ERL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C | sing | 1.43Å | 1.41Å | |
| CE | CD | sing | 1.53Å | 1.42Å | |
| CD | CG | sing | 1.53Å | 1.53Å | |
| CG | CB | sing | 1.53Å | 1.50Å | |
| CB | CA | sing | 1.53Å | 1.55Å | |
| C | CA | sing | 1.53Å | 1.49Å | |
| CA | N | sing | 1.47Å | 1.46Å | |
| CE | HE3 | sing | 1.09Å | 1.10Å | |
| CE | HE1 | sing | 1.09Å | 1.10Å | |
| CE | HE2 | sing | 1.09Å | 1.10Å | |
| CD | HD3 | sing | 1.09Å | 1.10Å | |
| CD | HD2 | sing | 1.09Å | 1.10Å | |
| CG | HG3 | sing | 1.09Å | 1.10Å | |
| CG | HG2 | sing | 1.09Å | 1.10Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CB | HB3 | sing | 1.09Å | 1.10Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | HN2 | sing | 1.01Å | 1.00Å | |
| O | H1 | sing | 0.97Å | 0.95Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C | S1 | sing | 1.81Å | 14.14Å | |
| S1 | O3 | sing | 1.52Å | 0.00Å | |
| S1 | O1 | doub | 1.42Å | 0.00Å | |
| S1 | O2 | doub | 1.42Å | 0.00Å | |
| O3 | H3 | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | CA | 110.3° | 109.4° |
| C | O | H1 | 109.5° | 114.0° |
| O | C | H2 | 100.1° | 109.5° |
| O | C | S1 | 69.8° | 109.5° |
| CE | CD | CG | 111.3° | 109.4° |
| CD | CE | HE3 | 109.5° | 109.4° |
| CD | CE | HE1 | 109.5° | 109.5° |
| CD | CE | HE2 | 109.5° | 109.5° |
| CE | CD | HD3 | 109.0° | 109.5° |
| CE | CD | HD2 | 109.0° | 109.5° |
| CD | CG | CB | 109.8° | 109.5° |
| CG | CD | HD3 | 109.0° | 109.5° |
| CG | CD | HD2 | 109.0° | 109.5° |
| CD | CG | HG3 | 109.4° | 109.5° |
| CD | CG | HG2 | 109.4° | 109.5° |
| CG | CB | CA | 110.6° | 109.5° |
| CB | CG | HG3 | 109.4° | 109.5° |
| CB | CG | HG2 | 109.4° | 109.4° |
| CG | CB | HB2 | 109.2° | 109.5° |
| CG | CB | HB3 | 109.2° | 109.4° |
| CB | CA | C | 112.3° | 109.5° |
| CB | CA | N | 110.0° | 109.5° |
| CA | CB | HB2 | 109.2° | 109.4° |
| CA | CB | HB3 | 109.2° | 109.5° |
| CB | CA | HA | 107.3° | 109.5° |
| C | CA | N | 110.7° | 109.5° |
| C | CA | HA | 108.0° | 109.4° |
| CA | C | H2 | 99.5° | 109.5° |
| CA | C | S1 | 43.7° | 109.5° |
| N | CA | HA | 108.4° | 109.5° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | HN2 | 109.4° | 111.0° |
| HE3 | CE | HE1 | 109.5° | 109.5° |
| HE3 | CE | HE2 | 109.5° | 109.5° |
| HE1 | CE | HE2 | 109.5° | 109.5° |
| HD3 | CD | HD2 | 109.5° | 109.5° |
| HG3 | CG | HG2 | 109.5° | 109.5° |
| HB2 | CB | HB3 | 109.5° | 109.5° |
| H | N | HN2 | 109.5° | 111.0° |
| H2 | C | S1 | 91.0° | 109.5° |
| C | S1 | O3 | 90.0° | 104.4° |
| C | S1 | O1 | 90.0° | 110.6° |
| C | S1 | O2 | 90.0° | 110.6° |
| O3 | S1 | O1 | 90.0° | 104.3° |
| O3 | S1 | O2 | 90.0° | 104.2° |
| S1 | O3 | H3 | 90.0° | 114.0° |
| O1 | S1 | O2 | 90.0° | 121.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | CA | CB | 64.7° | 65.0° |
| O | C | CA | H2 | 104.5° | 120.0° |
