RNE
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
NAA | CAB | sing | 1.47Å | 1.50Å | |
CAB | CAC | sing | 1.51Å | 1.54Å | |
CAC | CAD | doub | 1.34Å | 1.35Å | |
CAU | CAD | sing | 1.51Å | 1.53Å | |
CAD | CAG | sing | 1.46Å | 1.54Å | |
CAG | CAF | doub | 1.36Å | 1.36Å | |
CAF | CAE | sing | 1.41Å | 1.53Å | |
CAE | CAH | doub | 1.36Å | 1.35Å | |
CAT | CAH | sing | 1.51Å | 1.52Å | |
CAH | CAI | sing | 1.41Å | 1.52Å | |
CAI | CAJ | doub | 1.36Å | 1.34Å | |
CAQ | CAP | sing | 1.53Å | 1.52Å | |
CAJ | CAK | sing | 1.46Å | 1.56Å | |
CAK | CAP | sing | 1.50Å | 1.55Å | |
CAK | CAL | doub | 1.32Å | 1.34Å | |
CAP | CAR | sing | 1.53Å | 1.53Å | |
CAP | CAO | sing | 1.53Å | 1.51Å | |
CAS | CAL | sing | 1.51Å | 1.52Å | |
CAL | CAM | sing | 1.50Å | 1.53Å | |
CAO | CAN | sing | 1.53Å | 1.49Å | |
CAM | CAN | sing | 1.53Å | 1.52Å | |
NAA | HAA2 | sing | 1.01Å | 1.00Å | |
NAA | HAA1 | sing | 1.01Å | 1.00Å | |
CAB | HAB2 | sing | 1.09Å | 1.10Å | |
CAB | HAB1 | sing | 1.09Å | 1.10Å | |
CAC | HAC1 | sing | 1.08Å | 1.08Å | |
CAG | HAG1 | sing | 1.08Å | 1.08Å | |
CAF | HAF1 | sing | 1.08Å | 1.08Å | |
CAE | HAE1 | sing | 1.08Å | 1.08Å | |
CAI | HAI1 | sing | 1.08Å | 1.08Å | |
CAJ | HAJ1 | sing | 1.08Å | 1.08Å | |
CAM | HAM2 | sing | 1.09Å | 1.10Å | |
CAM | HAM1 | sing | 1.09Å | 1.10Å | |
CAN | HAN1 | sing | 1.09Å | 1.10Å | |
CAN | HAN2 | sing | 1.09Å | 1.10Å | |
CAO | HAO1 | sing | 1.09Å | 1.10Å | |
CAO | HAO2 | sing | 1.09Å | 1.10Å | |
CAQ | HAQ3 | sing | 1.09Å | 1.10Å | |
CAQ | HAQ1 | sing | 1.09Å | 1.10Å | |
CAQ | HAQ2 | sing | 1.09Å | 1.10Å | |
CAR | HAR1 | sing | 1.09Å | 1.10Å | |
CAR | HAR2 | sing | 1.09Å | 1.10Å | |
CAR | HAR3 | sing | 1.09Å | 1.10Å | |
CAS | HAS3 | sing | 1.09Å | 1.10Å | |
CAS | HAS1 | sing | 1.09Å | 1.10Å | |
CAS | HAS2 | sing | 1.09Å | 1.10Å | |
CAT | HAT2 | sing | 1.09Å | 1.10Å | |
CAT | HAT3 | sing | 1.09Å | 1.10Å | |
CAT | HAT1 | sing | 1.09Å | 1.10Å | |
CAU | HAU3 | sing | 1.09Å | 1.10Å | |
CAU | HAU1 | sing | 1.09Å | 1.10Å | |
CAU | HAU2 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
NAA | CAB | CAC | 105.8° | 109.5° |
CAB | NAA | HAA2 | 109.5° | 111.0° |
CAB | NAA | HAA1 | 109.5° | 111.0° |
