T26
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OE1 | CD | sing | 1.34Å | 1.25Å | |
CD | OE2 | doub | 1.21Å | 1.26Å | |
CD | CG | sing | 1.51Å | 1.52Å | |
CG | CB | sing | 1.53Å | 1.54Å | |
CB | CA | sing | 1.53Å | 1.55Å | |
C | OXT | sing | 1.34Å | 1.28Å | |
C | O | doub | 1.21Å | 1.25Å | |
C | CA | sing | 1.51Å | 1.51Å | |
N | CAU | sing | 1.35Å | 1.34Å | |
N | CA | sing | 1.47Å | 1.47Å | |
CAU | OBC | doub | 1.22Å | 1.22Å | |
CAU | CAT | sing | 1.48Å | 1.48Å | |
CAT | CAQ | sing | 1.40Å | 1.48Å | Aromatic |
CAT | CAS | doub | 1.39Å | 1.35Å | Aromatic |
CAQ | CAO | doub | 1.38Å | 1.40Å | Aromatic |
CAS | CAR | sing | 1.39Å | 1.39Å | Aromatic |
CAR | CAP | doub | 1.39Å | 1.40Å | Aromatic |
CAR | NAY | sing | 1.40Å | 1.46Å | |
CAP | CAO | sing | 1.38Å | 1.39Å | Aromatic |
CAA | CAC | sing | 1.38Å | 1.39Å | Aromatic |
CAA | CAB | doub | 1.38Å | 1.39Å | Aromatic |
CAA | CAN | sing | 1.51Å | 1.47Å | |
CAC | CAE | doub | 1.38Å | 1.38Å | Aromatic |
CAE | CAF | sing | 1.40Å | 1.40Å | Aromatic |
CAB | CAG | sing | 1.38Å | 1.40Å | Aromatic |
CAG | CAF | doub | 1.40Å | 1.39Å | Aromatic |
CAF | CAH | sing | 1.47Å | 1.48Å | |
CAH | CAI | doub | 1.36Å | 1.35Å | |
CAI | SBG | sing | 1.78Å | 1.75Å | |
CAI | CAK | sing | 1.47Å | 1.47Å | |
SBG | CAL | sing | 1.77Å | 1.74Å | |
CAL | SBH | doub | 1.71Å | 1.77Å | |
CAL | NAX | sing | 1.34Å | 1.36Å | |
NAX | CAK | sing | 1.32Å | 1.36Å | |
CAK | OBE | doub | 1.22Å | 1.28Å | |
CAN | NAY | sing | 1.46Å | 1.50Å | |
OE1 | HE1 | sing | 0.97Å | 0.95Å | |
CG | HG1C | sing | 1.09Å | 1.10Å | |
CG | HG2C | sing | 1.09Å | 1.10Å | |
CB | HB1C | sing | 1.09Å | 1.10Å | |
CB | HB2C | sing | 1.09Å | 1.10Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
OXT | HXT | sing | 0.97Å | 0.95Å | |
N | H | sing | 0.97Å | 1.00Å | |
CAQ | HAQ | sing | 1.08Å | 1.08Å | |
CAS | HAS | sing | 1.08Å | 1.08Å | |
CAO | HAO | sing | 1.08Å | 1.08Å | |
CAP | HAP | sing | 1.08Å | 1.08Å | |
NAY | HAY | sing | 0.97Å | 1.00Å | |
CAC | HAC | sing | 1.08Å | 1.08Å | |
CAB | HAB | sing | 1.08Å | 1.08Å | |
CAN | HAN1 | sing | 1.09Å | 1.10Å | |
CAN | HAN2 | sing | 1.09Å | 1.10Å | |
CAE | HAE | sing | 1.08Å | 1.08Å | |
CAG | HAG | sing | 1.08Å | 1.08Å | |
CAH | HAH | sing | 1.08Å | 1.08Å | |
NAX | HAX | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OE1 | CD | OE2 | 121.3° | 120.0° |
OE1 | CD | CG | 120.6° | 120.0° |
CD | OE1 | HE1 | 109.5° | 117.0° |
OE2 | CD | CG | 118.1° | 120.0° |
CD | CG | CB | 113.2° | 109.5° |
CD | CG | HG1C | 108.2° | 109.5° |
