GVD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAL | CAM | sing | 1.50Å | 1.54Å | |
| CAL | CBB | sing | 1.51Å | 1.53Å | |
| CAM | CBB | sing | 1.51Å | 1.54Å | |
| CBB | CAX | sing | 1.52Å | 1.55Å | |
| CAX | CAK | doub | 1.37Å | 1.35Å | |
| CAX | NAS | sing | 1.36Å | 1.34Å | |
| NAS | NAN | sing | 1.34Å | 1.23Å | |
| CAK | CAV | sing | 1.38Å | 1.34Å | |
| NAN | CAV | doub | 1.31Å | 1.33Å | |
| CAV | NAR | sing | 1.40Å | 1.36Å | |
| NAR | C6 | sing | 1.42Å | 1.35Å | |
| C6 | N1 | doub | 1.35Å | 1.34Å | |
| C6 | C5 | sing | 1.39Å | 1.41Å | |
| C5 | CAJ | doub | 1.41Å | 1.39Å | |
| CAJ | CAD | sing | 1.39Å | 1.40Å | |
| CAD | CAC | doub | 1.39Å | 1.39Å | |
| CAC | CAI | sing | 1.40Å | 1.39Å | |
| C5 | C4 | sing | 1.40Å | 1.40Å | |
| CAI | C4 | doub | 1.39Å | 1.40Å | |
| C4 | N3 | sing | 1.34Å | 1.35Å | |
| N1 | C2 | sing | 1.34Å | 1.35Å | |
| N3 | C2 | doub | 1.35Å | 1.35Å | |
| C2 | NAQ | sing | 1.40Å | 1.33Å | |
| NAQ | CAU | doub | 1.30Å | 1.35Å | |
| CAU | CAG | sing | 1.48Å | 1.40Å | |
| CAG | CAE | doub | 1.34Å | 1.40Å | |
| CAB | NAA | trip | 1.16Å | 1.15Å | |
| CAU | CAH | sing | 1.48Å | 1.39Å | |
| CAF | CAH | doub | 1.34Å | 1.39Å | |
| CAB | CA0 | sing | 1.46Å | 1.48Å | |
| CAE | CAT | sing | 1.50Å | 1.39Å | |
| CAF | CAT | sing | 1.50Å | 1.40Å | |
| CA0 | CAT | sing | 1.53Å | 1.54Å | |
| CAL | HAL1 | sing | 1.08Å | 1.10Å | |
| CAL | HAL2 | sing | 1.08Å | 1.10Å | |
| CAM | HAM1 | sing | 1.08Å | 1.10Å | |
| CAM | HAM2 | sing | 1.08Å | 1.10Å | |
| CBB | HBB | sing | 1.09Å | 1.10Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| NAS | HAS | sing | 1.01Å | 1.00Å | |
| NAR | HAR | sing | 1.01Å | 1.00Å | |
| CAJ | HAJ | sing | 1.09Å | 1.08Å | |
| CAD | HAD | sing | 1.09Å | 1.08Å | |
| CAC | HAC | sing | 1.09Å | 1.08Å | |
| CAI | HAI | sing | 1.09Å | 1.08Å | |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAE | HAE | sing | 1.09Å | 1.08Å | |
| CAT | HAT | sing | 1.10Å | 1.10Å | |
| CA0 | HA01 | sing | 1.08Å | 1.10Å | |
| CA0 | HA02 | sing | 1.08Å | 1.10Å | |
| CAF | HAF | sing | 1.09Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAM | CAL | CBB | 60.0° | 60.2° |
| CAL | CAM | CBB | 59.8° | 60.1° |
| CAM | CAL | HAL1 | 130.9° | 117.7° |
| CAM | CAL | HAL2 | 136.0° | 117.6° |
| CAL | CAM | HAM1 | 131.0° | 117.6° |
| CAL | CAM | HAM2 | 136.1° | 117.8° |
| CAL | CBB | CAM | 60.3° | 59.7° |
| CAL | CBB | CAX | 115.9° | 119.2° |
| CBB | CAL | HAL1 | 130.9° | 118.1° |
| CBB | CAL | HAL2 | 136.0° | 118.5° |