NAA | CAB | HAB2 | 110.4° | 109.5° |
NAA | CAB | HAB1 | 110.4° | 109.5° |
CAB | CAC | CAD | 129.4° | 120.0° |
CAC | CAB | HAB2 | 110.4° | 109.5° |
CAC | CAB | HAB1 | 110.4° | 109.5° |
CAB | CAC | HAC1 | 115.3° | 120.0° |
CAC | CAD | CAU | 125.8° | 120.0° |
CAC | CAD | CAG | 113.1° | 120.0° |
CAD | CAC | HAC1 | 115.3° | 120.0° |
CAU | CAD | CAG | 120.6° | 120.0° |
CAD | CAU | HAU3 | 109.5° | 109.5° |
CAD | CAU | HAU1 | 109.5° | 109.4° |
CAD | CAU | HAU2 | 109.5° | 109.4° |
CAD | CAG | CAF | 121.7° | 120.0° |
CAD | CAG | HAG1 | 119.1° | 120.0° |
CAG | CAF | CAE | 116.7° | 120.0° |
CAF | CAG | HAG1 | 119.1° | 120.0° |
CAG | CAF | HAF1 | 121.6° | 120.0° |
CAF | CAE | CAH | 124.4° | 120.0° |
CAE | CAF | HAF1 | 121.7° | 120.0° |
CAF | CAE | HAE1 | 117.8° | 120.0° |
CAE | CAH | CAT | 123.9° | 120.0° |
CAE | CAH | CAI | 114.4° | 120.0° |
CAH | CAE | HAE1 | 117.8° | 120.0° |
CAT | CAH | CAI | 121.5° | 120.0° |
CAH | CAT | HAT2 | 109.5° | 109.5° |
CAH | CAT | HAT3 | 109.4° | 109.5° |
CAH | CAT | HAT1 | 109.4° | 109.5° |
CAH | CAI | CAJ | 121.8° | 120.0° |
CAH | CAI | HAI1 | 119.1° | 120.0° |
CAI | CAJ | CAK | 122.5° | 120.0° |
CAJ | CAI | HAI1 | 119.1° | 120.0° |
CAI | CAJ | HAJ1 | 118.7° | 120.0° |
CAQ | CAP | CAK | 112.5° | 109.4° |
CAQ | CAP | CAR | 108.1° | 109.3° |
CAQ | CAP | CAO | 105.5° | 109.1° |
CAP | CAQ | HAQ3 | 109.5° | 109.4° |
CAP | CAQ | HAQ1 | 109.5° | 109.5° |
CAP | CAQ | HAQ2 | 109.4° | 109.5° |
CAJ | CAK | CAP | 122.0° | 118.1° |
CAJ | CAK | CAL | 116.6° | 118.2° |
CAK | CAJ | HAJ1 | 118.8° | 120.0° |
CAP | CAK | CAL | 121.3° | 123.7° |
CAK | CAP | CAR | 111.7° | 109.4° |
CAK | CAP | CAO | 110.7° | 110.0° |
CAK | CAL | CAS | 121.8° | 118.1° |
CAK | CAL | CAM | 124.4° | 123.7° |
CAR | CAP | CAO | 108.0° | 109.6° |
CAP | CAR | HAR1 | 109.5° | 109.5° |
CAP | CAR | HAR2 | 109.5° | 109.5° |
CAP | CAR | HAR3 | 109.5° | 109.5° |
CAP | CAO | CAN | 111.7° | 108.4° |
CAP | CAO | HAO1 | 108.9° | 109.9° |
CAP | CAO | HAO2 | 108.9° | 109.7° |
CAS | CAL | CAM | 113.7° | 118.2° |
CAL | CAS | HAS3 | 109.5° | 109.5° |
CAL | CAS | HAS1 | 109.5° | 109.4° |
CAL | CAS | HAS2 | 109.5° | 109.5° |
