8EP
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OAC | CAN | sing | 1.34Å | 1.26Å | |
CAN | OAE | doub | 1.21Å | 1.25Å | |
CAN | CAT | sing | 1.51Å | 1.51Å | |
CAT | CB | sing | 1.53Å | 1.53Å | |
CAT | OAL | sing | 1.44Å | 1.43Å | |
CAT | CAJ | sing | 1.54Å | 1.53Å | |
CB | CA | sing | 1.53Å | 1.53Å | |
CA | N | sing | 1.47Å | 1.46Å | |
CA | C | sing | 1.51Å | 1.50Å | |
C | OXT | doub | 1.21Å | 1.25Å | |
C | O | sing | 1.34Å | 1.25Å | |
OAL | CAS | sing | 1.43Å | 1.41Å | |
CAS | CAQ | sing | 1.52Å | 1.53Å | |
CAS | CAR | sing | 1.54Å | 1.52Å | |
CAQ | OAG | sing | 1.43Å | 1.42Å | |
CAQ | CAP | sing | 1.53Å | 1.52Å | |
CAP | OAF | sing | 1.43Å | 1.43Å | |
CAP | CAH | sing | 1.53Å | 1.52Å | |
CAH | OAK | sing | 1.42Å | 1.43Å | |
OAK | CAR | sing | 1.43Å | 1.43Å | |
CAR | CAJ | sing | 1.56Å | 1.52Å | |
OAC | HOAC | sing | 0.97Å | 0.95Å | |
CB | HB | sing | 1.09Å | 1.10Å | |
CB | HBA | sing | 1.09Å | 1.10Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
N | HN | sing | 1.01Å | 1.00Å | |
N | HNA | sing | 1.01Å | 1.00Å | |
O | HO | sing | 0.97Å | 0.95Å | |
CAS | HAS | sing | 1.09Å | 1.10Å | |
CAQ | HAQ | sing | 1.09Å | 1.10Å | |
OAG | HOAG | sing | 0.97Å | 0.95Å | |
CAP | HAP | sing | 1.09Å | 1.10Å | |
OAF | HOAF | sing | 0.97Å | 0.95Å | |
CAH | HAH | sing | 1.09Å | 1.10Å | |
CAH | HAHA | sing | 1.09Å | 1.10Å | |
CAR | HAR | sing | 1.09Å | 1.10Å | |
CAJ | HAJ | sing | 1.09Å | 1.10Å | |
CAJ | HAJA | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OAC | CAN | OAE | 122.3° | 120.0° |
OAC | CAN | CAT | 118.4° | 120.0° |
CAN | OAC | HOAC | 109.5° | 117.0° |
OAE | CAN | CAT | 119.3° | 120.0° |
CAN | CAT | CB | 112.9° | 109.8° |
CAN | CAT | OAL | 108.5° | 109.8° |
CAN | CAT | CAJ | 108.3° | 109.9° |
CB | CAT | OAL | 110.3° | 109.8° |
CB | CAT | CAJ | 111.0° | 109.9° |
CAT | CB | CA | 113.7° | 109.5° |
CAT | CB | HB | 108.1° | 109.5° |
CAT | CB | HBA | 107.1° | 109.5° |
OAL | CAT | CAJ | 105.5° | 107.6° |
CAT | OAL | CAS | 110.8° | 109.3° |
CAT | CAJ | CAR | 105.0° | 102.0° |
CAT | CAJ | HAJ | 111.0° | 110.9° |
CAT | CAJ | HAJA | 111.9° | 110.9° |
CB | CA | N | 112.1° | 109.4° |
CB | CA | C | 108.1° | 109.5° |
CA | CB | HB | 108.1° | 109.4° |
CA | CB | HBA | 107.1° | 109.5° |
CB | CA | HA | 108.8° | 109.5° |
N | CA | C | 110.0° | 109.5° |
N | CA | HA | 106.8° | 109.4° |
CA | N | HN | 109.5° | 111.0° |
CA | N | HNA | 109.5° | 111.0° |
CA | C | OXT | 117.0° | 120.0° |
CA | C | O | 119.4° | 120.0° |
C | CA | HA | 111.0° | 109.5° |
OXT | C | O | 123.5° | 120.0° |
