C99
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | CA1 | sing | 1.47Å | 1.50Å | |
| N1 | H | sing | 1.01Å | 1.00Å | |
| N1 | H2 | sing | 1.01Å | 1.00Å | |
| CA1 | CB1 | sing | 1.53Å | 1.50Å | |
| CA1 | C1 | sing | 1.53Å | 1.50Å | |
| CA1 | HA1 | sing | 1.09Å | 1.10Å | |
| CB1 | CG1 | sing | 1.53Å | 1.52Å | |
| CB1 | OG1 | sing | 1.43Å | 1.41Å | |
| CB1 | HB1 | sing | 1.09Å | 1.10Å | |
| CG1 | HG11 | sing | 1.09Å | 1.10Å | |
| CG1 | HG12 | sing | 1.09Å | 1.10Å | |
| CG1 | HG13 | sing | 1.09Å | 1.10Å | |
| OG1 | HOG1 | sing | 0.97Å | 0.95Å | |
| C1 | N2 | sing | 1.47Å | 1.41Å | |
| C1 | O1 | sing | 1.43Å | 1.53Å | |
| C1 | N3 | sing | 1.47Å | 1.44Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| N2 | CA2 | sing | 1.35Å | 1.32Å | |
| N2 | HN2 | sing | 0.97Å | 1.00Å | |
| N3 | CA3 | sing | 1.46Å | 1.43Å | |
| N3 | C2 | sing | 1.35Å | 1.41Å | |
| C2 | CA2 | sing | 1.49Å | 1.43Å | |
| C2 | O2 | doub | 1.21Å | 1.17Å | |
| CA2 | O4 | doub | 1.21Å | 1.28Å | |
| CA3 | C3 | sing | 1.51Å | 1.54Å | |
| CA3 | HA31 | sing | 1.09Å | 1.10Å | |
| CA3 | HA32 | sing | 1.09Å | 1.10Å | |
| C3 | OXT | sing | 1.34Å | 1.35Å | |
| C3 | O3 | doub | 1.21Å | 1.19Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA1 | N1 | H | 109.5° | 111.1° |
| CA1 | N1 | H2 | 109.5° | 111.0° |
| N1 | CA1 | CB1 | 107.1° | 109.4° |
| N1 | CA1 | C1 | 115.5° | 109.5° |
| N1 | CA1 | HA1 | 107.4° | 109.5° |
| H | N1 | H2 | 109.5° | 111.0° |
| CB1 | CA1 | C1 | 110.7° | 109.5° |
| CB1 | CA1 | HA1 | 112.6° | 109.5° |
| CA1 | CB1 | CG1 | 111.4° | 109.5° |
| CA1 | CB1 | OG1 | 119.1° | 109.5° |
| CA1 | CB1 | HB1 | 100.1° | 109.5° |
| C1 | CA1 | HA1 | 103.6° | 109.5° |
| CA1 | C1 | N2 | 127.1° | 109.9° |
| CA1 | C1 | O1 | 98.0° | 109.9° |
| CA1 | C1 | N3 | 112.3° | 109.9° |
| CG1 | CB1 | OG1 | 106.9° | 109.5° |
| CG1 | CB1 | HB1 | 114.0° | 109.5° |
| CB1 | CG1 | HG11 | 109.5° | 109.4° |
| CB1 | CG1 | HG12 | 109.5° | 109.4° |
| CB1 | CG1 | HG13 | 109.5° | 109.5° |
| OG1 | CB1 | HB1 | 105.3° | 109.4° |
| CB1 | OG1 | HOG1 | 109.5° | 114.0° |
| HG11 | CG1 | HG12 | 109.5° | 109.5° |
| HG11 | CG1 | HG13 | 109.5° | 109.5° |
| HG12 | CG1 | HG13 | 109.5° | 109.4° |
| N2 | C1 | O1 | 109.0° | 109.9° |
| N2 | C1 | N3 | 101.4° | 107.1° |
| C1 | N2 | CA2 | 108.5° | 107.6° |
| C1 | N2 | HN2 | 125.8° | 126.2° |
| O1 | C1 | N3 | 108.1° | 110.1° |
| C1 | O1 | HO1 | 109.5° | 114.0° |
| C1 | N3 | CA3 | 130.6° | 126.2° |
| C1 | N3 | C2 | 113.0° | 107.7° |
| CA2 | N2 | HN2 | 125.8° | 126.2° |