CAL | CAM | CAN | 111.1° | 110.1° |
CAL | CAM | HAM2 | 109.1° | 109.3° |
CAL | CAM | HAM1 | 109.1° | 109.3° |
CAO | CAN | CAM | 112.8° | 108.5° |
CAO | CAN | HAN1 | 108.6° | 109.6° |
CAO | CAN | HAN2 | 108.7° | 109.8° |
CAN | CAO | HAO1 | 108.9° | 109.6° |
CAN | CAO | HAO2 | 108.9° | 109.6° |
CAN | CAM | HAM2 | 109.0° | 109.4° |
CAN | CAM | HAM1 | 109.0° | 109.4° |
CAM | CAN | HAN1 | 108.6° | 109.6° |
CAM | CAN | HAN2 | 108.6° | 109.7° |
HAA2 | NAA | HAA1 | 109.5° | 111.0° |
HAB2 | CAB | HAB1 | 109.5° | 109.5° |
HAM2 | CAM | HAM1 | 109.5° | 109.3° |
HAN1 | CAN | HAN2 | 109.4° | 109.6° |
HAO1 | CAO | HAO2 | 109.5° | 109.6° |
HAQ3 | CAQ | HAQ1 | 109.4° | 109.5° |
HAQ3 | CAQ | HAQ2 | 109.5° | 109.5° |
HAQ1 | CAQ | HAQ2 | 109.5° | 109.5° |
HAR1 | CAR | HAR2 | 109.4° | 109.4° |
HAR1 | CAR | HAR3 | 109.5° | 109.4° |
HAR2 | CAR | HAR3 | 109.5° | 109.5° |
HAS3 | CAS | HAS1 | 109.5° | 109.4° |
HAS3 | CAS | HAS2 | 109.4° | 109.5° |
HAS1 | CAS | HAS2 | 109.5° | 109.4° |
HAT2 | CAT | HAT3 | 109.4° | 109.5° |
HAT2 | CAT | HAT1 | 109.5° | 109.5° |
HAT3 | CAT | HAT1 | 109.5° | 109.5° |
HAU3 | CAU | HAU1 | 109.5° | 109.5° |
HAU3 | CAU | HAU2 | 109.5° | 109.5° |
HAU1 | CAU | HAU2 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
NAA | CAB | CAC | HAB2 | 119.4° | 120.0° |
NAA | CAB | CAC | HAB1 | 119.5° | 120.0° |
NAA | CAB | CAC | CAD | 127.5° | 122.9° |
CAB | NAA | HAA2 | HAA1 | 120.0° | 123.9° |
NAA | CAB | HAB2 | HAB1 | 121.7° | 120.0° |
NAA | CAB | CAC | HAC1 | 52.5° | 57.2° |
CAB | CAC | CAD | HAC1 | 180.0° | 179.9° |
CAB | CAC | CAD | CAU | 1.6° | 6.3° |
CAB | CAC | CAD | CAG | 174.6° | 173.7° |
CAC | CAB | NAA | HAA2 | 180.0° | 180.0° |
CAC | CAB | NAA | HAA1 | 60.0° | 56.1° |
CAC | CAB | HAB2 | HAB1 | 121.7° | 120.0° |
CAC | CAD | CAU | CAG | 172.5° | 180.0° |
CAC | CAD | CAG | CAF | 152.8° | 179.9° |
CAD | CAC | CAB | HAB2 | 8.1° | 117.1° |
CAD | CAC | CAB | HAB1 | 113.0° | 2.9° |
CAC | CAD | CAG | HAG1 | 27.2° | 0.0° |
CAC | CAD | CAU | HAU3 | 180.0° | 85.1° |
CAC | CAD | CAU | HAU1 | 60.0° | 154.9° |
CAC | CAD | CAU | HAU2 | 60.0° | 34.9° |
CAU | CAD | CAG | CAF | 20.6° | 0.0° |
CAU | CAD | CAC | HAC1 | 178.4° | 173.7° |
