SWW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.45Å | |
| O09 | C08 | sing | 1.43Å | 1.40Å | |
| C08 | C07 | sing | 1.53Å | 1.53Å | |
| CA | C | sing | 1.51Å | 1.55Å | |
| CA | C05 | sing | 1.53Å | 1.54Å | |
| C | O | doub | 1.21Å | 1.21Å | |
| S06 | C05 | sing | 1.81Å | 1.84Å | |
| S06 | C07 | sing | 1.81Å | 1.81Å | |
| C | OXT | sing | 1.34Å | 1.33Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C07 | H072 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C08 | H082 | sing | 1.09Å | 1.10Å | |
| O09 | H091 | sing | 0.97Å | 0.95Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N | CA | C | 112.7° | 109.4° |
| N | CA | C05 | 111.4° | 109.4° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.4° | 111.0° |
| N | CA | HA | 108.6° | 109.5° |
| O09 | C08 | C07 | 113.2° | 109.4° |
| O09 | C08 | H081 | 108.6° | 109.5° |
| O09 | C08 | H082 | 108.5° | 109.5° |
| C08 | O09 | H091 | 109.5° | 113.9° |
| C08 | C07 | S06 | 113.8° | 109.5° |
| C08 | C07 | H072 | 108.4° | 109.5° |
| C08 | C07 | H071 | 108.4° | 109.5° |
| C07 | C08 | H081 | 108.5° | 109.5° |
| C07 | C08 | H082 | 108.5° | 109.4° |
| C | CA | C05 | 109.0° | 109.5° |
| CA | C | O | 118.9° | 120.0° |
| CA | C | OXT | 118.0° | 120.0° |
| C | CA | HA | 107.4° | 109.5° |
| CA | C05 | S06 | 114.6° | 109.5° |
| C05 | CA | HA | 107.5° | 109.5° |
| CA | C05 | H052 | 108.2° | 109.4° |
| CA | C05 | H051 | 108.2° | 109.5° |
| O | C | OXT | 123.2° | 120.0° |
| C05 | S06 | C07 | 107.6° | 103.0° |
| S06 | C05 | H052 | 108.2° | 109.5° |
| S06 | C05 | H051 | 108.2° | 109.5° |
| S06 | C07 | H072 | 108.4° | 109.5° |
| S06 | C07 | H071 | 108.4° | 109.5° |
| C | OXT | HXT | 109.5° | 117.0° |
| H | N | H2 | 109.5° | 111.0° |
| H052 | C05 | H051 | 109.5° | 109.5° |
| H072 | C07 | H071 | 109.5° | 109.4° |
| H081 | C08 | H082 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | CA | C | C05 | 124.2° | 120.0° |
| N | CA | C | HA | 119.6° | 120.0° |
| N | CA | C05 | HA | 118.9° | 120.0° |
| N | CA | C | O | 163.3° | 20.0° |
| N | CA | C05 | S06 | 30.1° | 65.0° |
| N | CA | C | OXT | 17.6° | 160.0° |
| CA | N | H | H2 | 120.0° | 123.9° |
| N | CA | C05 | H052 | 150.9° | 175.0° |
| N | CA | C05 | H051 | 90.6° | 55.0° |
| O09 | C08 | C07 | H081 | 120.6° | 120.0° |
| O09 | C08 | C07 | H082 | 120.6° | 119.9° |
| O09 | C08 | C07 | S06 | 71.3° | 180.0° |
| O09 | C08 | C07 | H072 | 168.1° | 60.0° |
| O09 | C08 | C07 | H071 | 49.4° | 59.9° |
| O09 | C08 | H081 | H082 | 118.3° | 120.0° |
| C08 | C07 | S06 | C05 | 94.9° | 180.0° |
| C08 | C07 | S06 | H072 | 120.6° | 120.0° |
| C08 | C07 | S06 | H071 | 120.6° | 120.0° |
| C08 | C07 | H072 | H071 | 118.0° | 120.0° |
| C07 | C08 | H081 | H082 | 118.3° | 120.0° |
| C07 | C08 | O09 | H091 | 180.0° | 180.0° |
| C | CA | C05 | HA | 116.1° | 120.0° |
| CA | C | O | OXT | 179.0° | 180.0° |
| C | CA | C05 | S06 | 155.1° | 175.0° |
| C | CA | N | H | 180.0° | 176.0° |
| C | CA | N | H2 | 60.0° | 60.0° |
| C | CA | C05 | H052 | 84.2° | 55.1° |
| C | CA | C05 | H051 | 34.4° | 65.0° |
| CA | C | OXT | HXT | 179.0° | 180.0° |
| C05 | CA | C | O | 39.1° | 99.9° |
| CA | C05 | S06 | H052 | 120.8° | 119.9° |
| CA | C05 | S06 | H051 | 120.7° | 120.0° |
| CA | C05 | S06 | C07 | 73.5° | 180.0° |
| C05 | CA | C | OXT | 141.8° | 80.0° |
| C05 | CA | N | H | 57.2° | 64.0° |
| C05 | CA | N | H2 | 62.9° | 60.0° |
| CA | C05 | H052 | H051 | 117.7° | 120.0° |
| O | C | CA | HA | 77.1° | 140.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| S06 | C05 | CA | HA | 88.8° | 55.0° |
| S06 | C05 | H052 | H051 | 117.6° | 120.0° |
| C05 | S06 | C07 | H072 | 144.4° | 60.0° |
| C05 | S06 | C07 | H071 | 25.7° | 60.0° |
| C07 | S06 | C05 | H052 | 47.3° | 60.0° |
| C07 | S06 | C05 | H051 | 165.8° | 60.0° |
| S06 | C07 | H072 | H071 | 118.0° | 120.0° |
| S06 | C07 | C08 | H081 | 49.3° | 60.0° |
| S06 | C07 | C08 | H082 | 168.2° | 60.0° |
| OXT | C | CA | HA | 102.0° | 40.0° |
| H | N | CA | HA | 61.1° | 56.0° |
| H2 | N | CA | HA | 178.9° | 180.0° |
| HA | CA | C05 | H052 | 32.0° | 65.0° |
| HA | CA | C05 | H051 | 150.5° | 175.0° |
| H072 | C07 | C08 | H081 | 71.3° | 60.0° |
| H072 | C07 | C08 | H082 | 47.5° | 179.9° |
| H071 | C07 | C08 | H081 | 169.9° | 180.0° |
| H071 | C07 | C08 | H082 | 71.2° | 60.0° |
| H081 | C08 | O09 | H091 | 59.4° | 60.0° |
| H082 | C08 | O09 | H091 | 59.4° | 60.1° |
