| O5' | PA | OPP | 100.0° | 109.5° |
| PA | O5' | C5' | 119.4° | 106.8° |
| PA | OPP | PN | 137.1° | 106.8° |
| O5' | C5' | C4' | 104.7° | 109.5° |
| O5' | C5' | H5'1 | 114.0° | 109.4° |
| O5' | C5' | H5'2 | 114.0° | 109.5° |
| C4' | C5' | H5'1 | 114.0° | 109.5° |
| C4' | C5' | H5'2 | 114.1° | 109.5° |
| C5' | C4' | O4' | 105.4° | 109.9° |
| C5' | C4' | C3' | 112.6° | 109.9° |
| C5' | C4' | H4' | 108.7° | 109.9° |
| H5'1 | C5' | H5'2 | 96.5° | 109.5° |
| O4' | C4' | C3' | 104.7° | 107.5° |
| O4' | C4' | H4' | 116.2° | 109.9° |
| C4' | O4' | C1' | 106.9° | 107.0° |
| C3' | C4' | H4' | 109.4° | 109.8° |
| C4' | C3' | O3' | 106.7° | 110.8° |
| C4' | C3' | C2' | 105.1° | 104.0° |
| C4' | C3' | H3' | 114.2° | 110.5° |
| O4' | C1' | C2' | 111.7° | 103.5° |
| O4' | C1' | N9A | 112.7° | 110.6° |
| O4' | C1' | H1' | 105.6° | 110.6° |
| O3' | C3' | C2' | 110.3° | 110.5° |
| O3' | C3' | H3' | 109.5° | 110.4° |
| C3' | O3' | HO'3 | 106.7° | 106.9° |
| C2' | C3' | H3' | 110.9° | 110.4° |
| C3' | C2' | O2' | 117.6° | 110.9° |
| C3' | C2' | C1' | 94.9° | 102.1° |
| C3' | C2' | H2' | 116.0° | 111.0° |
| O2' | C2' | C1' | 115.1° | 110.9° |
| O2' | C2' | H2' | 96.3° | 110.8° |
| C2' | O2' | HO'2 | 117.6° | 106.8° |
| C1' | C2' | H2' | 118.5° | 110.9° |
| C2' | C1' | N9A | 109.2° | 110.8° |
| C2' | C1' | H1' | 109.3° | 110.6° |
| N9A | C1' | H1' | 108.3° | 110.5° |
| C1' | N9A | C8A | 130.6° | 126.3° |
| C1' | N9A | C4A | 126.2° | 126.3° |
| C8A | N9A | C4A | 103.0° | 107.4° |
| N9A | C8A | N7A | 113.6° | 110.0° |
| N9A | C8A | H8A | 125.6° | 125.0° |
| N9A | C4A | C5A | 109.0° | 106.0° |
| N9A | C4A | N3A | 127.6° | 134.9° |
| N7A | C8A | H8A | 120.8° | 125.0° |
| C8A | N7A | C5A | 106.6° | 109.5° |
| N7A | C5A | C6A | 131.7° | 134.7° |
| N7A | C5A | C4A | 107.8° | 107.1° |
| C6A | C5A | C4A | 120.5° | 118.2° |
| C5A | C6A | N6A | 125.6° | 120.8° |
| C5A | C6A | N1A | 113.0° | 118.4° |
| C5A | C4A | N3A | 123.4° | 119.1° |
| N6A | C6A | N1A | 121.4° | 120.8° |
| C6A | N6A | H6A1 | 125.6° | 120.0° |
| C6A | N6A | H6A2 | 106.5° | 119.9° |
| C6A | N1A | C2A | 124.5° | 121.2° |
| H6A1 | N6A | H6A2 | 106.6° | 120.1° |
| N1A | C2A | N3A | 125.0° | 122.4° |
| N1A | C2A | H2A | 114.3° | 118.8° |
| N3A | C2A | H2A | 120.7° | 118.8° |
| C2A | N3A | C4A | 113.6° | 120.7° |
| OPP | PN | O1N | 108.1° | 109.5° |
| OPP | PN | O2N | 107.6° | 109.5° |
| OPP | PN | O5B | 102.6° | 109.5° |
