24O
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N | CA | sing | 1.47Å | 1.46Å | |
N | H | sing | 1.01Å | 1.00Å | |
CA | C43 | sing | 1.53Å | 1.53Å | |
CA | C92 | sing | 1.53Å | 1.54Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
C43 | O45 | sing | 1.43Å | 1.46Å | |
C43 | C47 | sing | 1.53Å | 1.54Å | |
C43 | H43 | sing | 1.09Å | 1.10Å | |
O45 | H45 | sing | 0.97Å | 0.95Å | |
C47 | C49 | sing | 1.54Å | 1.55Å | |
C47 | C55 | sing | 1.54Å | 1.55Å | |
C47 | H47 | sing | 1.09Å | 1.10Å | |
C49 | C51 | sing | 1.54Å | 1.55Å | |
C49 | C | sing | 1.51Å | 1.53Å | |
C49 | H49 | sing | 1.09Å | 1.10Å | |
C51 | C54 | sing | 1.52Å | 1.51Å | |
C51 | H511 | sing | 1.09Å | 1.10Å | |
C51 | H512 | sing | 1.09Å | 1.10Å | |
C54 | C55 | sing | 1.53Å | 1.50Å | |
C54 | O58 | doub | 1.21Å | 1.22Å | |
C55 | H551 | sing | 1.09Å | 1.10Å | |
C55 | H552 | sing | 1.09Å | 1.10Å | |
C | O | doub | 1.21Å | 1.22Å | |
C92 | C95 | sing | 1.53Å | 1.55Å | |
C92 | H921 | sing | 1.09Å | 1.10Å | |
C92 | H922 | sing | 1.09Å | 1.10Å | |
C95 | C97 | sing | 1.53Å | 1.54Å | |
C95 | C98 | sing | 1.53Å | 1.55Å | |
C95 | H95 | sing | 1.09Å | 1.10Å | |
C97 | H971 | sing | 1.09Å | 1.10Å | |
C97 | H972 | sing | 1.09Å | 1.10Å | |
C97 | H973 | sing | 1.09Å | 1.10Å | |
C98 | H981 | sing | 1.09Å | 1.10Å | |
C98 | H982 | sing | 1.09Å | 1.10Å | |
C98 | H983 | sing | 1.09Å | 1.10Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
C | OXT | sing | 1.34Å | 33.58Å | |
OXT | HXT | sing | 0.97Å | 0.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CA | N | H | 109.5° | 111.0° |
N | CA | C43 | 113.1° | 109.5° |
N | CA | C92 | 108.8° | 109.4° |
N | CA | HA | 107.6° | 109.5° |
CA | N | H2 | 109.5° | 111.0° |
H | N | H2 | 109.5° | 111.0° |
C43 | CA | C92 | 109.7° | 109.5° |
C43 | CA | HA | 106.5° | 109.5° |
CA | C43 | O45 | 111.0° | 109.5° |
CA | C43 | C47 | 111.8° | 109.5° |
CA | C43 | H43 | 107.1° | 109.5° |
C92 | CA | HA | 111.1° | 109.4° |
CA | C92 | C95 | 109.2° | 109.5° |
CA | C92 | H921 | 109.6° | 109.5° |
CA | C92 | H922 | 109.5° | 109.5° |
O45 | C43 | C47 | 110.5° | 109.4° |
O45 | C43 | H43 | 108.6° | 109.4° |
C43 | O45 | H45 | 109.5° | 114.0° |
C47 | C43 | H43 | 107.7° | 109.5° |
C43 | C47 | C49 | 106.6° | 110.2° |
C43 | C47 | C55 | 113.0° | 110.1° |
C43 | C47 | H47 | 108.8° | 110.1° |
C49 | C47 | C55 | 108.7° | 106.0° |
C49 | C47 | H47 | 113.1° | 110.1° |
C47 | C49 | C51 | 105.6° | 106.0° |
C47 | C49 | C | 108.3° | 110.2° |
C47 | C49 | H49 | 112.0° | 110.1° |
C55 | C47 | H47 | 106.7° | 110.2° |
C47 | C55 | C54 | 101.4° | 104.3° |
C47 | C55 | H551 | 112.3° | 110.5° |