| N2 | CA2 | C2 | 114.5° | 108.8° |
| N2 | CA2 | O4 | 120.4° | 125.6° |
| CA3 | N3 | C2 | 115.2° | 126.2° |
| N3 | CA3 | C3 | 123.9° | 109.5° |
| N3 | CA3 | HA31 | 104.9° | 109.5° |
| N3 | CA3 | HA32 | 101.5° | 109.5° |
| N3 | C2 | CA2 | 99.0° | 108.8° |
| N3 | C2 | O2 | 131.2° | 125.6° |
| CA2 | C2 | O2 | 129.8° | 125.7° |
| C2 | CA2 | O4 | 125.1° | 125.6° |
| C3 | CA3 | HA31 | 104.9° | 109.5° |
| C3 | CA3 | HA32 | 101.5° | 109.4° |
| CA3 | C3 | OXT | 110.6° | 120.0° |
| CA3 | C3 | O3 | 122.5° | 120.0° |
| HA31 | CA3 | HA32 | 121.6° | 109.5° |
| OXT | C3 | O3 | 126.9° | 120.0° |
| C3 | OXT | HXT | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA1 | N1 | H | H2 | 120.0° | 124.1° |
| N1 | CA1 | CB1 | C1 | 126.7° | 120.0° |
| N1 | CA1 | CB1 | HA1 | 117.9° | 120.0° |
| N1 | CA1 | C1 | HA1 | 117.2° | 120.0° |
| N1 | CA1 | CB1 | CG1 | 59.5° | 55.0° |
| N1 | CA1 | CB1 | OG1 | 65.6° | 65.0° |
| N1 | CA1 | CB1 | HB1 | 179.6° | 175.0° |
| N1 | CA1 | C1 | N2 | 67.5° | 58.5° |
| N1 | CA1 | C1 | O1 | 171.2° | 179.6° |
| N1 | CA1 | C1 | N3 | 57.9° | 59.1° |
| H | N1 | CA1 | CB1 | 32.1° | 60.0° |
| H | N1 | CA1 | C1 | 155.9° | 60.0° |
| H | N1 | CA1 | HA1 | 89.1° | 180.0° |
| H2 | N1 | CA1 | CB1 | 152.1° | 64.0° |
| H2 | N1 | CA1 | C1 | 84.1° | 176.0° |
| H2 | N1 | CA1 | HA1 | 30.9° | 56.0° |
| CB1 | CA1 | C1 | HA1 | 120.9° | 120.0° |
| CA1 | CB1 | CG1 | OG1 | 131.6° | 120.0° |
| CA1 | CB1 | CG1 | HB1 | 112.4° | 120.0° |
| CA1 | CB1 | OG1 | HB1 | 111.2° | 120.0° |
| CA1 | CB1 | CG1 | HG11 | 175.5° | 60.0° |
| CA1 | CB1 | CG1 | HG12 | 64.5° | 180.0° |
| CA1 | CB1 | CG1 | HG13 | 55.5° | 60.0° |
| CA1 | CB1 | OG1 | HOG1 | 156.2° | 60.0° |
| CB1 | CA1 | C1 | N2 | 54.3° | 61.4° |
| CB1 | CA1 | C1 | O1 | 66.9° | 59.6° |
| CB1 | CA1 | C1 | N3 | 179.8° | 179.1° |
| C1 | CA1 | CB1 | CG1 | 173.8° | 175.0° |
| C1 | CA1 | CB1 | OG1 | 61.1° | 55.0° |
| C1 | CA1 | CB1 | HB1 | 52.9° | 65.0° |
| CA1 | C1 | N2 | O1 | 116.4° | 121.1° |
| CA1 | C1 | N2 | N3 | 129.7° | 119.4° |
| CA1 | C1 | O1 | N3 | 116.7° | 121.2° |
| CA1 | C1 | O1 | HO1 | 146.2° | 179.9° |
| CA1 | C1 | N2 | CA2 | 147.7° | 119.4° |
| CA1 | C1 | N2 | HN2 | 32.3° | 60.6° |
| CA1 | C1 | N3 | CA3 | 35.7° | 60.6° |
| CA1 | C1 | N3 | C2 | 157.5° | 119.3° |
| HA1 | CA1 | CB1 | CG1 | 58.4° | 65.0° |
| HA1 | CA1 | CB1 | OG1 | 176.5° | 175.0° |
| HA1 | CA1 | CB1 | HB1 | 62.5° | 55.0° |
| HA1 | CA1 | C1 | N2 | 175.3° | 178.6° |
| HA1 | CA1 | C1 | O1 | 54.0° | 60.4° |