CD | CG | HG2C | 107.4° | 109.5° |
CG | CB | CA | 111.8° | 109.4° |
CB | CG | HG1C | 108.3° | 109.5° |
CB | CG | HG2C | 107.4° | 109.4° |
CG | CB | HB1C | 108.7° | 109.4° |
CG | CB | HB2C | 108.2° | 109.4° |
CB | CA | C | 109.5° | 109.5° |
CB | CA | N | 107.0° | 109.5° |
CA | CB | HB1C | 108.7° | 109.4° |
CA | CB | HB2C | 108.2° | 109.5° |
CB | CA | HA | 111.2° | 109.5° |
OXT | C | O | 123.2° | 120.0° |
OXT | C | CA | 120.3° | 120.0° |
C | OXT | HXT | 109.5° | 117.0° |
O | C | CA | 116.5° | 120.0° |
C | CA | N | 110.0° | 109.4° |
C | CA | HA | 108.4° | 109.4° |
CAU | N | CA | 123.1° | 120.0° |
N | CAU | OBC | 120.6° | 120.0° |
N | CAU | CAT | 120.0° | 120.0° |
CAU | N | H | 118.5° | 120.0° |
N | CA | HA | 110.8° | 109.5° |
CA | N | H | 118.5° | 120.0° |
OBC | CAU | CAT | 119.3° | 120.0° |
CAU | CAT | CAQ | 120.8° | 120.1° |
CAU | CAT | CAS | 121.4° | 120.1° |
CAQ | CAT | CAS | 117.7° | 119.8° |
CAT | CAQ | CAO | 119.8° | 120.0° |
CAT | CAQ | HAQ | 120.1° | 120.0° |
CAT | CAS | CAR | 121.9° | 119.8° |
CAT | CAS | HAS | 119.0° | 120.1° |
CAQ | CAO | CAP | 119.3° | 120.3° |
CAO | CAQ | HAQ | 120.1° | 120.0° |
CAQ | CAO | HAO | 120.4° | 119.8° |
CAS | CAR | CAP | 120.9° | 120.0° |
CAS | CAR | NAY | 118.6° | 120.0° |
CAR | CAS | HAS | 119.1° | 120.1° |
CAP | CAR | NAY | 120.5° | 120.0° |
CAR | CAP | CAO | 119.7° | 120.2° |
CAR | CAP | HAP | 120.1° | 119.9° |
CAR | NAY | CAN | 122.6° | 120.0° |
CAR | NAY | HAY | 105.3° | 120.0° |
CAP | CAO | HAO | 120.3° | 119.9° |
CAO | CAP | HAP | 120.2° | 119.9° |
CAC | CAA | CAB | 120.1° | 120.4° |
CAC | CAA | CAN | 119.9° | 119.8° |
CAA | CAC | CAE | 119.8° | 120.2° |
CAA | CAC | HAC | 120.1° | 119.9° |
CAB | CAA | CAN | 120.0° | 119.8° |
CAA | CAB | CAG | 120.0° | 120.2° |
CAA | CAB | HAB | 120.0° | 120.0° |
CAA | CAN | NAY | 115.1° | 109.4° |
CAA | CAN | HAN1 | 107.7° | 109.5° |
CAA | CAN | HAN2 | 106.3° | 109.4° |
CAC | CAE | CAF | 121.0° | 119.9° |
CAE | CAC | HAC | 120.1° | 119.9° |
CAC | CAE | HAE | 119.5° | 120.1° |
CAE | CAF | CAG | 118.6° | 119.6° |
CAE | CAF | CAH | 118.0° | 120.3° |
CAF | CAE | HAE | 119.5° | 120.0° |
CAB | CAG | CAF | 120.5° | 119.8° |
CAG | CAB | HAB | 120.0° | 119.9° |
CAB | CAG | HAG | 119.8° | 120.1° |
CAG | CAF | CAH | 123.4° | 120.2° |
CAF | CAG | HAG | 119.8° | 120.1° |
CAF | CAH | CAI | 128.7° | 120.0° |
CAF | CAH | HAH | 115.7° | 120.0° |
CAH | CAI | SBG | 128.9° | 128.0° |
CAH | CAI | CAK | 121.6° | 128.0° |
CAI | CAH | HAH | 115.6° | 120.0° |
SBG | CAI | CAK | 109.4° | 104.0° |
