UZ4
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O27 | C26 | doub | 1.21Å | 1.18Å | |
C26 | N25 | sing | 1.34Å | 1.38Å | |
C26 | C22 | sing | 1.51Å | 1.54Å | |
N25 | C24 | sing | 1.47Å | 1.42Å | |
C22 | C21 | sing | 1.53Å | 1.51Å | |
C22 | C23 | sing | 1.55Å | 1.56Å | |
C24 | C23 | sing | 1.55Å | 1.54Å | |
C21 | CA | sing | 1.53Å | 1.52Å | |
N | CA | sing | 1.47Å | 1.44Å | |
CA | C28 | sing | 1.53Å | 1.53Å | |
C28 | O29 | sing | 1.43Å | 1.47Å | |
C28 | C | sing | 1.51Å | 1.57Å | |
O | C | doub | 1.21Å | 1.23Å | |
N | H | sing | 1.01Å | 1.00Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
C21 | H5 | sing | 1.09Å | 1.10Å | |
C21 | H6 | sing | 1.09Å | 1.10Å | |
C22 | H7 | sing | 1.09Å | 1.10Å | |
C23 | H8 | sing | 1.09Å | 1.10Å | |
C23 | H9 | sing | 1.09Å | 1.10Å | |
C24 | H10 | sing | 1.09Å | 1.10Å | |
C24 | H11 | sing | 1.09Å | 1.10Å | |
N25 | H12 | sing | 0.97Å | 1.00Å | |
C28 | H13 | sing | 1.09Å | 1.10Å | |
O29 | H14 | sing | 0.97Å | 0.95Å | |
C | OXT | sing | 1.34Å | 1.40Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O27 | C26 | N25 | 118.8° | 124.9° |
O27 | C26 | C22 | 129.9° | 125.0° |
N25 | C26 | C22 | 111.3° | 110.1° |
C26 | N25 | C24 | 111.5° | 111.3° |
C26 | N25 | H12 | 124.2° | 124.3° |
C26 | C22 | C21 | 113.1° | 110.5° |
C26 | C22 | C23 | 100.9° | 104.2° |
C26 | C22 | H7 | 109.6° | 110.6° |
N25 | C24 | C23 | 105.7° | 105.4° |
N25 | C24 | H10 | 110.4° | 110.2° |
N25 | C24 | H11 | 110.4° | 110.3° |
C24 | N25 | H12 | 124.2° | 124.4° |
C21 | C22 | C23 | 113.4° | 110.4° |
C22 | C21 | CA | 113.4° | 109.4° |
C22 | C21 | H5 | 108.5° | 109.4° |
C22 | C21 | H6 | 108.5° | 109.5° |
C21 | C22 | H7 | 110.1° | 110.4° |
C22 | C23 | C24 | 105.4° | 101.8° |
C23 | C22 | H7 | 109.3° | 110.5° |
C22 | C23 | H8 | 110.5° | 111.0° |
C22 | C23 | H9 | 110.5° | 111.0° |
C24 | C23 | H8 | 110.5° | 111.0° |
C24 | C23 | H9 | 110.5° | 110.9° |
C23 | C24 | H10 | 110.4° | 110.3° |
C23 | C24 | H11 | 110.4° | 110.3° |
C21 | CA | N | 110.8° | 109.5° |
C21 | CA | C28 | 111.2° | 109.4° |
C21 | CA | HA | 109.2° | 109.5° |
CA | C21 | H5 | 108.5° | 109.4° |
CA | C21 | H6 | 108.5° | 109.5° |
N | CA | C28 | 106.0° | 109.5° |
CA | N | H | 109.5° | 111.0° |
CA | N | H2 | 109.5° | 111.0° |
N | CA | HA | 110.4° | 109.5° |
CA | C28 | O29 | 104.9° | 109.4° |
CA | C28 | C | 108.2° | 109.5° |