| O1N | PN | O2N | 121.9° | 109.5° |
| O1N | PN | O5B | 105.8° | 109.5° |
| O2N | PN | O5B | 109.2° | 109.5° |
| PN | O5B | C5B | 124.3° | 106.8° |
| O5B | C5B | C4B | 112.0° | 109.5° |
| O5B | C5B | H5A1 | 111.3° | 109.5° |
| O5B | C5B | H5A2 | 111.2° | 109.5° |
| C4B | C5B | H5A1 | 111.3° | 109.4° |
| C4B | C5B | H5A2 | 111.3° | 109.4° |
| C5B | C4B | O4B | 106.3° | 110.4° |
| C5B | C4B | C3B | 114.2° | 110.5° |
| C5B | C4B | H4B | 106.4° | 110.3° |
| H5A1 | C5B | H5A2 | 99.1° | 109.5° |
| O4B | C4B | C3B | 101.8° | 104.8° |
| O4B | C4B | H4B | 117.9° | 110.4° |
| C4B | O4B | C1B | 110.5° | 105.3° |
| C3B | C4B | H4B | 110.6° | 110.4° |
| C4B | C3B | O3B | 109.5° | 110.5° |
| C4B | C3B | C2B | 104.1° | 104.0° |
| C4B | C3B | H3B | 112.9° | 110.5° |
| O4B | C1B | C2B | 106.0° | 104.9° |
| O4B | C1B | N1N | 107.9° | 110.4° |
| O4B | C1B | H1B | 116.6° | 110.4° |
| O3B | C3B | C2B | 109.5° | 110.5° |
| O3B | C3B | H3B | 107.9° | 110.5° |
| C3B | O3B | HOA3 | 109.5° | 106.8° |
| C2B | C3B | H3B | 112.9° | 110.6° |
| C3B | C2B | O2B | 109.3° | 110.5° |
| C3B | C2B | C1B | 100.3° | 104.0° |
| C3B | C2B | H2B | 117.5° | 110.5° |
| O2B | C2B | C1B | 115.1° | 110.8° |
| O2B | C2B | H2B | 103.3° | 110.4° |
| C2B | O2B | HOB2 | 109.3° | 106.8° |
| C1B | C2B | H2B | 111.8° | 110.4° |
| C2B | C1B | N1N | 118.8° | 110.4° |
| C2B | C1B | H1B | 105.1° | 110.3° |
| N1N | C1B | H1B | 103.1° | 110.3° |
| C1B | N1N | C2N | 122.7° | 119.1° |
| C1B | N1N | C6N | 114.3° | 119.0° |
| C2N | N1N | C6N | 122.3° | 121.9° |
| N1N | C2N | C3N | 115.0° | 120.6° |
| N1N | C2N | H2N | 124.3° | 119.7° |
| N1N | C6N | C5N | 120.6° | 121.1° |
| N1N | C6N | H6N | 118.8° | 119.5° |
| C3N | C2N | H2N | 120.6° | 119.7° |
| C2N | C3N | C7N | 113.4° | 120.6° |
| C2N | C3N | C4N | 128.3° | 118.9° |
| C7N | C3N | C4N | 118.2° | 120.5° |
| C3N | C7N | O7N | 113.4° | 120.1° |
| C3N | C7N | N7N | 121.6° | 120.0° |
| C3N | C4N | C5N | 111.2° | 118.3° |
| C3N | C4N | C4P | 70.9° | 120.9° |
| O7N | C7N | N7N | 125.0° | 119.9° |
| C7N | N7N | H7N1 | 125.0° | 120.0° |
| C7N | N7N | H7N2 | 121.5° | 120.0° |
| H7N1 | N7N | H7N2 | 113.4° | 120.0° |
| C5N | C4N | C4P | 112.1° | 120.8° |
| C4N | C5N | C6N | 122.2° | 119.3° |
| C4N | C5N | H5N | 121.4° | 120.4° |
| C4N | C4P | C5P | 128.5° | 109.5° |
| C4N | C4P | C3P | 36.3° | 109.5° |
| C4N | C4P | H4P | 135.7° | 109.4° |
| C6N | C5N | H5N | 116.4° | 120.3° |
