BIU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.48Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | C | sing | 1.51Å | 1.49Å | |
| CA | CB | sing | 1.53Å | 1.63Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | CG2 | sing | 1.53Å | 1.53Å | |
| CB | CG1 | sing | 1.53Å | 1.56Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| CG2 | HG2 | sing | 1.09Å | 1.10Å | |
| CG2 | HG2A | sing | 1.09Å | 1.10Å | |
| CG2 | HG2B | sing | 1.09Å | 1.10Å | |
| CG1 | CD1 | sing | 1.53Å | 1.61Å | |
| CG1 | HG1 | sing | 1.09Å | 1.10Å | |
| CG1 | HG1A | sing | 1.09Å | 1.10Å | |
| CD1 | BR | sing | 1.97Å | 1.70Å | |
| CD1 | HD1 | sing | 1.09Å | 1.10Å | |
| CD1 | HD1A | sing | 1.09Å | 1.10Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| C | OXT | sing | 1.34Å | 1.43Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | C | 114.1° | 109.5° |
| N | CA | CB | 117.7° | 109.5° |
| N | CA | HA | 97.5° | 109.5° |
| H | N | H2 | 109.5° | 111.0° |
| C | CA | CB | 98.5° | 109.5° |
| C | CA | HA | 117.0° | 109.5° |
| CA | C | O | 124.9° | 120.0° |
| CA | C | OXT | 117.6° | 120.0° |
| CB | CA | HA | 113.3° | 109.4° |
| CA | CB | CG2 | 107.0° | 109.5° |
| CA | CB | CG1 | 117.9° | 109.5° |
| CA | CB | HB | 104.4° | 109.5° |
| CG2 | CB | CG1 | 106.2° | 109.5° |
| CG2 | CB | HB | 116.5° | 109.4° |
| CB | CG2 | HG2 | 109.5° | 109.5° |
| CB | CG2 | HG2A | 109.5° | 109.5° |
| CB | CG2 | HG2B | 109.5° | 109.5° |
| CG1 | CB | HB | 105.3° | 109.4° |
| CB | CG1 | CD1 | 118.0° | 109.5° |
| CB | CG1 | HG1 | 106.7° | 109.5° |
| CB | CG1 | HG1A | 104.7° | 109.5° |
| HG2 | CG2 | HG2A | 109.5° | 109.4° |
| HG2 | CG2 | HG2B | 109.4° | 109.5° |
| HG2A | CG2 | HG2B | 109.5° | 109.4° |
| CD1 | CG1 | HG1 | 106.7° | 109.4° |
| CD1 | CG1 | HG1A | 104.7° | 109.5° |
| CG1 | CD1 | BR | 112.8° | 109.5° |
| CG1 | CD1 | HD1 | 108.4° | 109.4° |
| CG1 | CD1 | HD1A | 107.6° | 109.5° |
| HG1 | CG1 | HG1A | 116.4° | 109.4° |
| BR | CD1 | HD1 | 108.4° | 109.5° |
| BR | CD1 | HD1A | 107.6° | 109.5° |
| HD1 | CD1 | HD1A | 112.1° | 109.4° |
| O | C | OXT | 117.6° | 120.0° |
| C | OXT | HXT | 109.5° | 117.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 120.0° | 124.0° |
| N | CA | C | CB | 125.5° | 120.1° |
| N | CA | C | HA | 112.8° | 120.0° |
| N | CA | CB | HA | 112.7° | 120.0° |
| N | CA | CB | CG2 | 178.4° | 180.0° |
| N | CA | CB | CG1 | 58.9° | 59.9° |
| N | CA | CB | HB | 57.5° | 60.0° |
| N | CA | C | O | 72.4° | 20.0° |
| N | CA | C | OXT | 107.5° | 160.0° |
| H | N | CA | C | 84.0° | 59.9° |
| H | N | CA | CB | 161.3° | 60.1° |