C47 | C55 | H552 | 112.3° | 110.5° |
C51 | C49 | C | 107.1° | 110.2° |
C51 | C49 | H49 | 113.1° | 110.2° |
C49 | C51 | C54 | 104.1° | 104.4° |
C49 | C51 | H511 | 111.3° | 110.5° |
C49 | C51 | H512 | 111.3° | 110.5° |
C | C49 | H49 | 110.6° | 110.1° |
C49 | C | O | 118.6° | 120.0° |
C49 | C | OXT | 101.4° | 120.0° |
C54 | C51 | H511 | 111.3° | 110.5° |
C54 | C51 | H512 | 111.3° | 110.4° |
C51 | C54 | C55 | 114.6° | 103.3° |
C51 | C54 | O58 | 122.6° | 128.4° |
H511 | C51 | H512 | 107.6° | 110.5° |
C55 | C54 | O58 | 122.8° | 128.3° |
C54 | C55 | H551 | 112.3° | 110.4° |
C54 | C55 | H552 | 112.3° | 110.5° |
H551 | C55 | H552 | 106.5° | 110.5° |
O | C | OXT | 42.9° | 120.0° |
C95 | C92 | H921 | 109.6° | 109.5° |
C95 | C92 | H922 | 109.6° | 109.5° |
C92 | C95 | C97 | 109.2° | 109.5° |
C92 | C95 | C98 | 108.9° | 109.5° |
C92 | C95 | H95 | 109.7° | 109.5° |
H921 | C92 | H922 | 109.4° | 109.5° |
C97 | C95 | C98 | 108.4° | 109.4° |
C97 | C95 | H95 | 110.2° | 109.5° |
C95 | C97 | H971 | 109.5° | 109.5° |
C95 | C97 | H972 | 109.5° | 109.4° |
C95 | C97 | H973 | 109.5° | 109.5° |
C98 | C95 | H95 | 110.4° | 109.4° |
C95 | C98 | H981 | 109.5° | 109.4° |
C95 | C98 | H982 | 109.5° | 109.5° |
C95 | C98 | H983 | 109.5° | 109.5° |
H971 | C97 | H972 | 109.5° | 109.5° |
H971 | C97 | H973 | 109.4° | 109.5° |
H972 | C97 | H973 | 109.5° | 109.5° |
H981 | C98 | H982 | 109.4° | 109.4° |
H981 | C98 | H983 | 109.5° | 109.4° |
H982 | C98 | H983 | 109.5° | 109.5° |
C | OXT | HXT | 90.0° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CA | N | H | H2 | 120.0° | 124.0° |
N | CA | C43 | C92 | 121.6° | 120.0° |
N | CA | C43 | HA | 118.0° | 120.0° |
N | CA | C92 | HA | 118.2° | 119.9° |
N | CA | C43 | O45 | 60.6° | 55.5° |
N | CA | C43 | C47 | 63.2° | 175.4° |
N | CA | C43 | H43 | 179.0° | 64.5° |
N | CA | C92 | C95 | 66.3° | 62.4° |
N | CA | C92 | H921 | 53.7° | 57.6° |
N | CA | C92 | H922 | 173.7° | 177.6° |
H | N | CA | C43 | 180.0° | 66.0° |
H | N | CA | C92 | 57.8° | 174.0° |
H | N | CA | HA | 62.6° | 54.1° |
C43 | CA | C92 | HA | 117.5° | 120.0° |
CA | C43 | O45 | C47 | 124.6° | 120.0° |
CA | C43 | O45 | H43 | 117.5° | 120.0° |
CA | C43 | C47 | H43 | 117.4° | 120.1° |
CA | C43 | O45 | H45 | 180.0° | 60.0° |
CA | C43 | C47 | C49 | 159.9° | 178.3° |
CA | C43 | C47 | C55 | 80.7° | 61.7° |
CA | C43 | C47 | H47 | 37.7° | 60.0° |
C43 | CA | C92 | C95 | 169.5° | 177.6° |
C43 | CA | C92 | H921 | 70.5° | 62.4° |
C43 | CA | C92 | H922 | 49.5° | 57.6° |
C43 | CA | N | H2 | 60.0° | 58.0° |
C92 | CA | C43 | O45 | 61.1° | 175.4° |
C92 | CA | C43 | C47 | 175.1° | 64.6° |
