GT9
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 | 1.02Å | |
| N | H2 | sing | 1.01Å | 1.02Å | |
| CA | CB | sing | 1.53Å | 1.54Å | |
| CA | C | sing | 1.51Å | 1.53Å | |
| CA | HA | sing | 1.09Å | 1.12Å | |
| CB | SG | sing | 1.81Å | 1.79Å | |
| CB | HB2 | sing | 1.09Å | 1.12Å | |
| CB | HB3 | sing | 1.09Å | 1.12Å | |
| SG | C1 | sing | 1.81Å | 1.81Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| C | OXT | sing | 1.34Å | 1.33Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C1 | H11 | sing | 1.09Å | 1.12Å | |
| C1 | H12 | sing | 1.09Å | 1.11Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | H21 | sing | 1.09Å | 1.12Å | |
| C2 | H22 | sing | 1.09Å | 1.12Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C3 | H31 | sing | 1.09Å | 1.11Å | |
| C3 | H32 | sing | 1.09Å | 1.11Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | H41 | sing | 1.09Å | 1.11Å | |
| C4 | H42 | sing | 1.09Å | 1.12Å | |
| C5 | C6 | sing | 1.53Å | 1.54Å | |
| C5 | H51 | sing | 1.09Å | 1.11Å | |
| C5 | H52 | sing | 1.09Å | 1.12Å | |
| C6 | C7 | sing | 1.53Å | 1.53Å | |
| C6 | H61 | sing | 1.09Å | 1.11Å | |
| C6 | H62 | sing | 1.09Å | 1.11Å | |
| C7 | C8 | sing | 1.53Å | 1.53Å | |
| C7 | H71 | sing | 1.09Å | 1.12Å | |
| C7 | H72 | sing | 1.09Å | 1.11Å | |
| C8 | C9 | sing | 1.53Å | 1.52Å | |
| C8 | H81 | sing | 1.09Å | 1.11Å | |
| C8 | H82 | sing | 1.09Å | 1.12Å | |
| C9 | H91 | sing | 1.09Å | 1.11Å | |
| C9 | H92 | sing | 1.09Å | 1.12Å | |
| C9 | H93 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 110.8° | 106.7° |
| CA | N | H2 | 111.7° | 106.7° |
| N | CA | CB | 110.8° | 109.5° |
| N | CA | C | 110.1° | 109.5° |
| N | CA | HA | 108.7° | 109.4° |
| H | N | H2 | 111.7° | 106.7° |
| CB | CA | C | 111.0° | 109.5° |
| CB | CA | HA | 107.7° | 109.5° |
| CA | CB | SG | 114.4° | 109.5° |
| CA | CB | HB2 | 110.4° | 109.4° |
| CA | CB | HB3 | 110.4° | 109.4° |
| C | CA | HA | 108.4° | 109.4° |
| CA | C | O | 121.2° | 120.0° |
| CA | C | OXT | 116.1° | 120.0° |
| SG | CB | HB2 | 110.4° | 109.5° |
| SG | CB | HB3 | 110.4° | 109.5° |
| CB | SG | C1 | 102.0° | 100.1° |
| HB2 | CB | HB3 | 99.8° | 109.5° |
| SG | C1 | C2 | 115.6° | 109.5° |
| SG | C1 | H11 | 110.0° | 109.5° |
| SG | C1 | H12 | 110.0° | 109.5° |
| O | C | OXT | 122.7° | 120.0° |
| C | OXT | HXT | 116.1° | 120.0° |
| C2 | C1 | H11 | 110.0° | 109.5° |
| C2 | C1 | H12 | 110.0° | 109.5° |
| C1 | C2 | C3 | 112.7° | 109.5° |
| C1 | C2 | H21 | 111.1° | 109.5° |
| C1 | C2 | H22 | 111.0° | 109.5° |
| H11 | C1 | H12 | 100.2° | 109.4° |