| C5N | C6N | H6N | 120.6° | 119.5° |
| C4P | C5P | H5P1 | 128.5° | 109.5° |
| C4P | C5P | H5P2 | 105.6° | 109.4° |
| C4P | C5P | H5P3 | 105.6° | 109.5° |
| C5P | C4P | C3P | 108.5° | 109.5° |
| C5P | C4P | H4P | 92.1° | 109.5° |
| H5P1 | C5P | H5P2 | 105.6° | 109.5° |
| H5P1 | C5P | H5P3 | 105.5° | 109.5° |
| H5P2 | C5P | H5P3 | 103.7° | 109.5° |
| C3P | C4P | H4P | 154.2° | 109.5° |
| C4P | C3P | OP | 121.7° | 120.0° |
| C4P | C3P | C2P | 120.8° | 120.0° |
| OP | C3P | C2P | 117.2° | 120.0° |
| C3P | C2P | C1P | 114.3° | 109.5° |
| C3P | C2P | H2P1 | 110.5° | 109.5° |
| C3P | C2P | H2P2 | 110.5° | 109.5° |
| C1P | C2P | H2P1 | 110.4° | 109.4° |
| C1P | C2P | H2P2 | 110.4° | 109.5° |
| C2P | C1P | H1P1 | 114.3° | 109.5° |
| C2P | C1P | H1P2 | 110.4° | 109.5° |
| C2P | C1P | H1P3 | 110.4° | 109.4° |
| H2P1 | C2P | H2P2 | 99.8° | 109.5° |
| H1P1 | C1P | H1P2 | 110.5° | 109.5° |
| H1P1 | C1P | H1P3 | 110.5° | 109.5° |
| H1P2 | C1P | H1P3 | 99.9° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1A | PA | O2A | O5' | 124.0° | 120.0° |
| O1A | PA | O2A | OPP | 127.7° | 120.0° |
| O1A | PA | O5' | OPP | 116.1° | 120.0° |
| O1A | PA | O2A | HOA2 | 180.0° | 180.0° |
| O1A | PA | O5' | C5' | 30.3° | 55.0° |
| O1A | PA | OPP | PN | 179.2° | 40.0° |
| O2A | PA | O5' | OPP | 116.0° | 120.0° |
| O2A | PA | O5' | C5' | 158.2° | 65.0° |
| O2A | PA | OPP | PN | 48.1° | 80.0° |
| O5' | PA | O2A | HOA2 | 56.1° | 60.0° |
| PA | O5' | C5' | C4' | 173.6° | 180.0° |
| PA | O5' | C5' | H5'1 | 61.2° | 60.0° |
| PA | O5' | C5' | H5'2 | 48.3° | 60.0° |
| O5' | PA | OPP | PN | 64.7° | 160.0° |
| OPP | PA | O2A | HOA2 | 52.3° | 60.0° |
| OPP | PA | O5' | C5' | 85.8° | 175.0° |
| PA | OPP | PN | O1N | 129.4° | 80.0° |
| PA | OPP | PN | O2N | 3.9° | 40.0° |
| PA | OPP | PN | O5B | 119.1° | 160.0° |
| O5' | C5' | C4' | H5'1 | 125.2° | 119.9° |
| O5' | C5' | C4' | H5'2 | 125.3° | 120.0° |
| O5' | C5' | H5'1 | H5'2 | 119.9° | 120.0° |
| O5' | C5' | C4' | O4' | 175.5° | 66.7° |
| O5' | C5' | C4' | C3' | 70.9° | 175.3° |
| O5' | C5' | C4' | H4' | 50.4° | 54.3° |
| C4' | C5' | H5'1 | H5'2 | 120.0° | 120.1° |
| C5' | C4' | O4' | C3' | 119.0° | 119.5° |
| C5' | C4' | O4' | H4' | 120.3° | 121.0° |
| C5' | C4' | C3' | H4' | 120.9° | 121.0° |
| C5' | C4' | O4' | C1' | 118.5° | 145.9° |
| C5' | C4' | C3' | O3' | 155.3° | 119.8° |
| C5' | C4' | C3' | C2' | 87.6° | 121.4° |