CAI | SBG | CAL | 87.8° | 94.6° |
CAI | CAK | NAX | 115.9° | 114.9° |
CAI | CAK | OBE | 122.0° | 122.5° |
SBG | CAL | SBH | 118.0° | 126.5° |
SBG | CAL | NAX | 119.0° | 106.9° |
SBH | CAL | NAX | 122.9° | 126.5° |
CAL | NAX | CAK | 107.9° | 119.5° |
CAL | NAX | HAX | 126.1° | 120.2° |
NAX | CAK | OBE | 122.1° | 122.5° |
CAK | NAX | HAX | 126.1° | 120.3° |
CAN | NAY | HAY | 105.3° | 120.1° |
NAY | CAN | HAN1 | 107.6° | 109.5° |
NAY | CAN | HAN2 | 106.4° | 109.5° |
HG1C | CG | HG2C | 112.4° | 109.5° |
HB1C | CB | HB2C | 111.3° | 109.5° |
HAN1 | CAN | HAN2 | 114.0° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OE1 | CD | OE2 | CG | 177.5° | 179.7° |
OE1 | CD | CG | CB | 62.9° | 179.7° |
OE1 | CD | CG | HG1C | 177.0° | 60.3° |
OE1 | CD | CG | HG2C | 55.4° | 59.8° |
OE2 | CD | CG | CB | 119.5° | 0.0° |
OE2 | CD | OE1 | HE1 | 0.0° | 0.0° |
OE2 | CD | CG | HG1C | 0.5° | 120.0° |
OE2 | CD | CG | HG2C | 122.1° | 119.9° |
CD | CG | CB | HG1C | 120.0° | 120.0° |
CD | CG | CB | HG2C | 118.4° | 120.0° |
CD | CG | CB | CA | 166.1° | 180.0° |
CG | CD | OE1 | HE1 | 177.4° | 179.7° |
CD | CG | HG1C | HG2C | 118.4° | 120.0° |
CD | CG | CB | HB1C | 46.1° | 60.0° |
CD | CG | CB | HB2C | 74.9° | 60.0° |
CG | CB | CA | HB1C | 120.0° | 119.9° |
CG | CB | CA | HB2C | 119.0° | 120.0° |
CG | CB | CA | C | 177.6° | 175.0° |
CG | CB | CA | N | 63.3° | 65.0° |
CB | CG | HG1C | HG2C | 118.5° | 119.9° |
CG | CB | HB1C | HB2C | 119.1° | 120.0° |
CG | CB | CA | HA | 57.9° | 55.0° |
CB | CA | C | OXT | 69.1° | 60.0° |
CB | CA | C | O | 109.6° | 120.0° |
CB | CA | C | N | 117.3° | 120.1° |
CB | CA | C | HA | 121.5° | 120.0° |
CB | CA | N | CAU | 150.6° | 155.0° |
CB | CA | N | HA | 121.4° | 120.1° |
CA | CB | CG | HG1C | 73.9° | 60.0° |
CA | CB | CG | HG2C | 47.7° | 60.0° |
CA | CB | HB1C | HB2C | 119.0° | 120.1° |
CB | CA | N | H | 29.4° | 25.0° |
OXT | C | O | CA | 178.6° | 180.0° |
OXT | C | CA | N | 48.2° | 180.0° |
OXT | C | CA | HA | 169.4° | 60.1° |
O | C | CA | N | 133.1° | 0.0° |
O | C | CA | HA | 11.9° | 120.0° |
O | C | OXT | HXT | 0.0° | 0.0° |
C | CA | N | CAU | 90.6° | 85.0° |
C | CA | N | HA | 119.8° | 119.9° |
C | CA | CB | HB1C | 62.4° | 65.1° |
C | CA | CB | HB2C | 58.6° | 55.0° |
CA | C | OXT | HXT | 178.5° | 179.9° |
C | CA | N | H | 89.5° | 95.0° |
CAU | N | CA | H | 180.0° | 180.0° |
N | CAU | OBC | CAT | 176.6° | 179.9° |
N | CAU | CAT | CAQ | 151.9° | 0.0° |
N | CAU | CAT | CAS | 27.2° | 179.7° |
CAU | N | CA | HA | 29.2° | 35.0° |
CA | N | CAU | OBC | 13.6° | 0.0° |