| C3 | C2 | H21 | 111.0° | 109.5° |
| C3 | C2 | H22 | 111.0° | 109.5° |
| C2 | C3 | C4 | 110.8° | 109.5° |
| C2 | C3 | H31 | 111.7° | 109.5° |
| C2 | C3 | H32 | 111.7° | 109.4° |
| H21 | C2 | H22 | 99.3° | 109.4° |
| C4 | C3 | H31 | 111.7° | 109.5° |
| C4 | C3 | H32 | 111.7° | 109.4° |
| C3 | C4 | C5 | 112.9° | 109.5° |
| C3 | C4 | H41 | 110.9° | 109.5° |
| C3 | C4 | H42 | 111.0° | 109.4° |
| H31 | C3 | H32 | 98.7° | 109.5° |
| C5 | C4 | H41 | 111.0° | 109.5° |
| C5 | C4 | H42 | 110.9° | 109.4° |
| C4 | C5 | C6 | 112.8° | 109.5° |
| C4 | C5 | H51 | 111.0° | 109.5° |
| C4 | C5 | H52 | 111.0° | 109.4° |
| H41 | C4 | H42 | 99.3° | 109.4° |
| C6 | C5 | H51 | 111.0° | 109.5° |
| C6 | C5 | H52 | 111.0° | 109.4° |
| C5 | C6 | C7 | 113.0° | 109.6° |
| C5 | C6 | H61 | 110.9° | 109.5° |
| C5 | C6 | H62 | 110.9° | 109.5° |
| H51 | C5 | H52 | 99.3° | 109.4° |
| C7 | C6 | H61 | 110.8° | 109.5° |
| C7 | C6 | H62 | 110.9° | 109.4° |
| C6 | C7 | C8 | 112.0° | 109.6° |
| C6 | C7 | H71 | 111.2° | 109.5° |
| C6 | C7 | H72 | 111.2° | 109.4° |
| H61 | C6 | H62 | 99.5° | 109.4° |
| C8 | C7 | H71 | 111.3° | 109.5° |
| C8 | C7 | H72 | 111.3° | 109.4° |
| C7 | C8 | C9 | 111.4° | 109.6° |
| C7 | C8 | H81 | 111.5° | 109.5° |
| C7 | C8 | H82 | 111.5° | 109.4° |
| H71 | C7 | H72 | 99.1° | 109.4° |
| C9 | C8 | H81 | 111.5° | 109.5° |
| C9 | C8 | H82 | 111.5° | 109.5° |
| C8 | C9 | H91 | 111.4° | 109.5° |
| C8 | C9 | H92 | 111.5° | 109.4° |
| C8 | C9 | H93 | 111.5° | 109.4° |
| H81 | C8 | H82 | 98.8° | 109.4° |
| H91 | C9 | H92 | 111.5° | 109.5° |
| H91 | C9 | H93 | 111.6° | 109.5° |
| H92 | C9 | H93 | 98.9° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 125.2° | 113.8° |
| N | CA | CB | C | 122.7° | 120.1° |
| N | CA | CB | HA | 118.7° | 120.0° |
| N | CA | C | HA | 118.8° | 119.9° |
| N | CA | CB | SG | 59.2° | 59.9° |
| N | CA | CB | HB2 | 175.5° | 180.0° |
| N | CA | CB | HB3 | 66.1° | 60.1° |
| N | CA | C | O | 12.4° | 30.1° |
| N | CA | C | OXT | 167.2° | 150.0° |
| H | N | CA | CB | 180.0° | 53.7° |
| H | N | CA | C | 56.8° | 173.8° |
| H | N | CA | HA | 61.8° | 66.3° |
| H2 | N | CA | CB | 54.7° | 60.0° |
| H2 | N | CA | C | 177.9° | 60.1° |
| H2 | N | CA | HA | 63.4° | 180.0° |
| CB | CA | C | HA | 118.1° | 120.0° |
| CA | CB | SG | HB2 | 125.3° | 120.0° |
| CA | CB | SG | HB3 | 125.3° | 120.0° |
| CA | CB | HB2 | HB3 | 116.3° | 119.9° |
| CA | CB | SG | C1 | 170.4° | 180.0° |
| CB | CA | C | O | 110.6° | 90.0° |
| CB | CA | C | OXT | 69.7° | 89.9° |
| C | CA | CB | SG | 63.5° | 180.0° |