| C5' | C4' | C3' | H3' | 34.2° | 2.9° |
| H5'1 | C5' | C4' | O4' | 50.3° | 53.3° |
| H5'1 | C5' | C4' | C3' | 163.8° | 64.8° |
| H5'1 | C5' | C4' | H4' | 74.8° | 174.3° |
| H5'2 | C5' | C4' | O4' | 59.2° | 173.3° |
| H5'2 | C5' | C4' | C3' | 54.3° | 55.3° |
| H5'2 | C5' | C4' | H4' | 175.6° | 65.7° |
| O4' | C4' | C3' | H4' | 125.1° | 119.5° |
| O4' | C4' | C3' | O3' | 90.7° | 120.6° |
| O4' | C4' | C3' | C2' | 26.4° | 1.9° |
| O4' | C4' | C3' | H3' | 148.2° | 116.6° |
| C4' | O4' | C1' | C2' | 25.1° | 40.0° |
| C4' | O4' | C1' | N9A | 148.4° | 158.7° |
| C4' | O4' | C1' | H1' | 93.6° | 78.5° |
| C3' | C4' | O4' | C1' | 0.5° | 26.4° |
| C4' | C3' | O3' | C2' | 113.7° | 114.8° |
| C4' | C3' | O3' | H3' | 124.1° | 122.8° |
| C4' | C3' | C2' | H3' | 123.9° | 118.6° |
| C4' | C3' | O3' | HO'3 | 180.0° | 176.2° |
| C4' | C3' | C2' | O2' | 158.1° | 139.2° |
| C4' | C3' | C2' | C1' | 36.3° | 21.0° |
| C4' | C3' | C2' | H2' | 88.8° | 97.2° |
| H4' | C4' | O4' | C1' | 121.2° | 93.1° |
| H4' | C4' | C3' | O3' | 34.4° | 1.1° |
| H4' | C4' | C3' | C2' | 151.5° | 117.6° |
| H4' | C4' | C3' | H3' | 86.7° | 123.9° |
| O4' | C1' | C2' | C3' | 39.9° | 37.1° |
| O4' | C1' | C2' | O2' | 163.6° | 155.3° |
| O4' | C1' | C2' | N9A | 125.3° | 118.6° |
| O4' | C1' | C2' | H1' | 116.4° | 118.5° |
| O4' | C1' | C2' | H2' | 83.3° | 81.2° |
| O4' | C1' | N9A | H1' | 116.4° | 122.8° |
| O4' | C1' | N9A | C8A | 58.8° | 23.6° |
| O4' | C1' | N9A | C4A | 126.9° | 156.7° |
| O3' | C3' | C2' | H3' | 121.4° | 122.5° |
| O3' | C3' | C2' | O2' | 43.4° | 20.2° |
| O3' | C3' | C2' | C1' | 78.4° | 98.0° |
| O3' | C3' | C2' | H2' | 156.5° | 143.8° |
| C2' | C3' | O3' | HO'3 | 66.3° | 61.4° |
| C3' | C2' | O2' | C1' | 110.7° | 112.7° |
| C3' | C2' | O2' | H2' | 123.7° | 123.7° |
| C3' | C2' | C1' | H2' | 123.2° | 118.3° |
| C3' | C2' | O2' | HO'2 | 180.0° | 67.3° |
| C3' | C2' | C1' | N9A | 165.2° | 155.7° |
| C3' | C2' | C1' | H1' | 76.5° | 81.4° |
| H3' | C3' | O3' | HO'3 | 55.9° | 61.0° |
| H3' | C3' | C2' | O2' | 78.0° | 102.2° |
| H3' | C3' | C2' | C1' | 160.2° | 139.6° |
| H3' | C3' | C2' | H2' | 35.1° | 21.4° |
| O2' | C2' | C1' | H2' | 113.1° | 123.5° |
| O2' | C2' | C1' | N9A | 71.1° | 86.1° |
| O2' | C2' | C1' | H1' | 47.2° | 36.8° |
| C1' | C2' | O2' | HO'2 | 69.4° | 180.0° |
| C2' | C1' | N9A | H1' | 118.9° | 123.0° |
| C2' | C1' | N9A | C8A | 65.9° | 90.6° |