CAU | CAD | CAG | HAG1 | 159.4° | 179.9° |
CAD | CAU | HAU3 | HAU1 | 120.0° | 120.0° |
CAD | CAU | HAU3 | HAU2 | 120.0° | 120.0° |
CAD | CAU | HAU1 | HAU2 | 120.0° | 120.0° |
CAD | CAG | CAF | HAG1 | 180.0° | 179.9° |
CAD | CAG | CAF | CAE | 173.6° | 180.0° |
CAG | CAD | CAC | HAC1 | 5.4° | 6.4° |
CAD | CAG | CAF | HAF1 | 6.4° | 0.1° |
CAG | CAD | CAU | HAU3 | 7.5° | 94.8° |
CAG | CAD | CAU | HAU1 | 112.5° | 25.1° |
CAG | CAD | CAU | HAU2 | 127.5° | 145.1° |
CAG | CAF | CAE | HAF1 | 180.0° | 179.9° |
CAG | CAF | CAE | CAH | 176.4° | 180.0° |
CAG | CAF | CAE | HAE1 | 3.6° | 0.1° |
CAF | CAE | CAH | HAE1 | 180.0° | 180.0° |
CAF | CAE | CAH | CAT | 6.6° | 0.0° |
CAF | CAE | CAH | CAI | 178.4° | 180.0° |
CAE | CAF | CAG | HAG1 | 6.4° | 0.1° |
CAE | CAH | CAT | CAI | 174.6° | 180.0° |
CAE | CAH | CAI | CAJ | 179.1° | 180.0° |
CAH | CAE | CAF | HAF1 | 3.6° | 0.0° |
CAE | CAH | CAI | HAI1 | 0.9° | 0.1° |
CAE | CAH | CAT | HAT2 | 180.0° | 90.0° |
CAE | CAH | CAT | HAT3 | 60.0° | 150.0° |
CAE | CAH | CAT | HAT1 | 60.0° | 30.0° |
CAT | CAH | CAI | CAJ | 4.0° | 0.0° |
CAT | CAH | CAE | HAE1 | 173.4° | 180.0° |
CAT | CAH | CAI | HAI1 | 176.0° | 180.0° |
CAH | CAT | HAT2 | HAT3 | 120.0° | 120.0° |
CAH | CAT | HAT2 | HAT1 | 120.0° | 120.0° |
CAH | CAT | HAT3 | HAT1 | 120.0° | 120.0° |
CAH | CAI | CAJ | HAI1 | 180.0° | 179.9° |
CAH | CAI | CAJ | CAK | 177.3° | 174.5° |
CAI | CAH | CAE | HAE1 | 1.6° | 0.0° |
CAH | CAI | CAJ | HAJ1 | 2.7° | 5.4° |
CAI | CAH | CAT | HAT2 | 5.4° | 90.0° |
CAI | CAH | CAT | HAT3 | 125.4° | 30.0° |
CAI | CAH | CAT | HAT1 | 114.6° | 150.0° |
CAI | CAJ | CAK | HAJ1 | 180.0° | 179.9° |
CAI | CAJ | CAK | CAP | 20.3° | 123.1° |
CAI | CAJ | CAK | CAL | 156.1° | 56.7° |
CAQ | CAP | CAK | CAJ | 48.0° | 42.7° |
CAQ | CAP | CAK | CAR | 121.8° | 119.7° |
CAQ | CAP | CAK | CAO | 117.8° | 119.9° |
CAQ | CAP | CAK | CAL | 135.7° | 137.5° |
CAQ | CAP | CAR | CAO | 113.7° | 119.5° |
CAQ | CAP | CAO | CAN | 171.0° | 170.2° |
CAQ | CAP | CAO | HAO1 | 68.6° | 50.5° |
CAQ | CAP | CAO | HAO2 | 50.7° | 70.1° |
CAP | CAQ | HAQ3 | HAQ1 | 120.0° | 120.0° |
CAP | CAQ | HAQ3 | HAQ2 | 120.0° | 120.0° |