CA | N | CAU | CAT | 163.0° | 180.0° |
N | CA | CB | HB1C | 56.7° | 54.9° |
N | CA | CB | HB2C | 177.7° | 175.0° |
OBC | CAU | CAT | CAQ | 24.7° | 180.0° |
OBC | CAU | CAT | CAS | 156.1° | 0.2° |
OBC | CAU | N | H | 166.4° | 180.0° |
CAU | CAT | CAQ | CAS | 179.2° | 179.7° |
CAU | CAT | CAQ | CAO | 173.0° | 180.0° |
CAU | CAT | CAS | CAR | 174.1° | 180.0° |
CAT | CAU | N | H | 17.0° | 0.0° |
CAU | CAT | CAQ | HAQ | 7.0° | 0.0° |
CAU | CAT | CAS | HAS | 5.9° | 0.0° |
CAT | CAQ | CAO | HAQ | 180.0° | 179.9° |
CAQ | CAT | CAS | CAR | 5.1° | 0.3° |
CAT | CAQ | CAO | CAP | 7.7° | 0.1° |
CAQ | CAT | CAS | HAS | 175.0° | 179.8° |
CAT | CAQ | CAO | HAO | 172.3° | 180.0° |
CAS | CAT | CAQ | CAO | 6.1° | 0.3° |
CAT | CAS | CAR | HAS | 180.0° | 180.0° |
CAT | CAS | CAR | CAP | 5.6° | 0.0° |
CAT | CAS | CAR | NAY | 173.8° | 180.0° |
CAS | CAT | CAQ | HAQ | 173.9° | 179.8° |
CAQ | CAO | CAP | CAR | 8.1° | 0.2° |
CAQ | CAO | CAP | HAO | 180.0° | 179.9° |
CAQ | CAO | CAP | HAP | 171.9° | 179.9° |
CAS | CAR | CAP | NAY | 179.5° | 179.9° |
CAS | CAR | CAP | CAO | 7.0° | 0.3° |
CAS | CAR | NAY | CAN | 156.8° | 180.0° |
CAS | CAR | CAP | HAP | 173.0° | 180.0° |
CAS | CAR | NAY | HAY | 36.8° | 0.0° |
CAR | CAP | CAO | HAP | 180.0° | 179.7° |
CAP | CAR | NAY | CAN | 23.7° | 0.0° |
CAP | CAR | CAS | HAS | 174.4° | 179.9° |
CAR | CAP | CAO | HAO | 171.9° | 179.7° |
CAP | CAR | NAY | HAY | 143.7° | 180.0° |
NAY | CAR | CAP | CAO | 172.4° | 179.8° |
CAR | NAY | CAN | CAA | 52.0° | 180.0° |
CAR | NAY | CAN | HAY | 120.0° | 180.0° |
NAY | CAR | CAS | HAS | 6.2° | 0.0° |
NAY | CAR | CAP | HAP | 7.5° | 0.1° |
CAR | NAY | CAN | HAN1 | 68.1° | 60.1° |
CAR | NAY | CAN | HAN2 | 169.4° | 60.0° |
CAP | CAO | CAQ | HAQ | 172.3° | 180.0° |
CAC | CAA | CAB | CAN | 179.7° | 179.7° |
CAA | CAC | CAE | HAC | 180.0° | 180.0° |
CAA | CAC | CAE | CAF | 1.8° | 0.0° |
CAC | CAA | CAB | CAG | 1.0° | 0.0° |
CAC | CAA | CAN | NAY | 49.2° | 90.0° |
CAC | CAA | CAB | HAB | 179.0° | 180.0° |
CAC | CAA | CAN | HAN1 | 169.2° | 150.0° |
CAC | CAA | CAN | HAN2 | 68.3° | 30.0° |
CAA | CAC | CAE | HAE | 178.2° | 179.9° |
CAB | CAA | CAC | CAE | 1.4° | 0.0° |
CAA | CAB | CAG | HAB | 180.0° | 180.0° |
CAA | CAB | CAG | CAF | 0.9° | 0.0° |
CAB | CAA | CAN | NAY | 130.6° | 90.3° |
CAB | CAA | CAC | HAC | 178.6° | 180.0° |
CAB | CAA | CAN | HAN1 | 10.6° | 29.7° |
CAB | CAA | CAN | HAN2 | 112.0° | 149.7° |
CAA | CAB | CAG | HAG | 179.1° | 180.0° |
CAN | CAA | CAC | CAE | 178.3° | 179.7° |
CAN | CAA | CAB | CAG | 178.8° | 179.7° |