| C2' | C1' | N9A | C4A | 108.4° | 89.1° |
| H2' | C2' | O2' | HO'2 | 56.2° | 56.5° |
| H2' | C2' | C1' | N9A | 42.0° | 37.4° |
| H2' | C2' | C1' | H1' | 160.3° | 160.3° |
| C1' | N9A | C8A | C4A | 175.2° | 179.7° |
| C1' | N9A | C8A | N7A | 176.3° | 179.9° |
| C1' | N9A | C8A | H8A | 3.8° | 0.0° |
| C1' | N9A | C4A | C5A | 176.7° | 179.9° |
| C1' | N9A | C4A | N3A | 2.9° | 0.8° |
| H1' | C1' | N9A | C8A | 175.2° | 146.5° |
| H1' | C1' | N9A | C4A | 10.5° | 33.9° |
| N9A | C8A | N7A | H8A | 180.0° | 179.9° |
| N9A | C8A | N7A | C5A | 0.4° | 0.0° |
| C8A | N9A | C4A | C5A | 1.2° | 0.4° |
| C8A | N9A | C4A | N3A | 178.4° | 179.5° |
| C4A | N9A | C8A | N7A | 1.0° | 0.2° |
| C4A | N9A | C8A | H8A | 179.0° | 179.7° |
| N9A | C4A | C5A | N7A | 1.0° | 0.4° |
| N9A | C4A | C5A | C6A | 179.2° | 179.8° |
| N9A | C4A | C5A | N3A | 179.7° | 179.3° |
| N9A | C4A | N3A | C2A | 178.7° | 179.5° |
| C8A | N7A | C5A | C6A | 179.9° | 180.0° |
| C8A | N7A | C5A | C4A | 0.4° | 0.3° |
| H8A | C8A | N7A | C5A | 179.6° | 180.0° |
| N7A | C5A | C6A | C4A | 179.7° | 179.7° |
| N7A | C5A | C6A | N6A | 0.5° | 0.0° |
| N7A | C5A | C6A | N1A | 179.6° | 180.0° |
| N7A | C5A | C4A | N3A | 178.6° | 179.7° |
| C5A | C6A | N6A | N1A | 179.1° | 179.9° |
| C5A | C6A | N6A | H6A1 | 180.0° | 0.0° |
| C5A | C6A | N6A | H6A2 | 54.7° | 180.0° |
| C5A | C6A | N1A | C2A | 0.2° | 0.0° |
| C6A | C5A | C4A | N3A | 1.1° | 0.5° |
| C4A | C5A | C6A | N6A | 179.2° | 179.7° |
| C4A | C5A | C6A | N1A | 0.1° | 0.2° |
| C5A | C4A | N3A | C2A | 1.7° | 0.5° |
| C6A | N6A | H6A1 | H6A2 | 125.3° | 180.0° |
| N6A | C6A | N1A | C2A | 178.9° | 180.0° |
| N1A | C6A | N6A | H6A1 | 1.0° | 180.0° |
| N1A | C6A | N6A | H6A2 | 124.4° | 0.1° |
| C6A | N1A | C2A | N3A | 0.5° | 0.1° |
| C6A | N1A | C2A | H2A | 179.6° | 180.0° |
| N1A | C2A | N3A | H2A | 180.0° | 180.0° |
| N1A | C2A | N3A | C4A | 1.4° | 0.2° |
| H2A | C2A | N3A | C4A | 178.7° | 179.8° |
| OPP | PN | O1N | O2N | 125.3° | 120.0° |
| OPP | PN | O1N | O5B | 109.3° | 120.0° |
| OPP | PN | O2N | O5B | 110.6° | 120.0° |
| OPP | PN | O5B | C5B | 110.8° | 175.0° |
| O1N | PN | O2N | O5B | 123.9° | 120.0° |
| O1N | PN | O5B | C5B | 136.0° | 65.0° |
| O2N | PN | O5B | C5B | 3.1° | 55.0° |
| PN | O5B | C5B | C4B | 161.8° | 180.0° |
| PN | O5B | C5B | H5A1 | 73.0° | 60.1° |
| PN | O5B | C5B | H5A2 | 36.5° | 60.0° |
| O5B | C5B | C4B | H5A1 | 125.3° | 120.0° |