C | O | HO | 109.5° | 116.9° |
OAL | CAS | CAQ | 107.2° | 112.5° |
OAL | CAS | CAR | 104.3° | 106.0° |
OAL | CAS | HAS | 116.8° | 109.0° |
CAQ | CAS | CAR | 116.4° | 112.1° |
CAS | CAQ | OAG | 108.1° | 109.2° |
CAS | CAQ | CAP | 112.1° | 110.5° |
CAQ | CAS | HAS | 104.9° | 109.0° |
CAS | CAQ | HAQ | 108.2° | 109.3° |
CAS | CAR | OAK | 112.0° | 110.5° |
CAS | CAR | CAJ | 102.2° | 100.1° |
CAR | CAS | HAS | 107.7° | 108.1° |
CAS | CAR | HAR | 111.9° | 112.7° |
OAG | CAQ | CAP | 108.1° | 109.3° |
OAG | CAQ | HAQ | 112.2° | 109.3° |
CAQ | OAG | HOAG | 109.5° | 113.9° |
CAQ | CAP | OAF | 108.6° | 109.7° |
CAQ | CAP | CAH | 110.0° | 108.2° |
CAP | CAQ | HAQ | 108.3° | 109.3° |
CAQ | CAP | HAP | 109.7° | 109.7° |
OAF | CAP | CAH | 109.4° | 109.7° |
OAF | CAP | HAP | 110.3° | 109.7° |
CAP | OAF | HOAF | 109.5° | 114.0° |
CAP | CAH | OAK | 108.4° | 108.6° |
CAH | CAP | HAP | 108.9° | 109.8° |
CAP | CAH | HAH | 109.9° | 109.6° |
CAP | CAH | HAHA | 110.1° | 109.6° |
CAH | OAK | CAR | 113.8° | 115.6° |
OAK | CAH | HAH | 109.8° | 109.6° |
OAK | CAH | HAHA | 110.1° | 109.6° |
OAK | CAR | CAJ | 107.2° | 106.6° |
OAK | CAR | HAR | 107.2° | 112.5° |
CAJ | CAR | HAR | 116.3° | 113.6° |
CAR | CAJ | HAJ | 111.0° | 111.0° |
CAR | CAJ | HAJA | 111.9° | 111.0° |
HB | CB | HBA | 112.8° | 109.4° |
HN | N | HNA | 109.4° | 111.0° |
HAH | CAH | HAHA | 108.6° | 109.8° |
HAJ | CAJ | HAJA | 106.1° | 110.8° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OAC | CAN | OAE | CAT | 179.1° | 180.0° |
OAC | CAN | CAT | CB | 143.5° | 84.3° |
OAC | CAN | CAT | OAL | 20.9° | 36.6° |
OAC | CAN | CAT | CAJ | 93.1° | 154.7° |
OAE | CAN | CAT | CB | 37.4° | 95.7° |
OAE | CAN | CAT | OAL | 160.0° | 143.4° |
OAE | CAN | CAT | CAJ | 86.0° | 25.2° |
OAE | CAN | OAC | HOAC | 0.0° | 0.0° |
CAN | CAT | CB | OAL | 121.5° | 120.9° |
CAN | CAT | CB | CAJ | 121.9° | 121.0° |
CAN | CAT | OAL | CAJ | 115.9° | 119.5° |
CAN | CAT | CB | CA | 57.8° | 54.3° |
CAN | CAT | OAL | CAS | 129.1° | 121.4° |
CAN | CAT | CAJ | CAR | 106.3° | 97.7° |
CAT | CAN | OAC | HOAC | 179.1° | 179.9° |
CAN | CAT | CB | HB | 62.2° | 65.7° |
CAN | CAT | CB | HBA | 176.0° | 174.3° |
CAN | CAT | CAJ | HAJ | 133.7° | 144.1° |
CAN | CAT | CAJ | HAJA | 15.4° | 20.5° |
CB | CAT | OAL | CAJ | 120.0° | 119.6° |
CAT | CB | CA | HB | 120.0° | 120.0° |
CAT | CB | CA | HBA | 118.1° | 120.1° |
CAT | CB | CA | N | 77.1° | 65.0° |
CAT | CB | CA | C | 161.4° | 175.0° |
CB | CAT | OAL | CAS | 106.8° | 117.7° |
CB | CAT | CAJ | CAR | 129.3° | 141.3° |