| CAL | CBB | HBB | 135.2° | 116.2° |
| CAM | CBB | CAX | 116.4° | 119.2° |
| CBB | CAM | HAM1 | 131.1° | 118.4° |
| CBB | CAM | HAM2 | 136.1° | 118.2° |
| CAM | CBB | HBB | 134.7° | 116.1° |
| CBB | CAX | CAK | 127.5° | 127.4° |
| CBB | CAX | NAS | 121.8° | 126.7° |
| CAX | CBB | HBB | 94.5° | 115.2° |
| CAK | CAX | NAS | 110.7° | 105.8° |
| CAX | CAK | CAV | 103.0° | 102.8° |
| CAX | CAK | HAK | 128.5° | 126.8° |
| CAX | NAS | NAN | 106.5° | 113.8° |
| CAX | NAS | HAS | 126.8° | 127.9° |
| NAS | NAN | CAV | 111.8° | 101.5° |
| NAN | NAS | HAS | 126.7° | 118.3° |
| CAK | CAV | NAN | 108.0° | 116.0° |
| CAK | CAV | NAR | 132.3° | 119.7° |
| CAV | CAK | HAK | 128.5° | 130.3° |
| NAN | CAV | NAR | 119.7° | 124.3° |
| CAV | NAR | C6 | 128.7° | 132.4° |
| CAV | NAR | HAR | 115.7° | 114.3° |
| NAR | C6 | N1 | 121.2° | 116.7° |
| NAR | C6 | C5 | 121.5° | 119.4° |
| C6 | NAR | HAR | 115.6° | 113.3° |
| N1 | C6 | C5 | 117.4° | 123.9° |
| C6 | N1 | C2 | 122.4° | 114.4° |
| C6 | C5 | CAJ | 121.7° | 122.9° |
| C6 | C5 | C4 | 119.5° | 116.1° |
| C5 | CAJ | CAD | 120.3° | 120.0° |
| CAJ | C5 | C4 | 118.8° | 121.0° |
| C5 | CAJ | HAJ | 119.8° | 121.9° |
| CAJ | CAD | CAC | 120.8° | 119.6° |
| CAD | CAJ | HAJ | 119.8° | 118.2° |
| CAJ | CAD | HAD | 119.6° | 120.2° |
| CAD | CAC | CAI | 119.2° | 120.1° |
| CAC | CAD | HAD | 119.6° | 120.3° |
| CAD | CAC | HAC | 120.4° | 120.0° |
| CAC | CAI | C4 | 120.4° | 121.6° |
| CAI | CAC | HAC | 120.4° | 119.9° |
| CAC | CAI | HAI | 119.8° | 118.6° |
| C5 | C4 | CAI | 120.5° | 117.8° |
| C5 | C4 | N3 | 119.9° | 121.5° |
| CAI | C4 | N3 | 119.6° | 120.7° |
| C4 | CAI | HAI | 119.8° | 119.8° |
| C4 | N3 | C2 | 119.5° | 116.4° |
| N1 | C2 | N3 | 121.4° | 127.7° |
| N1 | C2 | NAQ | 118.5° | 116.2° |
| N3 | C2 | NAQ | 120.1° | 116.1° |
| C2 | NAQ | CAU | 120.5° | 115.5° |
| NAQ | CAU | CAG | 121.2° | 122.3° |
| NAQ | CAU | CAH | 119.2° | 120.1° |
| CAU | CAG | CAE | 120.6° | 120.5° |
| CAG | CAU | CAH | 119.6° | 117.6° |
| CAU | CAG | HAG | 119.7° | 118.5° |
| CAG | CAE | CAT | 119.6° | 124.3° |
| CAE | CAG | HAG | 119.7° | 121.0° |
| CAG | CAE | HAE | 120.2° | 118.4° |
| NAA | CAB | CA0 | 170.4° | 178.3° |
| CAU | CAH | CAF | 119.9° | 120.6° |
| CAU | CAH | HAH | 120.0° | 118.3° |
| CAH | CAF | CAT | 120.5° | 124.3° |
| CAF | CAH | HAH | 120.0° | 121.2° |
| CAH | CAF | HAF | 119.7° | 118.4° |
| CAB | CA0 | CAT | 109.6° | 104.1° |
| CAB | CA0 | HA01 | 109.4° | 112.5° |