| O5B | C5B | C4B | H5A2 | 125.2° | 120.0° |
| O5B | C5B | H5A1 | H5A2 | 117.1° | 120.0° |
| O5B | C5B | C4B | O4B | 54.2° | 66.5° |
| O5B | C5B | C4B | C3B | 57.1° | 178.1° |
| O5B | C5B | C4B | H4B | 179.4° | 55.8° |
| C4B | C5B | H5A1 | H5A2 | 117.2° | 120.0° |
| C5B | C4B | O4B | C3B | 119.8° | 118.9° |
| C5B | C4B | O4B | H4B | 119.1° | 122.2° |
| C5B | C4B | C3B | H4B | 119.9° | 122.3° |
| C5B | C4B | O4B | C1B | 125.2° | 159.5° |
| C5B | C4B | C3B | O3B | 149.2° | 98.4° |
| C5B | C4B | C3B | C2B | 93.8° | 143.0° |
| C5B | C4B | C3B | H3B | 29.0° | 24.3° |
| H5A1 | C5B | C4B | O4B | 179.5° | 173.5° |
| H5A1 | C5B | C4B | C3B | 68.1° | 58.1° |
| H5A1 | C5B | C4B | H4B | 54.1° | 64.2° |
| H5A2 | C5B | C4B | O4B | 71.0° | 53.5° |
| H5A2 | C5B | C4B | C3B | 177.6° | 61.9° |
| H5A2 | C5B | C4B | H4B | 55.4° | 175.8° |
| O4B | C4B | C3B | H4B | 126.1° | 118.9° |
| O4B | C4B | C3B | O3B | 96.7° | 142.7° |
| O4B | C4B | C3B | C2B | 20.2° | 24.1° |
| O4B | C4B | C3B | H3B | 143.0° | 94.6° |
| C4B | O4B | C1B | C2B | 30.2° | 40.4° |
| C4B | O4B | C1B | N1N | 158.4° | 159.4° |
| C4B | O4B | C1B | H1B | 86.3° | 78.4° |
| C3B | C4B | O4B | C1B | 5.5° | 40.5° |
| C4B | C3B | O3B | C2B | 113.6° | 114.6° |
| C4B | C3B | O3B | H3B | 123.2° | 122.7° |
| C4B | C3B | C2B | H3B | 122.8° | 118.7° |
| C4B | C3B | O3B | HOA3 | 179.9° | 180.0° |
| C4B | C3B | C2B | O2B | 158.4° | 118.8° |
| C4B | C3B | C2B | C1B | 37.0° | 0.1° |
| C4B | C3B | C2B | H2B | 84.4° | 118.7° |
| H4B | C4B | O4B | C1B | 115.7° | 78.3° |
| H4B | C4B | C3B | O3B | 29.3° | 23.9° |
| H4B | C4B | C3B | C2B | 146.3° | 94.8° |
| H4B | C4B | C3B | H3B | 90.9° | 146.5° |
| O4B | C1B | C2B | C3B | 41.4° | 23.8° |
| O4B | C1B | C2B | O2B | 158.6° | 142.6° |
| O4B | C1B | C2B | N1N | 121.4° | 118.9° |
| O4B | C1B | C2B | H1B | 124.0° | 118.8° |
| O4B | C1B | C2B | H2B | 83.9° | 94.8° |
| O4B | C1B | N1N | H1B | 123.9° | 122.3° |
| O4B | C1B | N1N | C2N | 61.5° | 143.0° |
| O4B | C1B | N1N | C6N | 109.1° | 37.1° |
| O3B | C3B | C2B | H3B | 120.2° | 122.7° |
| O3B | C3B | C2B | O2B | 41.4° | 0.1° |
| O3B | C3B | C2B | C1B | 80.0° | 118.8° |
| O3B | C3B | C2B | H2B | 158.6° | 122.7° |
| C2B | C3B | O3B | HOA3 | 66.4° | 65.3° |
| C3B | C2B | O2B | C1B | 111.9° | 114.7° |
| C3B | C2B | O2B | H2B | 125.9° | 122.6° |
| C3B | C2B | C1B | H2B | 125.4° | 118.6° |
| C3B | C2B | O2B | HOB2 | 180.0° | 61.5° |
| C3B | C2B | C1B | N1N | 162.9° | 142.8° |
