K5H
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F10 | C09 | sing | 1.40Å | 1.37Å | |
| C09 | F12 | sing | 1.40Å | 1.36Å | |
| C09 | F11 | sing | 1.40Å | 1.36Å | |
| C09 | C06 | sing | 1.53Å | 1.54Å | |
| O08 | C06 | sing | 1.43Å | 1.41Å | |
| N | CA | sing | 1.47Å | 1.46Å | |
| C06 | C05 | sing | 1.53Å | 1.53Å | |
| C06 | O07 | sing | 1.43Å | 1.40Å | |
| C05 | S04 | sing | 1.81Å | 1.81Å | |
| C | CA | sing | 1.51Å | 1.52Å | |
| C | O | doub | 1.21Å | 1.18Å | |
| S04 | C03 | sing | 1.81Å | 1.82Å | |
| CA | C03 | sing | 1.53Å | 1.54Å | |
| N | H1 | sing | 1.01Å | 1.00Å | |
| N | H011 | sing | 1.01Å | 1.00Å | |
| CA | H021 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| O07 | H071 | sing | 0.97Å | 0.95Å | |
| O08 | H081 | sing | 0.97Å | 0.95Å | |
| C | OXT | sing | 1.34Å | 1.32Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F10 | C09 | F12 | 111.2° | 109.5° |
| F10 | C09 | F11 | 106.5° | 109.5° |
| F10 | C09 | C06 | 112.9° | 109.5° |
| F12 | C09 | F11 | 107.7° | 109.5° |
| F12 | C09 | C06 | 109.4° | 109.4° |
| F11 | C09 | C06 | 109.0° | 109.4° |
| C09 | C06 | O08 | 111.2° | 109.4° |
| C09 | C06 | C05 | 110.3° | 109.5° |
| C09 | C06 | O07 | 108.7° | 109.5° |
| O08 | C06 | C05 | 110.6° | 109.5° |
| O08 | C06 | O07 | 107.7° | 109.4° |
| C06 | O08 | H081 | 109.5° | 114.0° |
| N | CA | C | 113.5° | 109.5° |
| N | CA | C03 | 112.0° | 109.5° |
| CA | N | H1 | 109.5° | 111.0° |
| CA | N | H011 | 109.5° | 111.0° |
| N | CA | H021 | 109.6° | 109.5° |
| C05 | C06 | O07 | 108.2° | 109.5° |
| C06 | C05 | S04 | 112.1° | 109.5° |
| C06 | C05 | H052 | 108.8° | 109.5° |
| C06 | C05 | H051 | 108.8° | 109.4° |
| C06 | O07 | H071 | 109.5° | 114.0° |
| C05 | S04 | C03 | 110.7° | 103.0° |
| S04 | C05 | H052 | 108.8° | 109.5° |
| S04 | C05 | H051 | 108.8° | 109.5° |
| CA | C | O | 118.2° | 120.0° |
| C | CA | C03 | 104.2° | 109.5° |
| C | CA | H021 | 108.8° | 109.5° |
| CA | C | OXT | 117.9° | 120.0° |
| O | C | OXT | 123.9° | 120.0° |
| S04 | C03 | CA | 114.4° | 109.5° |
| S04 | C03 | H031 | 108.2° | 109.5° |
| S04 | C03 | H032 | 108.2° | 109.4° |
| C03 | CA | H021 | 108.6° | 109.4° |
| CA | C03 | H031 | 108.2° | 109.5° |
| CA | C03 | H032 | 108.2° | 109.5° |
| H1 | N | H011 | 109.4° | 111.0° |
| H031 | C03 | H032 | 109.5° | 109.5° |
| H052 | C05 | H051 | 109.5° | 109.5° |
| C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F10 | C09 | F12 | F11 | 116.4° | 120.0° |
| F10 | C09 | F12 | C06 | 125.4° | 120.0° |
| F10 | C09 | F11 | C06 | 122.0° | 120.0° |
| F10 | C09 | C06 | O08 | 57.6° | 60.0° |
| F10 | C09 | C06 | C05 | 65.5° | 180.0° |
| F10 | C09 | C06 | O07 | 176.0° | 60.0° |
| F12 | C09 | F11 | C06 | 118.6° | 119.9° |
| F12 | C09 | C06 | O08 | 66.8° | 180.0° |
| F12 | C09 | C06 | C05 | 170.1° | 60.0° |