| C | CA | CB | HB2 | 61.8° | 60.0° |
| C | CA | CB | HB3 | 171.2° | 60.0° |
| CA | C | O | OXT | 179.7° | 179.9° |
| CA | C | OXT | HXT | 180.0° | 179.9° |
| HA | CA | CB | SG | 177.9° | 60.0° |
| HA | CA | CB | HB2 | 56.8° | 60.0° |
| HA | CA | CB | HB3 | 52.6° | 180.0° |
| HA | CA | C | O | 131.3° | 150.0° |
| HA | CA | C | OXT | 48.4° | 30.1° |
| SG | CB | HB2 | HB3 | 116.3° | 120.0° |
| CB | SG | C1 | C2 | 68.2° | 180.0° |
| CB | SG | C1 | H11 | 57.0° | 60.0° |
| CB | SG | C1 | H12 | 166.5° | 60.0° |
| HB2 | CB | SG | C1 | 64.3° | 60.0° |
| HB3 | CB | SG | C1 | 45.1° | 60.0° |
| SG | C1 | C2 | H11 | 125.3° | 120.0° |
| SG | C1 | C2 | H12 | 125.3° | 120.0° |
| SG | C1 | H11 | H12 | 115.8° | 120.0° |
| SG | C1 | C2 | C3 | 70.4° | 180.0° |
| SG | C1 | C2 | H21 | 54.9° | 60.0° |
| SG | C1 | C2 | H22 | 164.3° | 60.0° |
| O | C | OXT | HXT | 0.4° | 0.0° |
| C2 | C1 | H11 | H12 | 115.8° | 120.0° |
| C1 | C2 | C3 | H21 | 125.3° | 120.0° |
| C1 | C2 | C3 | H22 | 125.3° | 120.0° |
| C1 | C2 | H21 | H22 | 116.9° | 120.0° |
| C1 | C2 | C3 | C4 | 177.6° | 180.0° |
| C1 | C2 | C3 | H31 | 52.4° | 59.9° |
| C1 | C2 | C3 | H32 | 57.1° | 60.0° |
| H11 | C1 | C2 | C3 | 164.3° | 60.0° |
| H11 | C1 | C2 | H21 | 70.3° | 180.0° |
| H11 | C1 | C2 | H22 | 39.1° | 60.0° |
| H12 | C1 | C2 | C3 | 54.9° | 60.0° |
| H12 | C1 | C2 | H21 | 179.8° | 60.0° |
| H12 | C1 | C2 | H22 | 70.4° | 180.0° |
| C3 | C2 | H21 | H22 | 116.9° | 120.0° |
| C2 | C3 | C4 | H31 | 125.2° | 120.0° |
| C2 | C3 | C4 | H32 | 125.3° | 119.9° |
| C2 | C3 | H31 | H32 | 117.6° | 119.9° |
| C2 | C3 | C4 | C5 | 156.0° | 180.0° |
| C2 | C3 | C4 | H41 | 30.6° | 59.9° |
| C2 | C3 | C4 | H42 | 78.8° | 60.0° |
| H21 | C2 | C3 | C4 | 57.0° | 60.0° |
| H21 | C2 | C3 | H31 | 177.7° | 180.0° |
| H21 | C2 | C3 | H32 | 68.2° | 60.0° |
| H22 | C2 | C3 | C4 | 52.4° | 60.0° |
| H22 | C2 | C3 | H31 | 72.9° | 60.1° |
| H22 | C2 | C3 | H32 | 177.7° | 180.0° |
| C4 | C3 | H31 | H32 | 117.6° | 120.0° |
| C3 | C4 | C5 | H41 | 125.3° | 120.1° |
| C3 | C4 | C5 | H42 | 125.3° | 120.0° |
| C3 | C4 | H41 | H42 | 116.8° | 119.9° |
| C3 | C4 | C5 | C6 | 64.2° | 180.0° |
| C3 | C4 | C5 | H51 | 61.1° | 59.9° |
| C3 | C4 | C5 | H52 | 170.6° | 60.0° |
| H31 | C3 | C4 | C5 | 78.8° | 59.9° |
| H31 | C3 | C4 | H41 | 155.9° | 179.9° |
| H31 | C3 | C4 | H42 | 46.5° | 60.0° |
| H32 | C3 | C4 | C5 | 30.7° | 60.1° |
| H32 | C3 | C4 | H41 | 94.6° | 60.0° |
| H32 | C3 | C4 | H42 | 156.0° | 179.9° |
| C5 | C4 | H41 | H42 | 116.8° | 120.0° |