CAP | CAQ | HAQ1 | HAQ2 | 120.0° | 120.0° |
CAQ | CAP | CAR | HAR1 | 180.0° | 59.7° |
CAQ | CAP | CAR | HAR2 | 60.0° | 60.2° |
CAQ | CAP | CAR | HAR3 | 60.0° | 179.7° |
CAJ | CAK | CAP | CAL | 176.3° | 179.7° |
CAJ | CAK | CAP | CAR | 73.8° | 77.0° |
CAJ | CAK | CAP | CAO | 165.8° | 162.6° |
CAJ | CAK | CAL | CAS | 5.3° | 0.5° |
CAJ | CAK | CAL | CAM | 174.4° | 179.6° |
CAK | CAJ | CAI | HAI1 | 2.7° | 5.6° |
CAK | CAP | CAR | CAO | 122.0° | 120.7° |
CAP | CAK | CAL | CAS | 178.2° | 179.3° |
CAP | CAK | CAL | CAM | 2.1° | 0.7° |
CAK | CAP | CAO | CAN | 49.0° | 50.2° |
CAP | CAK | CAJ | HAJ1 | 159.7° | 57.0° |
CAK | CAP | CAO | HAO1 | 169.3° | 69.5° |
CAK | CAP | CAO | HAO2 | 71.3° | 169.9° |
CAK | CAP | CAQ | HAQ3 | 180.0° | 62.8° |
CAK | CAP | CAQ | HAQ1 | 60.0° | 177.2° |
CAK | CAP | CAQ | HAQ2 | 60.0° | 57.2° |
CAK | CAP | CAR | HAR1 | 55.7° | 60.0° |
CAK | CAP | CAR | HAR2 | 64.3° | 180.0° |
CAK | CAP | CAR | HAR3 | 175.7° | 59.9° |
CAL | CAK | CAP | CAR | 102.6° | 102.8° |
CAL | CAK | CAP | CAO | 17.8° | 17.7° |
CAK | CAL | CAS | CAM | 179.8° | 179.9° |
CAK | CAL | CAM | CAN | 8.6° | 17.2° |
CAL | CAK | CAJ | HAJ1 | 23.9° | 123.2° |
CAK | CAL | CAM | HAM2 | 111.6° | 103.0° |
CAK | CAL | CAM | HAM1 | 128.9° | 137.4° |
CAK | CAL | CAS | HAS3 | 180.0° | 84.9° |
CAK | CAL | CAS | HAS1 | 60.0° | 155.1° |
CAK | CAL | CAS | HAS2 | 60.0° | 35.2° |
CAR | CAP | CAO | CAN | 73.5° | 70.1° |
CAR | CAP | CAO | HAO1 | 46.8° | 170.2° |
CAR | CAP | CAO | HAO2 | 166.2° | 49.6° |
CAR | CAP | CAQ | HAQ3 | 56.2° | 177.5° |
CAR | CAP | CAQ | HAQ1 | 63.8° | 57.5° |
CAR | CAP | CAQ | HAQ2 | 176.2° | 62.5° |
CAP | CAR | HAR1 | HAR2 | 120.0° | 120.0° |
CAP | CAR | HAR1 | HAR3 | 120.0° | 120.0° |
CAP | CAR | HAR2 | HAR3 | 120.0° | 120.1° |
CAP | CAO | CAN | HAO1 | 120.3° | 119.9° |
CAP | CAO | CAN | HAO2 | 120.3° | 119.7° |
CAP | CAO | CAN | CAM | 62.5° | 68.4° |
CAP | CAO | CAN | HAN1 | 58.0° | 172.0° |
CAP | CAO | CAN | HAN2 | 177.0° | 51.5° |
CAP | CAO | HAO1 | HAO2 | 119.0° | 120.7° |
CAO | CAP | CAQ | HAQ3 | 59.2° | 57.7° |
CAO | CAP | CAQ | HAQ1 | 179.1° | 62.3° |
CAO | CAP | CAQ | HAQ2 | 60.8° | 177.7° |