CAT | CB | HB | HBA | 118.3° | 120.0° |
CAT | CB | CA | HA | 40.8° | 54.9° |
CB | CAT | CAJ | HAJ | 9.2° | 23.1° |
CB | CAT | CAJ | HAJA | 109.1° | 100.4° |
OAL | CAT | CB | CA | 63.7° | 66.6° |
CAT | OAL | CAS | CAQ | 154.8° | 148.3° |
CAT | OAL | CAS | CAR | 30.7° | 25.5° |
OAL | CAT | CAJ | CAR | 9.7° | 21.8° |
OAL | CAT | CB | HB | 176.3° | 173.4° |
OAL | CAT | CB | HBA | 54.4° | 53.4° |
CAT | OAL | CAS | HAS | 88.0° | 90.7° |
OAL | CAT | CAJ | HAJ | 110.3° | 96.4° |
OAL | CAT | CAJ | HAJA | 131.4° | 140.1° |
CAJ | CAT | CB | CA | 179.7° | 175.2° |
CAJ | CAT | OAL | CAS | 13.2° | 1.8° |
CAT | CAJ | CAR | CAS | 26.8° | 34.8° |
CAT | CAJ | CAR | OAK | 91.2° | 80.2° |
CAT | CAJ | CAR | HAJ | 120.0° | 118.1° |
CAT | CAJ | CAR | HAJA | 121.7° | 118.2° |
CAJ | CAT | CB | HB | 59.7° | 55.2° |
CAJ | CAT | CB | HBA | 62.1° | 64.7° |
CAT | CAJ | CAR | HAR | 148.9° | 155.3° |
CAT | CAJ | HAJ | HAJA | 121.8° | 123.6° |
CB | CA | N | C | 120.3° | 120.0° |
CB | CA | N | HA | 119.1° | 120.0° |
CB | CA | C | HA | 119.2° | 120.0° |
CB | CA | C | OXT | 55.4° | 100.0° |
CB | CA | C | O | 125.8° | 80.0° |
CA | CB | HB | HBA | 118.3° | 119.9° |
CB | CA | N | HN | 18.0° | 60.0° |
CB | CA | N | HNA | 102.0° | 63.9° |
N | CA | C | HA | 118.0° | 120.0° |
N | CA | C | OXT | 178.2° | 19.9° |
N | CA | C | O | 3.1° | 160.0° |
N | CA | CB | HB | 162.9° | 175.0° |
N | CA | CB | HBA | 41.0° | 55.1° |
CA | N | HN | HNA | 120.0° | 123.9° |
CA | C | OXT | O | 178.7° | 179.9° |
C | CA | CB | HB | 41.4° | 55.0° |
C | CA | CB | HBA | 80.4° | 64.9° |
C | CA | N | HN | 102.3° | 60.0° |
C | CA | N | HNA | 137.7° | 176.1° |
CA | C | O | HO | 178.7° | 180.0° |
OXT | C | CA | HA | 63.8° | 139.9° |
OXT | C | O | HO | 0.0° | 0.1° |
O | C | CA | HA | 115.0° | 40.0° |
OAL | CAS | CAQ | CAR | 116.3° | 119.3° |
OAL | CAS | CAQ | HAS | 124.8° | 121.0° |
OAL | CAS | CAR | HAS | 124.8° | 116.7° |
OAL | CAS | CAQ | OAG | 161.5° | 171.6° |
OAL | CAS | CAQ | CAP | 79.5° | 68.1° |
OAL | CAS | CAR | OAK | 79.6° | 74.5° |
OAL | CAS | CAR | CAJ | 34.9° | 37.7° |
OAL | CAS | CAQ | HAQ | 39.8° | 52.1° |
OAL | CAS | CAR | HAR | 160.0° | 158.7° |
CAQ | CAS | CAR | HAS | 117.3° | 120.2° |
CAS | CAQ | OAG | CAP | 121.5° | 121.0° |
CAS | CAQ | OAG | HAQ | 119.2° | 119.5° |
CAS | CAQ | CAP | HAQ | 119.2° | 120.3° |
CAS | CAQ | CAP | OAF | 72.0° | 63.0° |
CAS | CAQ | CAP | CAH | 47.7° | 56.7° |
CAQ | CAS | CAR | OAK | 38.3° | 48.6° |
CAQ | CAS | CAR | CAJ | 152.8° | 160.8° |
CAS | CAQ | OAG | HOAG | 58.6° | 180.0° |