| CAB | CA0 | HA02 | 109.4° | 112.4° |
| CAE | CAT | CAF | 119.8° | 112.8° |
| CAE | CAT | CA0 | 120.1° | 110.1° |
| CAT | CAE | HAE | 120.2° | 117.3° |
| CAE | CAT | HAT | 98.9° | 107.6° |
| CAF | CAT | CA0 | 120.1° | 110.2° |
| CAF | CAT | HAT | 108.8° | 107.7° |
| CAT | CAF | HAF | 119.8° | 117.3° |
| CA0 | CAT | HAT | 61.9° | 108.3° |
| CAT | CA0 | HA01 | 109.4° | 108.7° |
| CAT | CA0 | HA02 | 109.4° | 108.7° |
| HAL1 | CAL | HAL2 | 74.7° | 114.4° |
| HAM1 | CAM | HAM2 | 74.5° | 114.3° |
| HA01 | CA0 | HA02 | 109.6° | 110.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAM | CAL | CBB | HAL1 | 120.0° | 107.5° |
| CAM | CAL | CBB | HAL2 | 126.7° | 107.3° |
| CAL | CAM | CBB | HAM1 | 120.0° | 107.3° |
| CAL | CAM | CBB | HAM2 | 126.7° | 107.5° |
| CAM | CAL | CBB | CAX | 107.0° | 108.7° |
| CAM | CAL | HAL1 | HAL2 | 138.6° | 144.3° |
| CAL | CAM | HAM1 | HAM2 | 138.6° | 144.3° |
| CAM | CAL | CBB | HBB | 125.1° | 106.3° |
| CAL | CBB | CAX | HBB | 146.1° | 145.3° |
| CAL | CBB | CAX | CAK | 57.5° | 124.7° |
| CAL | CBB | CAX | NAS | 123.4° | 55.2° |
| CBB | CAL | HAL1 | HAL2 | 138.6° | 146.6° |
| CAM | CBB | CAX | HBB | 145.9° | 145.1° |
| CAM | CBB | CAX | CAK | 10.5° | 55.2° |
| CAM | CBB | CAX | NAS | 168.6° | 124.8° |
| CBB | CAM | HAM1 | HAM2 | 138.7° | 146.5° |
| CBB | CAX | CAK | NAS | 179.1° | 180.0° |
| CBB | CAX | NAS | NAN | 179.4° | 180.0° |
| CBB | CAX | CAK | CAV | 179.3° | 180.0° |
| CAX | CBB | CAL | HAL1 | 133.0° | 143.8° |
| CAX | CBB | CAL | HAL2 | 19.7° | 1.4° |
| CAX | CBB | CAM | HAM1 | 13.9° | 1.4° |
| CAX | CBB | CAM | HAM2 | 127.2° | 143.7° |
| CBB | CAX | CAK | HAK | 0.7° | 0.0° |
| CBB | CAX | NAS | HAS | 0.6° | 0.1° |
| CAK | CAX | NAS | NAN | 0.2° | 0.0° |
| CAX | CAK | CAV | HAK | 180.0° | 180.0° |
| CAX | CAK | CAV | NAN | 0.2° | 0.1° |
| CAX | CAK | CAV | NAR | 177.5° | 180.0° |
| CAK | CAX | CBB | HBB | 156.4° | 89.9° |
| CAK | CAX | NAS | HAS | 179.8° | 179.9° |
| CAX | NAS | NAN | HAS | 180.0° | 179.9° |
| NAS | CAX | CAK | CAV | 0.2° | 0.0° |
| CAX | NAS | NAN | CAV | 0.0° | 0.0° |
| NAS | CAX | CBB | HBB | 22.7° | 90.1° |
| NAS | CAX | CAK | HAK | 179.8° | 180.0° |
| NAS | NAN | CAV | CAK | 0.1° | 0.1° |
| NAS | NAN | CAV | NAR | 177.9° | 180.0° |
| CAK | CAV | NAN | NAR | 178.0° | 179.9° |
| CAK | CAV | NAR | C6 | 7.1° | 180.0° |
| CAK | CAV | NAR | HAR | 172.9° | 0.1° |
| NAN | CAV | NAR | C6 | 175.4° | 0.1° |
| NAN | CAV | CAK | HAK | 179.9° | 180.0° |