C92 | CA | C43 | H43 | 57.3° | 55.5° |
CA | C92 | C95 | H921 | 120.0° | 120.0° |
CA | C92 | C95 | H922 | 120.0° | 120.0° |
CA | C92 | H921 | H922 | 120.1° | 120.0° |
CA | C92 | C95 | C97 | 174.1° | 175.8° |
CA | C92 | C95 | C98 | 67.7° | 64.2° |
CA | C92 | C95 | H95 | 53.3° | 55.8° |
C92 | CA | N | H2 | 177.8° | 62.0° |
HA | CA | C43 | O45 | 178.6° | 64.6° |
HA | CA | C43 | C47 | 54.8° | 55.4° |
HA | CA | C43 | H43 | 63.0° | 175.5° |
HA | CA | C92 | C95 | 51.9° | 57.6° |
HA | CA | C92 | H921 | 171.9° | 177.6° |
HA | CA | C92 | H922 | 68.0° | 62.4° |
HA | CA | N | H2 | 57.4° | 178.0° |
O45 | C43 | C47 | H43 | 118.4° | 119.9° |
O45 | C43 | C47 | C49 | 75.9° | 58.3° |
O45 | C43 | C47 | C55 | 43.4° | 58.3° |
O45 | C43 | C47 | H47 | 161.8° | 180.0° |
C47 | C43 | O45 | H45 | 55.4° | 60.0° |
C43 | C47 | C49 | C55 | 122.1° | 119.2° |
C43 | C47 | C49 | H47 | 119.5° | 121.6° |
C43 | C47 | C55 | H47 | 119.6° | 121.7° |
C43 | C47 | C49 | C51 | 145.6° | 119.2° |
C43 | C47 | C49 | C | 100.0° | 121.7° |
C43 | C47 | C49 | H49 | 22.2° | 0.0° |
C43 | C47 | C55 | C54 | 141.3° | 142.9° |
C43 | C47 | C55 | H551 | 21.3° | 24.2° |
C43 | C47 | C55 | H552 | 98.7° | 98.4° |
H43 | C43 | O45 | H45 | 62.4° | 180.0° |
H43 | C43 | C47 | C49 | 42.5° | 61.6° |
H43 | C43 | C47 | C55 | 161.9° | 178.2° |
H43 | C43 | C47 | H47 | 79.8° | 60.1° |
C49 | C47 | C55 | H47 | 122.3° | 119.2° |
C47 | C49 | C51 | C | 115.2° | 119.2° |
C47 | C49 | C51 | H49 | 122.7° | 119.1° |
C47 | C49 | C | H49 | 123.0° | 121.7° |
C47 | C49 | C51 | C54 | 13.3° | 23.7° |
C47 | C49 | C51 | H511 | 106.7° | 142.4° |
C47 | C49 | C51 | H512 | 133.3° | 95.0° |
C49 | C47 | C55 | C54 | 23.1° | 23.7° |
C49 | C47 | C55 | H551 | 96.9° | 95.0° |
C49 | C47 | C55 | H552 | 143.1° | 142.4° |
C47 | C49 | C | O | 27.7° | 0.0° |
C47 | C49 | C | OXT | 69.9° | 180.0° |
C55 | C47 | C49 | C51 | 23.4° | 0.0° |
C55 | C47 | C49 | C | 137.9° | 119.2° |
C55 | C47 | C49 | H49 | 100.0° | 119.2° |
C47 | C55 | C54 | C51 | 15.1° | 38.5° |
C47 | C55 | C54 | H551 | 120.0° | 118.7° |
C47 | C55 | C54 | H552 | 120.0° | 118.7° |
C47 | C55 | C54 | O58 | 164.7° | 141.4° |
C47 | C55 | H551 | H552 | 123.3° | 122.6° |
H47 | C47 | C49 | C51 | 94.9° | 119.2° |
H47 | C47 | C49 | C | 19.5° | 0.0° |
H47 | C47 | C49 | H49 | 141.7° | 121.6° |
H47 | C47 | C55 | C54 | 99.2° | 95.5° |
H47 | C47 | C55 | H551 | 140.8° | 145.9° |
H47 | C47 | C55 | H552 | 20.8° | 23.3° |
C51 | C49 | C | H49 | 123.6° | 121.7° |
C49 | C51 | C54 | H511 | 120.0° | 118.7° |
C49 | C51 | C54 | H512 | 120.0° | 118.7° |
C49 | C51 | H511 | H512 | 122.2° | 122.6° |
C49 | C51 | C54 | C55 | 1.3° | 38.5° |
