ESC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.44Å | 1.45Å | |
| N | H | sing | 1.01Å | 1.02Å | |
| N | H2 | sing | 1.01Å | 1.02Å | |
| CA | CB | sing | 1.53Å | 1.54Å | |
| CA | C | sing | 1.52Å | 1.53Å | |
| CA | HA | sing | 1.10Å | 1.12Å | |
| CB | CG | sing | 1.53Å | 1.52Å | |
| CB | HB2 | sing | 1.10Å | 1.11Å | |
| CB | HB3 | sing | 1.10Å | 1.11Å | |
| CG | SD | sing | 1.82Å | 1.81Å | |
| CG | HG2 | sing | 1.09Å | 1.12Å | |
| CG | HG3 | sing | 1.09Å | 1.12Å | |
| SD | CD | sing | 1.81Å | 1.80Å | |
| C | O | doub | 1.23Å | 1.23Å | |
| C | OXT | sing | 1.35Å | 72.04Å | |
| CD | CE | sing | 1.52Å | 1.54Å | |
| CD | HD2 | sing | 1.09Å | 1.12Å | |
| CD | HD3 | sing | 1.09Å | 1.11Å | |
| CE | HE1 | sing | 1.09Å | 1.12Å | |
| CE | HE2 | sing | 1.10Å | 1.11Å | |
| CE | HE3 | sing | 1.09Å | 1.11Å | |
| OXT | HXT | sing | 0.98Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 109.8° | 119.1° |
| CA | N | H2 | 112.1° | 119.1° |
| N | CA | CB | 109.8° | 111.7° |
| N | CA | C | 106.4° | 112.3° |
| N | CA | HA | 112.3° | 105.3° |
| H | N | H2 | 112.0° | 120.4° |
| CB | CA | C | 112.3° | 112.2° |
| CB | CA | HA | 106.4° | 109.0° |
| CA | CB | CG | 115.8° | 113.6° |
| CA | CB | HB2 | 109.9° | 108.6° |
| CA | CB | HB3 | 109.9° | 108.7° |
| C | CA | HA | 109.8° | 105.9° |
| CA | C | O | 119.8° | 123.2° |
| CA | C | OXT | 137.1° | 114.4° |
| CG | CB | HB2 | 109.9° | 109.3° |
| CG | CB | HB3 | 109.9° | 109.5° |
| CB | CG | SD | 114.6° | 110.3° |
| CB | CG | HG2 | 110.3° | 111.1° |
| CB | CG | HG3 | 110.3° | 111.2° |
| HB2 | CB | HB3 | 100.4° | 106.9° |
| SD | CG | HG2 | 110.4° | 108.0° |
| SD | CG | HG3 | 110.4° | 108.0° |
| CG | SD | CD | 103.3° | 98.3° |
| HG2 | CG | HG3 | 99.9° | 108.1° |
| SD | CD | CE | 111.1° | 110.6° |
| SD | CD | HD2 | 111.6° | 108.7° |
| SD | CD | HD3 | 111.6° | 108.7° |
| O | C | OXT | 57.9° | 122.3° |
| C | OXT | HXT | 137.1° | 114.9° |
| CE | CD | HD2 | 111.6° | 110.3° |
| CE | CD | HD3 | 111.6° | 110.3° |
| CD | CE | HE1 | 111.1° | 111.5° |
| CD | CE | HE2 | 111.6° | 111.6° |
| CD | CE | HE3 | 111.6° | 109.9° |
| HD2 | CD | HD3 | 98.7° | 108.1° |
| HE1 | CE | HE2 | 111.7° | 108.6° |
| HE1 | CE | HE3 | 111.6° | 107.6° |
| HE2 | CE | HE3 | 98.8° | 107.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 125.3° | 166.4° |
| N | CA | CB | C | 118.1° | 127.1° |
| N | CA | CB | HA | 121.7° | 115.9° |
| N | CA | C | HA | 121.7° | 114.5° |
| N | CA | CB | CG | 143.3° | 69.0° |
| N | CA | CB | HB2 | 91.5° | 52.9° |