CAO | CAP | CAR | HAR1 | 66.3° | 179.3° |
CAO | CAP | CAR | HAR2 | 173.7° | 59.3° |
CAO | CAP | CAR | HAR3 | 53.7° | 60.8° |
CAS | CAL | CAM | CAN | 171.1° | 162.8° |
CAS | CAL | CAM | HAM2 | 68.6° | 77.0° |
CAS | CAL | CAM | HAM1 | 50.9° | 42.5° |
CAL | CAS | HAS3 | HAS1 | 120.0° | 120.0° |
CAL | CAS | HAS3 | HAS2 | 120.0° | 120.1° |
CAL | CAS | HAS1 | HAS2 | 120.0° | 120.0° |
CAL | CAM | CAN | CAO | 40.1° | 49.8° |
CAL | CAM | CAN | HAM2 | 120.3° | 120.2° |
CAL | CAM | CAN | HAM1 | 120.3° | 120.2° |
CAL | CAM | HAM2 | HAM1 | 119.3° | 119.6° |
CAL | CAM | CAN | HAN1 | 80.4° | 169.5° |
CAL | CAM | CAN | HAN2 | 160.6° | 70.1° |
CAM | CAL | CAS | HAS3 | 0.2° | 95.1° |
CAM | CAL | CAS | HAS1 | 120.3° | 24.9° |
CAM | CAL | CAS | HAS2 | 119.7° | 144.9° |
CAO | CAN | CAM | HAN1 | 120.5° | 119.7° |
CAO | CAN | CAM | HAN2 | 120.5° | 119.9° |
CAO | CAN | CAM | HAM2 | 80.2° | 70.3° |
CAO | CAN | CAM | HAM1 | 160.3° | 170.0° |
CAO | CAN | HAN1 | HAN2 | 118.5° | 120.6° |
CAN | CAO | HAO1 | HAO2 | 119.0° | 120.4° |
CAN | CAM | HAM2 | HAM1 | 119.2° | 119.7° |
CAM | CAN | HAN1 | HAN2 | 118.5° | 120.4° |
CAM | CAN | CAO | HAO1 | 177.2° | 51.5° |
CAM | CAN | CAO | HAO2 | 57.8° | 171.9° |
HAA2 | NAA | CAB | HAB2 | 60.6° | 60.0° |
HAA2 | NAA | CAB | HAB1 | 60.6° | 60.0° |
HAA1 | NAA | CAB | HAB2 | 59.4° | 63.9° |
HAA1 | NAA | CAB | HAB1 | 179.4° | 176.1° |
HAB2 | CAB | CAC | HAC1 | 171.9° | 62.8° |
HAB1 | CAB | CAC | HAC1 | 67.0° | 177.2° |
HAG1 | CAG | CAF | HAF1 | 173.6° | 180.0° |
HAF1 | CAF | CAE | HAE1 | 176.4° | 180.0° |
HAI1 | CAI | CAJ | HAJ1 | 177.3° | 174.5° |
HAM2 | CAM | CAN | HAN1 | 159.3° | 49.3° |
HAM2 | CAM | CAN | HAN2 | 40.3° | 169.7° |
HAM1 | CAM | CAN | HAN1 | 39.8° | 70.3° |
HAM1 | CAM | CAN | HAN2 | 79.1° | 50.1° |
HAN1 | CAN | CAO | HAO1 | 62.3° | 68.1° |
HAN1 | CAN | CAO | HAO2 | 178.3° | 52.2° |
HAN2 | CAN | CAO | HAO1 | 56.7° | 171.4° |
HAN2 | CAN | CAO | HAO2 | 62.7° | 68.3° |
HAQ3 | CAQ | HAQ1 | HAQ2 | 120.0° | 120.1° |
HAR1 | CAR | HAR2 | HAR3 | 120.0° | 119.9° |
HAS3 | CAS | HAS1 | HAS2 | 120.0° | 120.0° |
HAT2 | CAT | HAT3 | HAT1 | 120.0° | 120.0° |
HAU3 | CAU | HAU1 | HAU2 | 120.0° | 120.1° |