| C4 | C5 | C6 | H51 | 125.3° | 120.1° |
| C4 | C5 | C6 | H52 | 125.2° | 120.0° |
| C4 | C5 | H51 | H52 | 116.8° | 120.0° |
| C4 | C5 | C6 | C7 | 55.7° | 180.0° |
| C4 | C5 | C6 | H61 | 69.5° | 59.9° |
| C4 | C5 | C6 | H62 | 179.1° | 60.1° |
| H41 | C4 | C5 | C6 | 170.5° | 59.9° |
| H41 | C4 | C5 | H51 | 64.2° | 180.0° |
| H41 | C4 | C5 | H52 | 45.2° | 60.1° |
| H42 | C4 | C5 | C6 | 61.1° | 60.0° |
| H42 | C4 | C5 | H51 | 173.6° | 60.1° |
| H42 | C4 | C5 | H52 | 64.1° | 180.0° |
| C6 | C5 | H51 | H52 | 116.9° | 119.9° |
| C5 | C6 | C7 | H61 | 125.2° | 120.1° |
| C5 | C6 | C7 | H62 | 125.2° | 120.0° |
| C5 | C6 | H61 | H62 | 116.8° | 120.0° |
| C5 | C6 | C7 | C8 | 116.3° | 180.0° |
| C5 | C6 | C7 | H71 | 8.9° | 59.9° |
| C5 | C6 | C7 | H72 | 118.4° | 60.0° |
| H51 | C5 | C6 | C7 | 179.0° | 59.9° |
| H51 | C5 | C6 | H61 | 55.8° | 180.0° |
| H51 | C5 | C6 | H62 | 53.8° | 60.1° |
| H52 | C5 | C6 | C7 | 69.5° | 60.0° |
| H52 | C5 | C6 | H61 | 165.3° | 60.1° |
| H52 | C5 | C6 | H62 | 55.7° | 180.0° |
| C7 | C6 | H61 | H62 | 116.8° | 119.9° |
| C6 | C7 | C8 | H71 | 125.2° | 120.1° |
| C6 | C7 | C8 | H72 | 125.3° | 120.0° |
| C6 | C7 | H71 | H72 | 117.1° | 119.9° |
| C6 | C7 | C8 | C9 | 176.9° | 180.0° |
| C6 | C7 | C8 | H81 | 51.6° | 59.9° |
| C6 | C7 | C8 | H82 | 57.9° | 60.0° |
| H61 | C6 | C7 | C8 | 118.5° | 59.9° |
| H61 | C6 | C7 | H71 | 116.3° | 180.0° |
| H61 | C6 | C7 | H72 | 6.9° | 60.1° |
| H62 | C6 | C7 | C8 | 8.9° | 60.0° |
| H62 | C6 | C7 | H71 | 134.1° | 60.1° |
| H62 | C6 | C7 | H72 | 116.4° | 180.0° |
| C8 | C7 | H71 | H72 | 117.2° | 119.9° |
| C7 | C8 | C9 | H81 | 125.3° | 120.1° |
| C7 | C8 | C9 | H82 | 125.2° | 120.0° |
| C7 | C8 | H81 | H82 | 117.4° | 119.9° |
| C7 | C8 | C9 | H91 | 180.0° | 179.9° |
| C7 | C8 | C9 | H92 | 54.8° | 60.0° |
| C7 | C8 | C9 | H93 | 54.7° | 59.9° |
| H71 | C7 | C8 | C9 | 57.9° | 59.9° |
| H71 | C7 | C8 | H81 | 176.8° | 180.0° |
| H71 | C7 | C8 | H82 | 67.3° | 60.1° |
| H72 | C7 | C8 | C9 | 51.6° | 60.0° |
| H72 | C7 | C8 | H81 | 73.7° | 60.1° |
| H72 | C7 | C8 | H82 | 176.9° | 180.0° |
| C9 | C8 | H81 | H82 | 117.4° | 120.0° |
| C8 | C9 | H91 | H92 | 125.2° | 120.0° |
| C8 | C9 | H91 | H93 | 125.3° | 120.0° |
| C8 | C9 | H92 | H93 | 117.4° | 119.9° |
| H81 | C8 | C9 | H91 | 54.7° | 60.0° |
| H81 | C8 | C9 | H92 | 180.0° | 60.1° |
| H81 | C8 | C9 | H93 | 70.6° | 180.0° |
| H82 | C8 | C9 | H91 | 54.7° | 60.0° |
| H82 | C8 | C9 | H92 | 70.5° | 180.0° |
| H82 | C8 | C9 | H93 | 179.9° | 60.0° |
| H91 | C9 | H92 | H93 | 117.5° | 120.0° |