| C3B | C2B | C1B | H1B | 82.6° | 95.0° |
| H3B | C3B | O3B | HOA3 | 56.8° | 57.4° |
| H3B | C3B | C2B | O2B | 78.8° | 122.5° |
| H3B | C3B | C2B | C1B | 159.8° | 118.6° |
| H3B | C3B | C2B | H2B | 38.4° | 0.0° |
| O2B | C2B | C1B | H2B | 117.5° | 122.7° |
| O2B | C2B | C1B | N1N | 80.0° | 98.5° |
| O2B | C2B | C1B | H1B | 34.6° | 23.7° |
| C1B | C2B | O2B | HOB2 | 68.1° | 176.2° |
| C2B | C1B | N1N | H1B | 115.7° | 122.2° |
| C2B | C1B | N1N | C2N | 59.0° | 101.5° |
| C2B | C1B | N1N | C6N | 130.4° | 78.4° |
| H2B | C2B | O2B | HOB2 | 54.1° | 61.1° |
| H2B | C2B | C1B | N1N | 37.5° | 24.2° |
| H2B | C2B | C1B | H1B | 152.0° | 146.4° |
| C1B | N1N | C2N | C6N | 169.9° | 180.0° |
| C1B | N1N | C2N | C3N | 173.6° | 179.7° |
| C1B | N1N | C2N | H2N | 6.4° | 0.0° |
| C1B | N1N | C6N | C5N | 175.1° | 180.0° |
| C1B | N1N | C6N | H6N | 4.9° | 0.0° |
| H1B | C1B | N1N | C2N | 174.6° | 20.7° |
| H1B | C1B | N1N | C6N | 14.8° | 159.3° |
| N1N | C2N | C3N | H2N | 180.0° | 179.7° |
| N1N | C2N | C3N | C7N | 175.3° | 180.0° |
| N1N | C2N | C3N | C4N | 2.3° | 0.6° |
| C2N | N1N | C6N | C5N | 4.5° | 0.1° |
| C2N | N1N | C6N | H6N | 175.5° | 180.0° |
| C6N | N1N | C2N | C3N | 3.7° | 0.3° |
| C6N | N1N | C2N | H2N | 176.3° | 180.0° |
| N1N | C6N | C5N | C4N | 0.6° | 0.1° |
| N1N | C6N | C5N | H6N | 180.0° | 179.9° |
| N1N | C6N | C5N | H5N | 179.4° | 179.9° |
| C2N | C3N | C7N | C4N | 177.8° | 179.4° |
| C2N | C3N | C7N | O7N | 170.8° | 173.6° |
| C2N | C3N | C7N | N7N | 8.9° | 6.4° |
| C2N | C3N | C4N | C5N | 6.5° | 0.6° |
| C2N | C3N | C4N | C4P | 100.5° | 179.8° |
| H2N | C2N | C3N | C7N | 4.7° | 0.3° |
| H2N | C2N | C3N | C4N | 177.8° | 179.7° |
| C3N | C7N | O7N | N7N | 179.7° | 180.0° |
| C3N | C7N | N7N | H7N1 | 0.3° | 0.1° |
| C3N | C7N | N7N | H7N2 | 180.0° | 180.0° |
| C7N | C3N | C4N | C5N | 170.9° | 180.0° |
| C7N | C3N | C4N | C4P | 82.1° | 0.4° |
| C4N | C3N | C7N | O7N | 11.4° | 7.0° |
| C4N | C3N | C7N | N7N | 168.9° | 173.0° |
| C3N | C4N | C5N | C4P | 77.2° | 179.7° |
| C3N | C4N | C5N | C6N | 5.5° | 0.3° |
| C3N | C4N | C5N | H5N | 174.5° | 179.8° |
| C3N | C4N | C4P | C5P | 149.5° | 144.5° |
| C3N | C4N | C4P | C3P | 143.8° | 95.5° |
| C3N | C4N | C4P | H4P | 2.3° | 24.6° |
| O7N | C7N | N7N | H7N1 | 180.0° | 180.0° |
| O7N | C7N | N7N | H7N2 | 0.3° | 0.0° |
| C7N | N7N | H7N1 | H7N2 | 179.8° | 180.0° |
| C4N | C5N | C6N | H5N | 180.0° | 179.9° |