| CAV | NAN | NAS | HAS | 180.0° | 180.0° |
| NAN | CAV | NAR | HAR | 4.6° | 180.0° |
| CAV | NAR | C6 | HAR | 180.0° | 179.9° |
| CAV | NAR | C6 | N1 | 15.8° | 30.1° |
| CAV | NAR | C6 | C5 | 165.2° | 150.0° |
| NAR | CAV | CAK | HAK | 2.5° | 0.1° |
| NAR | C6 | N1 | C5 | 179.1° | 179.9° |
| NAR | C6 | C5 | CAJ | 0.3° | 0.0° |
| NAR | C6 | C5 | C4 | 179.9° | 179.9° |
| NAR | C6 | N1 | C2 | 179.8° | 179.9° |
| N1 | C6 | C5 | CAJ | 178.8° | 180.0° |
| N1 | C6 | C5 | C4 | 1.0° | 0.0° |
| C6 | N1 | C2 | N3 | 0.0° | 0.0° |
| C6 | N1 | C2 | NAQ | 178.9° | 180.0° |
| N1 | C6 | NAR | HAR | 164.2° | 150.1° |
| C6 | C5 | CAJ | C4 | 179.8° | 179.9° |
| C6 | C5 | CAJ | CAD | 179.8° | 180.0° |
| C6 | C5 | C4 | CAI | 179.8° | 180.0° |
| C6 | C5 | C4 | N3 | 0.1° | 0.0° |
| C5 | C6 | N1 | C2 | 1.1° | 0.0° |
| C5 | C6 | NAR | HAR | 14.8° | 29.9° |
| C6 | C5 | CAJ | HAJ | 0.2° | 0.0° |
| C5 | CAJ | CAD | HAJ | 180.0° | 180.0° |
| C5 | CAJ | CAD | CAC | 0.0° | 0.0° |
| CAJ | C5 | C4 | CAI | 0.4° | 0.1° |
| CAJ | C5 | C4 | N3 | 179.9° | 179.9° |
| C5 | CAJ | CAD | HAD | 180.0° | 179.9° |
| CAJ | CAD | CAC | HAD | 180.0° | 179.9° |
| CAJ | CAD | CAC | CAI | 0.4° | 0.0° |
| CAD | CAJ | C5 | C4 | 0.4° | 0.1° |
| CAJ | CAD | CAC | HAC | 179.6° | 180.0° |
| CAD | CAC | CAI | HAC | 180.0° | 180.0° |
| CAD | CAC | CAI | C4 | 0.4° | 0.0° |
| CAC | CAD | CAJ | HAJ | 180.0° | 180.0° |
| CAD | CAC | CAI | HAI | 179.6° | 179.9° |
| CAC | CAI | C4 | C5 | 0.0° | 0.0° |
| CAC | CAI | C4 | HAI | 180.0° | 179.9° |
| CAC | CAI | C4 | N3 | 179.7° | 180.0° |
| CAI | CAC | CAD | HAD | 179.6° | 179.9° |
| C5 | C4 | CAI | N3 | 179.7° | 180.0° |
| C5 | C4 | N3 | C2 | 1.1° | 0.0° |
| C4 | C5 | CAJ | HAJ | 179.6° | 180.0° |
| C5 | C4 | CAI | HAI | 180.0° | 179.9° |
| CAI | C4 | N3 | C2 | 179.1° | 180.0° |
| C4 | CAI | CAC | HAC | 179.6° | 180.0° |
| C4 | N3 | C2 | N1 | 1.1° | 0.1° |
| C4 | N3 | C2 | NAQ | 180.0° | 179.9° |
| N3 | C4 | CAI | HAI | 0.3° | 0.1° |
| N1 | C2 | N3 | NAQ | 178.9° | 180.0° |
| N1 | C2 | NAQ | CAU | 16.1° | 89.9° |
| N3 | C2 | NAQ | CAU | 165.0° | 90.1° |
| C2 | NAQ | CAU | CAG | 55.2° | 180.0° |
| C2 | NAQ | CAU | CAH | 125.1° | 0.3° |
| NAQ | CAU | CAG | CAH | 179.7° | 179.7° |
| NAQ | CAU | CAG | CAE | 179.9° | 179.1° |
| NAQ | CAU | CAH | CAF | 179.9° | 179.0° |
| NAQ | CAU | CAG | HAG | 0.1° | 1.1° |
| NAQ | CAU | CAH | HAH | 0.1° | 1.1° |
| CAU | CAG | CAE | HAG | 180.0° | 179.9° |
| CAG | CAU | CAH | CAF | 0.2° | 1.3° |