C49 | C51 | C54 | O58 | 178.4° | 141.4° |
C51 | C49 | C | O | 85.7° | 116.6° |
C51 | C49 | C | OXT | 43.5° | 63.3° |
C | C49 | C51 | C54 | 128.5° | 95.5° |
C | C49 | C51 | H511 | 8.6° | 23.3° |
C | C49 | C51 | H512 | 111.4° | 145.9° |
C49 | C | O | OXT | 75.2° | 179.9° |
C49 | C | OXT | HXT | 90.0° | 180.0° |
H49 | C49 | C51 | C54 | 109.4° | 142.9° |
H49 | C49 | C51 | H511 | 130.6° | 98.4° |
H49 | C49 | C51 | H512 | 10.6° | 24.2° |
H49 | C49 | C | O | 150.7° | 121.7° |
H49 | C49 | C | OXT | 167.1° | 58.4° |
C54 | C51 | H511 | H512 | 122.2° | 122.5° |
C51 | C54 | C55 | O58 | 179.7° | 179.9° |
C51 | C54 | C55 | H551 | 105.0° | 80.2° |
C51 | C54 | C55 | H552 | 135.1° | 157.2° |
H511 | C51 | C54 | C55 | 121.3° | 157.2° |
H511 | C51 | C54 | O58 | 58.5° | 22.7° |
H512 | C51 | C54 | C55 | 118.7° | 80.2° |
H512 | C51 | C54 | O58 | 61.5° | 99.9° |
C54 | C55 | H551 | H552 | 123.2° | 122.5° |
O58 | C54 | C55 | H551 | 75.3° | 99.9° |
O58 | C54 | C55 | H552 | 44.6° | 22.7° |
O | C | OXT | HXT | 90.0° | 0.1° |
C95 | C92 | H921 | H922 | 120.1° | 120.0° |
C92 | C95 | C97 | C98 | 118.5° | 120.0° |
C92 | C95 | C97 | H95 | 120.5° | 120.1° |
C92 | C95 | C98 | H95 | 120.5° | 120.1° |
C92 | C95 | C97 | H971 | 180.0° | 64.7° |
C92 | C95 | C97 | H972 | 60.0° | 175.3° |
C92 | C95 | C97 | H973 | 60.0° | 55.3° |
C92 | C95 | C98 | H981 | 180.0° | 60.0° |
C92 | C95 | C98 | H982 | 60.0° | 180.0° |
C92 | C95 | C98 | H983 | 60.0° | 59.9° |
H921 | C92 | C95 | C97 | 54.1° | 55.8° |
H921 | C92 | C95 | C98 | 172.3° | 175.8° |
H921 | C92 | C95 | H95 | 66.7° | 64.2° |
H922 | C92 | C95 | C97 | 65.9° | 64.2° |
H922 | C92 | C95 | C98 | 52.2° | 55.7° |
H922 | C92 | C95 | H95 | 173.2° | 175.8° |
C97 | C95 | C98 | H95 | 120.8° | 119.9° |
C95 | C97 | H971 | H972 | 120.0° | 120.0° |
C95 | C97 | H971 | H973 | 120.0° | 120.0° |
C95 | C97 | H972 | H973 | 120.0° | 120.0° |
C97 | C95 | C98 | H981 | 61.3° | 180.0° |
C97 | C95 | C98 | H982 | 58.7° | 60.0° |
C97 | C95 | C98 | H983 | 178.7° | 60.0° |
C98 | C95 | C97 | H971 | 61.5° | 55.3° |
C98 | C95 | C97 | H972 | 178.5° | 64.7° |
C98 | C95 | C97 | H973 | 58.5° | 175.3° |
C95 | C98 | H981 | H982 | 120.0° | 120.0° |
C95 | C98 | H981 | H983 | 120.0° | 120.0° |
C95 | C98 | H982 | H983 | 120.0° | 120.1° |
H95 | C95 | C97 | H971 | 59.5° | 175.2° |
H95 | C95 | C97 | H972 | 60.5° | 55.2° |
H95 | C95 | C97 | H973 | 179.5° | 64.8° |
H95 | C95 | C98 | H981 | 59.5° | 60.0° |
H95 | C95 | C98 | H982 | 179.4° | 59.9° |
H95 | C95 | C98 | H983 | 60.5° | 180.0° |
H971 | C97 | H972 | H973 | 120.0° | 120.0° |
H981 | C98 | H982 | H983 | 120.0° | 119.9° |