C28 | CA | HA | 109.2° | 109.4° |
CA | C28 | H13 | 112.7° | 109.5° |
O29 | C28 | C | 104.4° | 109.5° |
O29 | C28 | H13 | 113.8° | 109.5° |
C28 | O29 | H14 | 109.5° | 114.0° |
C28 | C | O | 120.9° | 120.0° |
C | C28 | H13 | 112.2° | 109.5° |
C28 | C | OXT | 116.8° | 120.0° |
O | C | OXT | 122.3° | 120.0° |
H | N | H2 | 109.5° | 111.0° |
H5 | C21 | H6 | 109.5° | 109.5° |
H8 | C23 | H9 | 109.5° | 110.9° |
H10 | C24 | H11 | 109.5° | 110.2° |
C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O27 | C26 | N25 | C22 | 178.6° | 179.9° |
O27 | C26 | N25 | C24 | 177.3° | 179.5° |
O27 | C26 | C22 | C21 | 46.4° | 45.2° |
O27 | C26 | C22 | C23 | 167.9° | 163.8° |
O27 | C26 | C22 | H7 | 76.9° | 77.4° |
O27 | C26 | N25 | H12 | 2.7° | 0.4° |
C26 | N25 | C24 | H12 | 180.0° | 179.9° |
N25 | C26 | C22 | C21 | 132.0° | 134.9° |
N25 | C26 | C22 | C23 | 10.5° | 16.3° |
C26 | N25 | C24 | C23 | 17.3° | 17.0° |
N25 | C26 | C22 | H7 | 104.7° | 102.5° |
C26 | N25 | C24 | H10 | 102.1° | 136.0° |
C26 | N25 | C24 | H11 | 136.7° | 102.0° |
C22 | C26 | N25 | C24 | 4.1° | 0.4° |
C26 | C22 | C21 | C23 | 114.2° | 114.8° |
C26 | C22 | C21 | H7 | 123.0° | 122.7° |
C26 | C22 | C23 | H7 | 115.5° | 118.9° |
C26 | C22 | C23 | C24 | 19.9° | 24.8° |
C26 | C22 | C21 | CA | 177.1° | 179.9° |
C26 | C22 | C21 | H5 | 62.4° | 60.0° |
C26 | C22 | C21 | H6 | 56.5° | 60.0° |
C26 | C22 | C23 | H8 | 99.5° | 93.3° |
C26 | C22 | C23 | H9 | 139.2° | 142.9° |
C22 | C26 | N25 | H12 | 175.9° | 179.7° |
N25 | C24 | C23 | C22 | 23.3° | 25.5° |
N25 | C24 | C23 | H10 | 119.4° | 118.9° |
N25 | C24 | C23 | H11 | 119.4° | 119.1° |
N25 | C24 | C23 | H8 | 96.1° | 92.7° |
N25 | C24 | C23 | H9 | 142.6° | 143.6° |
N25 | C24 | H10 | H11 | 121.8° | 122.0° |
C21 | C22 | C23 | H7 | 123.2° | 122.5° |
C21 | C22 | C23 | C24 | 141.2° | 143.5° |
C22 | C21 | CA | H5 | 120.6° | 119.9° |
C22 | C21 | CA | H6 | 120.6° | 120.0° |
C22 | C21 | CA | N | 60.8° | 65.4° |
C22 | C21 | CA | C28 | 178.4° | 174.6° |
C22 | C21 | CA | HA | 61.0° | 54.7° |
C22 | C21 | H5 | H6 | 118.2° | 120.0° |
C21 | C22 | C23 | H8 | 21.8° | 25.4° |
C21 | C22 | C23 | H9 | 99.5° | 98.4° |
C22 | C23 | C24 | H8 | 119.3° | 118.1° |
C22 | C23 | C24 | H9 | 119.3° | 118.1° |
C23 | C22 | C21 | CA | 68.8° | 65.3° |
C23 | C22 | C21 | H5 | 51.8° | 174.8° |
C23 | C22 | C21 | H6 | 170.7° | 54.7° |