| H | N | CA | HA | 40.0° | 180.0° |
| H2 | N | CA | C | 36.0° | 176.1° |
| H2 | N | CA | CB | 78.7° | 63.9° |
| H2 | N | CA | HA | 160.0° | 56.0° |
| C | CA | CB | HA | 124.3° | 120.0° |
| C | CA | CB | CG2 | 58.6° | 60.0° |
| C | CA | CB | CG1 | 178.1° | 180.0° |
| C | CA | CB | HB | 65.5° | 60.0° |
| CA | C | O | OXT | 180.0° | 180.0° |
| CA | C | OXT | HXT | 180.0° | 180.0° |
| CA | CB | CG2 | CG1 | 126.8° | 120.1° |
| CA | CB | CG2 | HB | 116.4° | 120.0° |
| CA | CB | CG1 | HB | 115.9° | 120.0° |
| CA | CB | CG2 | HG2 | 159.3° | 60.0° |
| CA | CB | CG2 | HG2A | 39.3° | 180.0° |
| CA | CB | CG2 | HG2B | 80.7° | 60.0° |
| CA | CB | CG1 | CD1 | 178.3° | 175.0° |
| CA | CB | CG1 | HG1 | 61.7° | 65.0° |
| CA | CB | CG1 | HG1A | 62.3° | 55.0° |
| CB | CA | C | O | 53.1° | 100.0° |
| CB | CA | C | OXT | 126.9° | 80.0° |
| HA | CA | CB | CG2 | 65.7° | 60.0° |
| HA | CA | CB | CG1 | 53.8° | 60.0° |
| HA | CA | CB | HB | 170.2° | 180.0° |
| HA | CA | C | O | 174.8° | 140.0° |
| HA | CA | C | OXT | 5.2° | 40.0° |
| CG2 | CB | CG1 | HB | 124.1° | 119.9° |
| CB | CG2 | HG2 | HG2A | 120.0° | 120.0° |
| CB | CG2 | HG2 | HG2B | 120.0° | 120.1° |
| CB | CG2 | HG2A | HG2B | 120.0° | 120.0° |
| CG2 | CB | CG1 | CD1 | 61.7° | 64.9° |
| CG2 | CB | CG1 | HG1 | 58.3° | 55.1° |
| CG2 | CB | CG1 | HG1A | 177.7° | 175.0° |
| CG1 | CB | CG2 | HG2 | 74.0° | 60.0° |
| CG1 | CB | CG2 | HG2A | 166.0° | 60.0° |
| CG1 | CB | CG2 | HG2B | 46.0° | 180.0° |
| CB | CG1 | CD1 | HG1 | 120.0° | 120.0° |
| CB | CG1 | CD1 | HG1A | 116.0° | 120.0° |
| CB | CG1 | HG1 | HG1A | 116.5° | 120.0° |
| CB | CG1 | CD1 | BR | 30.8° | 180.0° |
| CB | CG1 | CD1 | HD1 | 150.7° | 60.0° |
| CB | CG1 | CD1 | HD1A | 87.8° | 59.9° |
| HB | CB | CG2 | HG2 | 42.9° | 179.9° |
| HB | CB | CG2 | HG2A | 77.1° | 60.0° |
| HB | CB | CG2 | HG2B | 162.9° | 60.0° |
| HB | CB | CG1 | CD1 | 62.4° | 55.0° |
| HB | CB | CG1 | HG1 | 177.6° | 175.0° |
| HB | CB | CG1 | HG1A | 53.6° | 65.1° |
| HG2 | CG2 | HG2A | HG2B | 119.9° | 119.9° |
| CD1 | CG1 | HG1 | HG1A | 116.5° | 120.0° |
| CG1 | CD1 | BR | HD1 | 120.0° | 119.9° |
| CG1 | CD1 | BR | HD1A | 118.6° | 120.1° |
| CG1 | CD1 | HD1 | HD1A | 118.6° | 120.0° |
| HG1 | CG1 | CD1 | BR | 89.2° | 60.0° |
| HG1 | CG1 | CD1 | HD1 | 30.7° | 180.0° |
| HG1 | CG1 | CD1 | HD1A | 152.2° | 60.1° |
| HG1A | CG1 | CD1 | BR | 146.7° | 60.0° |
| HG1A | CG1 | CD1 | HD1 | 93.3° | 60.0° |
| HG1A | CG1 | CD1 | HD1A | 28.2° | 180.0° |
| BR | CD1 | HD1 | HD1A | 118.7° | 120.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