| CAU | CAG | CAE | CAT | 0.5° | 0.2° |
| CAG | CAU | CAH | HAH | 179.8° | 178.6° |
| CAU | CAG | CAE | HAE | 179.5° | 179.4° |
| CAE | CAG | CAU | CAH | 0.4° | 1.3° |
| CAG | CAE | CAT | HAE | 180.0° | 179.6° |
| CAG | CAE | CAT | CAF | 0.4° | 1.6° |
| CAG | CAE | CAT | CA0 | 180.0° | 125.0° |
| CAG | CAE | CAT | HAT | 117.4° | 117.1° |
| NAA | CAB | CA0 | CAT | 66.1° | 177.9° |
| NAA | CAB | CA0 | HA01 | 173.9° | 60.5° |
| NAA | CAB | CA0 | HA02 | 53.9° | 64.7° |
| CAU | CAH | CAF | HAH | 180.0° | 179.9° |
| CAU | CAH | CAF | CAT | 0.2° | 0.2° |
| CAH | CAU | CAG | HAG | 179.6° | 178.6° |
| CAU | CAH | CAF | HAF | 179.8° | 179.4° |
| CAH | CAF | CAT | CAE | 0.3° | 1.6° |
| CAH | CAF | CAT | HAF | 180.0° | 179.6° |
| CAH | CAF | CAT | CA0 | 179.9° | 125.0° |
| CAH | CAF | CAT | HAT | 112.3° | 117.1° |
| CAB | CA0 | CAT | CAE | 169.5° | 62.5° |
| CAB | CA0 | CAT | CAF | 10.9° | 62.5° |
| CAB | CA0 | CAT | HA01 | 120.0° | 120.0° |
| CAB | CA0 | CAT | HA02 | 119.9° | 120.0° |
| CAB | CA0 | CAT | HAT | 85.6° | 180.0° |
| CAB | CA0 | HA01 | HA02 | 119.9° | 126.3° |
| CAE | CAT | CAF | CA0 | 179.6° | 123.5° |
| CAE | CAT | CAF | HAT | 112.6° | 118.6° |
| CAE | CAT | CA0 | HAT | 83.9° | 117.5° |
| CAT | CAE | CAG | HAG | 179.5° | 179.9° |
| CAE | CAT | CA0 | HA01 | 70.6° | 57.5° |
| CAE | CAT | CA0 | HA02 | 49.5° | 177.5° |
| CAE | CAT | CAF | HAF | 179.7° | 178.1° |
| CAF | CAT | CA0 | HAT | 96.5° | 117.5° |
| CAT | CAF | CAH | HAH | 179.8° | 179.9° |
| CAF | CAT | CAE | HAE | 179.6° | 178.0° |
| CAF | CAT | CA0 | HA01 | 109.1° | 177.5° |
| CAF | CAT | CA0 | HA02 | 130.9° | 57.5° |
| CA0 | CAT | CAE | HAE | 0.0° | 54.6° |
| CAT | CA0 | HA01 | HA02 | 120.0° | 119.0° |
| CA0 | CAT | CAF | HAF | 0.1° | 54.6° |
| HAL1 | CAL | CAM | HAM1 | 120.0° | 143.2° |
| HAL1 | CAL | CAM | HAM2 | 6.7° | 0.1° |
| HAL1 | CAL | CBB | HBB | 5.1° | 1.2° |
| HAL2 | CAL | CAM | HAM1 | 6.7° | 0.1° |
| HAL2 | CAL | CAM | HAM2 | 106.6° | 143.0° |
| HAL2 | CAL | CBB | HBB | 108.2° | 146.4° |
| HAM1 | CAM | CBB | HBB | 114.2° | 146.3° |
| HAM2 | CAM | CBB | HBB | 0.9° | 1.1° |
| HAJ | CAJ | CAD | HAD | 0.0° | 0.1° |
| HAD | CAD | CAC | HAC | 0.4° | 0.1° |
| HAC | CAC | CAI | HAI | 0.4° | 0.1° |
| HAG | CAG | CAE | HAE | 0.5° | 0.5° |
| HAH | CAH | CAF | HAF | 0.2° | 0.5° |
| HAE | CAE | CAT | HAT | 62.6° | 63.3° |
| HAT | CAT | CA0 | HA01 | 154.4° | 59.9° |
| HAT | CAT | CA0 | HA02 | 34.3° | 60.0° |
| HAT | CAT | CAF | HAF | 67.7° | 63.3° |