| C4N | C5N | C6N | H6N | 179.4° | 180.0° |
| C5N | C4N | C4P | C5P | 104.7° | 35.9° |
| C5N | C4N | C4P | C3P | 38.0° | 84.2° |
| C5N | C4N | C4P | H4P | 103.5° | 155.8° |
| C4P | C4N | C5N | C6N | 71.7° | 180.0° |
| C4P | C4N | C5N | H5N | 108.3° | 0.2° |
| C4N | C4P | C5P | C3P | 35.0° | 120.1° |
| C4N | C4P | C5P | H4P | 160.7° | 119.9° |
| C4N | C4P | C5P | H5P1 | 180.0° | 59.9° |
| C4N | C4P | C5P | H5P2 | 54.7° | 180.0° |
| C4N | C4P | C5P | H5P3 | 54.7° | 60.1° |
| C4N | C4P | C3P | H4P | 87.9° | 120.0° |
| C4N | C4P | C3P | OP | 145.0° | 30.0° |
| C4N | C4P | C3P | C2P | 41.3° | 150.0° |
| H5N | C5N | C6N | H6N | 0.6° | 0.1° |
| C4P | C5P | H5P1 | H5P2 | 125.3° | 120.0° |
| C4P | C5P | H5P1 | H5P3 | 125.3° | 120.0° |
| C4P | C5P | H5P2 | H5P3 | 110.8° | 120.0° |
| C5P | C4P | C3P | H4P | 141.4° | 120.0° |
| C5P | C4P | C3P | OP | 84.3° | 90.0° |
| C5P | C4P | C3P | C2P | 89.4° | 90.0° |
| H5P1 | C5P | H5P2 | H5P3 | 110.7° | 120.0° |
| H5P1 | C5P | C4P | C3P | 145.0° | 180.0° |
| H5P1 | C5P | C4P | H4P | 19.2° | 60.0° |
| H5P2 | C5P | C4P | C3P | 19.7° | 60.0° |
| H5P2 | C5P | C4P | H4P | 144.6° | 60.0° |
| H5P3 | C5P | C4P | C3P | 89.7° | 60.0° |
| H5P3 | C5P | C4P | H4P | 106.0° | 180.0° |
| C4P | C3P | OP | C2P | 173.9° | 180.0° |
| C4P | C3P | C2P | C1P | 124.1° | 180.0° |
| C4P | C3P | C2P | H2P1 | 110.7° | 60.1° |
| C4P | C3P | C2P | H2P2 | 1.1° | 60.0° |
| H4P | C4P | C3P | OP | 57.1° | 150.0° |
| H4P | C4P | C3P | C2P | 129.2° | 30.0° |
| OP | C3P | C2P | C1P | 49.9° | 0.0° |
| OP | C3P | C2P | H2P1 | 75.4° | 119.9° |
| OP | C3P | C2P | H2P2 | 175.1° | 120.0° |
| C3P | C2P | C1P | H2P1 | 125.3° | 120.0° |
| C3P | C2P | C1P | H2P2 | 125.3° | 120.0° |
| C3P | C2P | H2P1 | H2P2 | 116.3° | 120.1° |
| C3P | C2P | C1P | H1P1 | 180.0° | 180.0° |
| C3P | C2P | C1P | H1P2 | 54.8° | 60.0° |
| C3P | C2P | C1P | H1P3 | 54.7° | 60.0° |
| C1P | C2P | H2P1 | H2P2 | 116.2° | 120.0° |
| C2P | C1P | H1P1 | H1P2 | 125.2° | 120.0° |
| C2P | C1P | H1P1 | H1P3 | 125.2° | 119.9° |
| C2P | C1P | H1P2 | H1P3 | 116.3° | 119.9° |
| H2P1 | C2P | C1P | H1P1 | 54.7° | 60.0° |
| H2P1 | C2P | C1P | H1P2 | 179.9° | 60.0° |
| H2P1 | C2P | C1P | H1P3 | 70.6° | 180.0° |
| H2P2 | C2P | C1P | H1P1 | 54.7° | 60.0° |
| H2P2 | C2P | C1P | H1P2 | 70.5° | 180.0° |
| H2P2 | C2P | C1P | H1P3 | 180.0° | 60.0° |
| H1P1 | C1P | H1P2 | H1P3 | 116.4° | 120.1° |