CAS | CAQ | CAP | HAP | 167.5° | 176.5° |
CAQ | CAS | CAR | HAR | 82.1° | 78.2° |
CAR | CAS | CAQ | OAG | 82.1° | 69.0° |
CAR | CAS | CAQ | CAP | 36.9° | 51.2° |
CAS | CAR | OAK | CAH | 53.9° | 55.9° |
CAS | CAR | OAK | CAJ | 111.3° | 107.9° |
CAS | CAR | OAK | HAR | 123.1° | 127.0° |
CAS | CAR | CAJ | HAR | 122.1° | 120.4° |
CAR | CAS | CAQ | HAQ | 156.1° | 171.5° |
CAS | CAR | CAJ | HAJ | 93.2° | 83.3° |
CAS | CAR | CAJ | HAJA | 148.5° | 153.0° |
OAG | CAQ | CAP | HAQ | 121.7° | 119.5° |
OAG | CAQ | CAP | OAF | 169.0° | 176.8° |
OAG | CAQ | CAP | CAH | 71.3° | 63.5° |
OAG | CAQ | CAS | HAS | 36.7° | 50.7° |
OAG | CAQ | CAP | HAP | 48.4° | 56.2° |
CAQ | CAP | OAF | CAH | 120.1° | 118.8° |
CAQ | CAP | OAF | HAP | 120.2° | 120.6° |
CAQ | CAP | CAH | HAP | 120.2° | 119.7° |
CAQ | CAP | CAH | OAK | 62.2° | 60.7° |
CAP | CAQ | CAS | HAS | 155.7° | 170.9° |
CAP | CAQ | OAG | HOAG | 62.9° | 59.0° |
CAQ | CAP | OAF | HOAF | 58.5° | 180.0° |
CAQ | CAP | CAH | HAH | 177.8° | 179.6° |
CAQ | CAP | CAH | HAHA | 58.2° | 59.0° |
OAF | CAP | CAH | HAP | 120.6° | 120.6° |
OAF | CAP | CAH | OAK | 57.0° | 59.0° |
OAF | CAP | CAQ | HAQ | 47.3° | 57.3° |
OAF | CAP | CAH | HAH | 63.0° | 60.8° |
OAF | CAP | CAH | HAHA | 177.5° | 178.7° |
CAP | CAH | OAK | HAH | 120.0° | 119.7° |
CAP | CAH | OAK | HAHA | 120.4° | 119.7° |
CAP | CAH | OAK | CAR | 66.7° | 62.7° |
CAH | CAP | CAQ | HAQ | 167.0° | 176.9° |
CAH | CAP | OAF | HOAF | 178.6° | 61.3° |
CAP | CAH | HAH | HAHA | 120.5° | 120.4° |
CAH | OAK | CAR | CAJ | 165.2° | 163.8° |
OAK | CAH | CAP | HAP | 177.6° | 179.6° |
OAK | CAH | HAH | HAHA | 120.4° | 120.5° |
CAH | OAK | CAR | HAR | 69.2° | 71.1° |
OAK | CAR | CAJ | HAR | 119.9° | 124.5° |
OAK | CAR | CAS | HAS | 155.6° | 168.8° |
CAR | OAK | CAH | HAH | 173.3° | 177.6° |
CAR | OAK | CAH | HAHA | 53.8° | 57.0° |
OAK | CAR | CAJ | HAJ | 148.8° | 161.6° |
OAK | CAR | CAJ | HAJA | 30.5° | 37.9° |
CAJ | CAR | CAS | HAS | 89.9° | 79.0° |
CAR | CAJ | HAJ | HAJA | 121.8° | 123.8° |
HB | CB | CA | HA | 79.2° | 65.1° |
HBA | CB | CA | HA | 159.0° | 175.0° |
HA | CA | N | HN | 137.1° | 180.0° |
HA | CA | N | HNA | 17.1° | 56.0° |
HAS | CAS | CAQ | HAQ | 85.0° | 68.8° |
HAS | CAS | CAR | HAR | 35.2° | 42.0° |
HAQ | CAQ | OAG | HOAG | 177.9° | 60.5° |
HAQ | CAQ | CAP | HAP | 73.3° | 63.3° |
HAP | CAP | OAF | HOAF | 61.7° | 59.4° |
HAP | CAP | CAH | HAH | 57.6° | 59.8° |
HAP | CAP | CAH | HAHA | 62.0° | 60.7° |
HAR | CAR | CAJ | HAJ | 28.9° | 37.1° |
HAR | CAR | CAJ | HAJA | 89.4° | 86.6° |