| F12 | C09 | C06 | O07 | 51.6° | 60.0° |
| F11 | C09 | C06 | O08 | 175.7° | 60.0° |
| F11 | C09 | C06 | C05 | 52.6° | 60.0° |
| F11 | C09 | C06 | O07 | 65.9° | 180.0° |
| C09 | C06 | O08 | C05 | 123.0° | 120.0° |
| C09 | C06 | O08 | O07 | 119.0° | 119.9° |
| C09 | C06 | C05 | O07 | 118.8° | 120.0° |
| C09 | C06 | C05 | S04 | 171.6° | 180.0° |
| C09 | C06 | C05 | H052 | 51.2° | 60.0° |
| C09 | C06 | C05 | H051 | 68.0° | 60.0° |
| C09 | C06 | O07 | H071 | 180.0° | 60.0° |
| C09 | C06 | O08 | H081 | 180.0° | 60.1° |
| O08 | C06 | C05 | O07 | 117.7° | 120.0° |
| O08 | C06 | C05 | S04 | 48.1° | 60.0° |
| O08 | C06 | C05 | H052 | 72.3° | 180.0° |
| O08 | C06 | C05 | H051 | 168.5° | 60.0° |
| O08 | C06 | O07 | H071 | 59.4° | 179.9° |
| N | CA | C | C03 | 122.0° | 120.0° |
| N | CA | C | H021 | 122.3° | 120.1° |
| N | CA | C | O | 174.8° | 20.0° |
| N | CA | C03 | S04 | 57.0° | 60.0° |
| N | CA | C03 | H021 | 121.1° | 120.0° |
| CA | N | H1 | H011 | 120.0° | 123.9° |
| N | CA | C03 | H031 | 63.7° | 60.0° |
| N | CA | C03 | H032 | 177.7° | 180.0° |
| N | CA | C | OXT | 4.9° | 160.0° |
| C06 | C05 | S04 | H052 | 120.4° | 120.0° |
| C06 | C05 | S04 | H051 | 120.4° | 120.0° |
| C06 | C05 | S04 | C03 | 142.7° | 180.0° |
| C06 | C05 | H052 | H051 | 118.8° | 120.0° |
| C05 | C06 | O07 | H071 | 60.2° | 60.0° |
| C05 | C06 | O08 | H081 | 57.0° | 60.0° |
| O07 | C06 | C05 | S04 | 69.6° | 60.0° |
| O07 | C06 | C05 | H052 | 170.0° | 60.0° |
| O07 | C06 | C05 | H051 | 50.8° | 180.0° |
| O07 | C06 | O08 | H081 | 61.0° | 180.0° |
| C05 | S04 | C03 | CA | 95.7° | 180.0° |
| C05 | S04 | C03 | H031 | 25.0° | 60.0° |
| C05 | S04 | C03 | H032 | 143.6° | 60.0° |
| S04 | C05 | H052 | H051 | 118.8° | 120.0° |
| CA | C | O | OXT | 179.8° | 180.0° |
| C | CA | C03 | S04 | 66.0° | 180.0° |
| C | CA | C03 | H021 | 115.8° | 120.0° |
| C | CA | N | H1 | 180.0° | 64.0° |
| C | CA | N | H011 | 60.0° | 60.0° |
| C | CA | C03 | H031 | 173.2° | 60.0° |
| C | CA | C03 | H032 | 54.7° | 60.0° |
| CA | C | OXT | HXT | 179.8° | 180.0° |
| O | C | CA | C03 | 52.8° | 100.0° |
| O | C | CA | H021 | 62.9° | 140.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| S04 | C03 | CA | H031 | 120.7° | 120.0° |
| S04 | C03 | CA | H032 | 120.8° | 119.9° |
| S04 | C03 | CA | H021 | 178.1° | 60.0° |
| S04 | C03 | H031 | H032 | 117.8° | 120.0° |
| C03 | S04 | C05 | H052 | 96.9° | 60.0° |
| C03 | S04 | C05 | H051 | 22.3° | 60.0° |
| C03 | CA | N | H1 | 62.4° | 176.1° |
| C03 | CA | N | H011 | 177.6° | 60.0° |
| CA | C03 | H031 | H032 | 117.7° | 120.0° |
| C03 | CA | C | OXT | 127.0° | 80.0° |
| H1 | N | CA | H021 | 58.2° | 56.1° |
| H011 | N | CA | H021 | 61.8° | 180.0° |
| H021 | CA | C03 | H031 | 57.4° | 180.0° |
| H021 | CA | C03 | H032 | 61.1° | 60.0° |
| H021 | CA | C | OXT | 117.3° | 39.9° |