C22 | C23 | H8 | H9 | 121.9° | 123.9° |
C22 | C23 | C24 | H10 | 96.1° | 144.4° |
C22 | C23 | C24 | H11 | 142.7° | 93.7° |
C24 | C23 | C22 | H7 | 95.6° | 94.0° |
C24 | C23 | H8 | H9 | 121.9° | 123.7° |
C23 | C24 | H10 | H11 | 121.8° | 122.0° |
C23 | C24 | N25 | H12 | 162.7° | 163.0° |
C21 | CA | N | C28 | 120.8° | 120.0° |
C21 | CA | N | HA | 121.1° | 120.0° |
C21 | CA | C28 | HA | 120.6° | 120.0° |
C21 | CA | C28 | O29 | 170.3° | 60.0° |
C21 | CA | C28 | C | 78.8° | 180.0° |
C21 | CA | N | H | 180.0° | 53.5° |
C21 | CA | N | H2 | 60.0° | 70.4° |
CA | C21 | H5 | H6 | 118.2° | 120.0° |
CA | C21 | C22 | H7 | 54.0° | 57.3° |
C21 | CA | C28 | H13 | 45.9° | 60.0° |
N | CA | C28 | HA | 118.9° | 120.0° |
N | CA | C28 | O29 | 49.8° | 60.0° |
N | CA | C28 | C | 160.8° | 60.0° |
CA | N | H | H2 | 120.0° | 124.0° |
N | CA | C21 | H5 | 178.6° | 54.5° |
N | CA | C21 | H6 | 59.8° | 174.6° |
N | CA | C28 | H13 | 74.5° | 180.0° |
CA | C28 | O29 | C | 113.7° | 120.0° |
CA | C28 | O29 | H13 | 123.7° | 120.0° |
CA | C28 | C | H13 | 125.0° | 120.0° |
CA | C28 | C | O | 70.7° | 115.0° |
C28 | CA | N | H | 59.2° | 66.5° |
C28 | CA | N | H2 | 60.8° | 169.6° |
C28 | CA | C21 | H5 | 61.0° | 65.5° |
C28 | CA | C21 | H6 | 57.9° | 54.6° |
CA | C28 | O29 | H14 | 180.0° | 60.0° |
CA | C28 | C | OXT | 110.1° | 65.1° |
O29 | C28 | C | H13 | 123.7° | 120.0° |
O29 | C28 | C | O | 178.0° | 5.0° |
O29 | C28 | CA | HA | 69.1° | 180.0° |
O29 | C28 | C | OXT | 1.2° | 175.0° |
C28 | C | O | OXT | 179.1° | 180.0° |
C | C28 | CA | HA | 41.8° | 60.0° |
C | C28 | O29 | H14 | 66.3° | 60.0° |
C28 | C | OXT | HXT | 179.2° | 180.0° |
O | C | C28 | H13 | 54.3° | 125.0° |
O | C | OXT | HXT | 0.0° | 0.0° |
H | N | CA | HA | 58.9° | 173.6° |
H2 | N | CA | HA | 178.9° | 49.6° |
HA | CA | C21 | H5 | 59.5° | 174.6° |
HA | CA | C21 | H6 | 178.4° | 65.4° |
HA | CA | C28 | H13 | 166.5° | 60.0° |
H5 | C21 | C22 | H7 | 174.6° | 62.7° |
H6 | C21 | C22 | H7 | 66.5° | 177.3° |
H7 | C22 | C23 | H8 | 145.1° | 147.9° |
H7 | C22 | C23 | H9 | 23.8° | 24.1° |
H8 | C23 | C24 | H10 | 144.5° | 26.3° |
H8 | C23 | C24 | H11 | 23.3° | 148.2° |
H9 | C23 | C24 | H10 | 23.2° | 97.4° |
H9 | C23 | C24 | H11 | 98.0° | 24.5° |
H10 | C24 | N25 | H12 | 77.9° | 44.1° |
H11 | C24 | N25 | H12 | 43.3° | 77.9° |
H13 | C28 | O29 | H14 | 56.4° | 180.0° |
H13 | C28 | C | OXT | 124.9° | 55.0° |