CAA | CAN | NAY | HAN1 | 120.0° | 120.0° |
CAA | CAN | NAY | HAN2 | 117.5° | 120.0° |
CAA | CAN | NAY | HAY | 68.0° | 0.0° |
CAN | CAA | CAC | HAC | 1.7° | 0.3° |
CAN | CAA | CAB | HAB | 1.2° | 0.3° |
CAA | CAN | HAN1 | HAN2 | 117.7° | 119.9° |
CAC | CAE | CAF | HAE | 180.0° | 179.9° |
CAC | CAE | CAF | CAG | 1.7° | 0.1° |
CAC | CAE | CAF | CAH | 179.7° | 180.0° |
CAE | CAF | CAG | CAB | 1.2° | 0.0° |
CAE | CAF | CAG | CAH | 177.9° | 180.0° |
CAE | CAF | CAH | CAI | 173.1° | 21.1° |
CAF | CAE | CAC | HAC | 178.2° | 180.0° |
CAE | CAF | CAG | HAG | 178.7° | 180.0° |
CAE | CAF | CAH | HAH | 6.9° | 158.9° |
CAB | CAG | CAF | HAG | 180.0° | 180.0° |
CAB | CAG | CAF | CAH | 179.2° | 180.0° |
CAG | CAF | CAH | CAI | 9.0° | 158.9° |
CAF | CAG | CAB | HAB | 179.1° | 180.0° |
CAG | CAF | CAE | HAE | 178.3° | 180.0° |
CAG | CAF | CAH | HAH | 171.1° | 21.1° |
CAF | CAH | CAI | HAH | 180.0° | 180.0° |
CAF | CAH | CAI | SBG | 4.0° | 7.6° |
CAF | CAH | CAI | CAK | 174.8° | 172.7° |
CAH | CAF | CAE | HAE | 0.2° | 0.1° |
CAH | CAF | CAG | HAG | 0.8° | 0.0° |
CAH | CAI | SBG | CAK | 179.0° | 179.8° |
CAH | CAI | SBG | CAL | 177.8° | 180.0° |
CAH | CAI | CAK | NAX | 179.0° | 179.8° |
CAH | CAI | CAK | OBE | 1.9° | 0.0° |
CAI | SBG | CAL | SBH | 179.2° | 180.0° |
CAI | SBG | CAL | NAX | 2.2° | 0.0° |
SBG | CAI | CAK | NAX | 0.0° | 0.4° |
SBG | CAI | CAK | OBE | 179.1° | 179.8° |
SBG | CAI | CAH | HAH | 176.0° | 172.4° |
CAK | CAI | SBG | CAL | 1.1° | 0.2° |
CAI | CAK | NAX | CAL | 1.5° | 0.5° |
CAI | CAK | NAX | OBE | 179.1° | 179.8° |
CAK | CAI | CAH | HAH | 5.2° | 7.3° |
CAI | CAK | NAX | HAX | 178.5° | 179.8° |
SBG | CAL | SBH | NAX | 176.8° | 179.9° |
SBG | CAL | NAX | CAK | 2.5° | 0.3° |
SBG | CAL | NAX | HAX | 177.4° | 180.0° |
SBH | CAL | NAX | CAK | 179.3° | 179.7° |
SBH | CAL | NAX | HAX | 0.6° | 0.1° |
CAL | NAX | CAK | HAX | 180.0° | 179.7° |
CAL | NAX | CAK | OBE | 179.4° | 179.7° |
OBE | CAK | NAX | HAX | 0.6° | 0.0° |
NAY | CAN | HAN1 | HAN2 | 117.7° | 120.1° |
HG1C | CG | CB | HB1C | 166.1° | 179.9° |
HG1C | CG | CB | HB2C | 45.1° | 60.0° |
HG2C | CG | CB | HB1C | 72.2° | 59.9° |
HG2C | CG | CB | HB2C | 166.8° | 180.0° |
HB1C | CB | CA | HA | 177.9° | 175.0° |
HB2C | CB | CA | HA | 61.2° | 64.9° |
HA | CA | N | H | 150.8° | 145.0° |
HAQ | CAQ | CAO | HAO | 7.7° | 0.1° |
HAO | CAO | CAP | HAP | 8.1° | 0.0° |
HAY | NAY | CAN | HAN1 | 171.9° | 120.0° |
HAY | NAY | CAN | HAN2 | 49.4° | 120.0° |
HAC | CAC | CAE | HAE | 1.8° | 0.1° |
HAB | CAB | CAG | HAG | 0.9° | 0.0° |