| HA1 | CA1 | C1 | N3 | 59.3° | 60.9° |
| CG1 | CB1 | OG1 | HB1 | 121.6° | 120.0° |
| CB1 | CG1 | HG11 | HG12 | 120.0° | 120.0° |
| CB1 | CG1 | HG11 | HG13 | 120.0° | 120.1° |
| CB1 | CG1 | HG12 | HG13 | 120.0° | 120.0° |
| CG1 | CB1 | OG1 | HOG1 | 29.0° | 60.0° |
| OG1 | CB1 | CG1 | HG11 | 43.9° | 60.0° |
| OG1 | CB1 | CG1 | HG12 | 163.9° | 60.0° |
| OG1 | CB1 | CG1 | HG13 | 76.1° | 179.9° |
| HB1 | CB1 | CG1 | HG11 | 72.1° | 180.0° |
| HB1 | CB1 | CG1 | HG12 | 47.9° | 60.0° |
| HB1 | CB1 | CG1 | HG13 | 167.9° | 60.0° |
| HB1 | CB1 | OG1 | HOG1 | 92.6° | 180.0° |
| HG11 | CG1 | HG12 | HG13 | 120.0° | 120.1° |
| N2 | C1 | O1 | N3 | 109.4° | 117.8° |
| N2 | C1 | O1 | HO1 | 79.9° | 59.0° |
| C1 | N2 | CA2 | HN2 | 180.0° | 180.0° |
| N2 | C1 | N3 | CA3 | 174.2° | 180.0° |
| N2 | C1 | N3 | C2 | 19.0° | 0.0° |
| C1 | N2 | CA2 | C2 | 12.1° | 0.0° |
| C1 | N2 | CA2 | O4 | 167.7° | 180.0° |
| O1 | C1 | N2 | CA2 | 95.9° | 119.6° |
| O1 | C1 | N2 | HN2 | 84.1° | 60.4° |
| O1 | C1 | N3 | CA3 | 71.3° | 60.6° |
| O1 | C1 | N3 | C2 | 95.5° | 119.5° |
| N3 | C1 | O1 | HO1 | 29.5° | 58.8° |
| N3 | C1 | N2 | CA2 | 17.9° | 0.0° |
| N3 | C1 | N2 | HN2 | 162.1° | 180.0° |
| C1 | N3 | CA3 | C2 | 166.6° | 179.9° |
| C1 | N3 | C2 | CA2 | 12.1° | 0.1° |
| C1 | N3 | C2 | O2 | 168.1° | 180.0° |
| C1 | N3 | CA3 | C3 | 74.1° | 90.0° |
| C1 | N3 | CA3 | HA31 | 165.9° | 150.0° |
| C1 | N3 | CA3 | HA32 | 38.4° | 30.0° |
| N2 | CA2 | C2 | N3 | 0.1° | 0.1° |
| N2 | CA2 | C2 | O4 | 179.8° | 180.0° |
| N2 | CA2 | C2 | O2 | 179.7° | 180.0° |
| HN2 | N2 | CA2 | C2 | 167.8° | 180.0° |
| HN2 | N2 | CA2 | O4 | 12.3° | 0.0° |
| CA3 | N3 | C2 | CA2 | 179.0° | 180.0° |
| CA3 | N3 | C2 | O2 | 0.9° | 0.1° |
| N3 | CA3 | C3 | HA31 | 120.0° | 120.0° |
| N3 | CA3 | C3 | HA32 | 112.5° | 120.0° |
| N3 | CA3 | HA31 | HA32 | 114.1° | 120.0° |
| N3 | CA3 | C3 | OXT | 29.0° | 180.0° |
| N3 | CA3 | C3 | O3 | 153.8° | 0.0° |
| N3 | C2 | CA2 | O2 | 179.8° | 180.0° |
| N3 | C2 | CA2 | O4 | 179.7° | 180.0° |
| C2 | N3 | CA3 | C3 | 92.5° | 90.1° |
| C2 | N3 | CA3 | HA31 | 27.5° | 29.9° |
| C2 | N3 | CA3 | HA32 | 155.0° | 149.9° |
| O2 | C2 | CA2 | O4 | 0.5° | 0.0° |
| C3 | CA3 | HA31 | HA32 | 114.0° | 120.0° |
| CA3 | C3 | OXT | O3 | 177.1° | 180.0° |
| CA3 | C3 | OXT | HXT | 177.1° | 179.9° |
| HA31 | CA3 | C3 | OXT | 149.0° | 60.0° |
| HA31 | CA3 | C3 | O3 | 33.8° | 120.0° |
| HA32 | CA3 | C3 | OXT | 83.5° | 60.0° |
| HA32 | CA3 | C3 | O3 | 93.7° | 120.0° |
| O3 | C3 | OXT | HXT | 0.0° | 0.1° |