| N | CA | CB | HB3 | 18.0° | 168.9° |
| N | CA | C | O | 35.9° | 5.5° |
| N | CA | C | OXT | 37.6° | 177.1° |
| H | N | CA | CB | 180.0° | 102.0° |
| H | N | CA | C | 58.3° | 131.0° |
| H | N | CA | HA | 61.8° | 16.2° |
| H2 | N | CA | CB | 54.8° | 64.6° |
| H2 | N | CA | C | 176.5° | 62.4° |
| H2 | N | CA | HA | 63.3° | 177.3° |
| CB | CA | C | HA | 118.1° | 118.8° |
| CA | CB | CG | HB2 | 125.2° | 121.4° |
| CA | CB | CG | HB3 | 125.2° | 121.7° |
| CA | CB | HB2 | HB3 | 115.7° | 117.2° |
| CA | CB | CG | SD | 137.5° | 179.7° |
| CA | CB | CG | HG2 | 97.1° | 60.0° |
| CA | CB | CG | HG3 | 12.2° | 60.4° |
| CB | CA | C | O | 84.3° | 121.3° |
| CB | CA | C | OXT | 157.8° | 56.1° |
| C | CA | CB | CG | 25.1° | 58.1° |
| C | CA | CB | HB2 | 150.4° | 180.0° |
| C | CA | CB | HB3 | 100.1° | 64.0° |
| CA | C | O | OXT | 129.6° | 177.2° |
| CA | C | OXT | HXT | 180.0° | 177.4° |
| HA | CA | CB | CG | 95.0° | 175.1° |
| HA | CA | CB | HB2 | 30.2° | 63.1° |
| HA | CA | CB | HB3 | 139.7° | 53.0° |
| HA | CA | C | O | 157.6° | 120.0° |
| HA | CA | C | OXT | 84.1° | 62.6° |
| CG | CB | HB2 | HB3 | 115.8° | 118.4° |
| CB | CG | SD | HG2 | 125.3° | 121.6° |
| CB | CG | SD | HG3 | 125.3° | 121.7° |
| CB | CG | HG2 | HG3 | 116.1° | 122.2° |
| CB | CG | SD | CD | 8.0° | 180.0° |
| HB2 | CB | CG | SD | 12.3° | 58.3° |
| HB2 | CB | CG | HG2 | 137.6° | 61.4° |
| HB2 | CB | CG | HG3 | 113.0° | 178.1° |
| HB3 | CB | CG | SD | 97.2° | 58.5° |
| HB3 | CB | CG | HG2 | 28.1° | 178.3° |
| HB3 | CB | CG | HG3 | 137.5° | 61.3° |
| SD | CG | HG2 | HG3 | 116.2° | 116.6° |
| CG | SD | CD | CE | 179.2° | 180.0° |
| CG | SD | CD | HD2 | 55.5° | 58.8° |
| CG | SD | CD | HD3 | 53.9° | 58.8° |
| HG2 | CG | SD | CD | 133.3° | 58.4° |
| HG3 | CG | SD | CD | 117.2° | 58.3° |
| SD | CD | CE | HD2 | 125.3° | 120.3° |
| SD | CD | CE | HD3 | 125.3° | 120.3° |
| SD | CD | HD2 | HD3 | 117.5° | 117.9° |
| SD | CD | CE | HE1 | 180.0° | 60.8° |
| SD | CD | CE | HE2 | 54.7° | 60.8° |
| SD | CD | CE | HE3 | 54.8° | 180.0° |
| O | C | OXT | HXT | 79.3° | 0.0° |
| CE | CD | HD2 | HD3 | 117.5° | 120.7° |
| CD | CE | HE1 | HE2 | 125.3° | 123.3° |
| CD | CE | HE1 | HE3 | 125.2° | 120.6° |
| CD | CE | HE2 | HE3 | 117.5° | 120.6° |
| HD2 | CD | CE | HE1 | 54.7° | 178.9° |
| HD2 | CD | CE | HE2 | 180.0° | 59.5° |
| HD2 | CD | CE | HE3 | 70.5° | 59.7° |
| HD3 | CD | CE | HE1 | 54.7° | 59.5° |
| HD3 | CD | CE | HE2 | 70.6° | 178.9° |
| HD3 | CD | CE | HE3 | 179.9° | 59.7° |
| HE1 | CE | HE2 | HE3 | 117.5° | 116.2° |