| O | C | CA | S1 | 23.2° | 120.0° |
| O | C | CA | N | 171.9° | 55.0° |
| O | C | CA | HA | 53.4° | 175.0° |
| O | C | H2 | S1 | 69.7° | 120.0° |
| O | C | S1 | O3 | 90.0° | 55.0° |
| O | C | S1 | O1 | 90.0° | 56.6° |
| O | C | S1 | O2 | 90.0° | 166.6° |
| CE | CD | CG | HD3 | 120.3° | 120.0° |
| CE | CD | CG | HD2 | 120.3° | 120.0° |
| CE | CD | CG | CB | 176.8° | 180.0° |
| CD | CE | HE3 | HE1 | 120.0° | 120.0° |
| CD | CE | HE3 | HE2 | 120.0° | 120.0° |
| CD | CE | HE1 | HE2 | 120.0° | 120.0° |
| CE | CD | HD3 | HD2 | 119.2° | 120.0° |
| CE | CD | CG | HG3 | 56.8° | 60.0° |
| CE | CD | CG | HG2 | 63.1° | 60.0° |
| CD | CG | CB | HG3 | 120.0° | 120.1° |
| CD | CG | CB | HG2 | 120.0° | 120.0° |
| CD | CG | CB | CA | 175.8° | 180.0° |
| CG | CD | CE | HE3 | 180.0° | 180.0° |
| CG | CD | CE | HE1 | 60.0° | 60.0° |
| CG | CD | CE | HE2 | 60.0° | 60.0° |
| CG | CD | HD3 | HD2 | 119.2° | 120.0° |
| CD | CG | HG3 | HG2 | 119.9° | 120.0° |
| CD | CG | CB | HB2 | 55.6° | 60.0° |
| CD | CG | CB | HB3 | 64.1° | 60.0° |
| CG | CB | CA | HB2 | 120.2° | 120.0° |
| CG | CB | CA | HB3 | 120.1° | 120.0° |
| CG | CB | CA | C | 167.5° | 175.0° |
| CG | CB | CA | N | 68.8° | 65.0° |
| CB | CG | CD | HD3 | 62.9° | 60.0° |
| CB | CG | CD | HD2 | 56.6° | 60.0° |
| CB | CG | HG3 | HG2 | 119.9° | 120.0° |
| CG | CB | HB2 | HB3 | 119.5° | 120.0° |
| CG | CB | CA | HA | 49.0° | 55.0° |
| CB | CA | C | N | 123.4° | 120.0° |
| CB | CA | C | HA | 118.1° | 120.0° |
| CB | CA | N | HA | 117.0° | 120.0° |
| CA | CB | CG | HG3 | 64.2° | 60.0° |
| CA | CB | CG | HG2 | 55.8° | 60.0° |
| CA | CB | HB2 | HB3 | 119.5° | 120.0° |
| CB | CA | N | H | 180.0° | 176.0° |
| CB | CA | N | HN2 | 60.0° | 60.0° |
| CB | CA | C | H2 | 39.8° | 55.0° |
| CB | CA | C | S1 | 41.5° | 175.0° |
| C | CA | N | HA | 118.3° | 119.9° |
| C | CA | CB | HB2 | 47.3° | 55.0° |
| C | CA | CB | HB3 | 72.4° | 65.0° |
| C | CA | N | H | 55.3° | 64.0° |
| C | CA | N | HN2 | 64.7° | 60.0° |
| CA | C | O | H1 | 180.0° | 60.0° |
| CA | C | H2 | S1 | 43.1° | 120.0° |
| CA | C | S1 | O3 | 90.0° | 175.0° |
| CA | C | S1 | O1 | 90.0° | 63.4° |
| CA | C | S1 | O2 | 90.0° | 73.4° |
| N | CA | CB | HB2 | 171.1° | 175.0° |
| N | CA | CB | HB3 | 51.4° | 55.0° |
| CA | N | H | HN2 | 120.0° | 123.9° |
| N | CA | C | H2 | 83.5° | 175.0° |
| N | CA | C | S1 | 164.9° | 65.0° |
| HE3 | CE | HE1 | HE2 | 120.0° | 120.0° |
| HE3 | CE | CD | HD3 | 59.7° | 60.0° |
| HE3 | CE | CD | HD2 | 59.8° | 60.0° |
| HE1 | CE | CD | HD3 | 60.3° | 60.0° |
| HE1 | CE | CD | HD2 | 179.7° | 180.0° |
| HE2 | CE | CD | HD3 | 179.8° | 180.0° |
| HE2 | CE | CD | HD2 | 60.3° | 60.0° |
| HD3 | CD | CG | HG3 | 177.0° | 180.0° |
| HD3 | CD | CG | HG2 | 57.1° | 60.0° |
| HD2 | CD | CG | HG3 | 63.5° | 60.0° |
| HD2 | CD | CG | HG2 | 176.6° | 180.0° |
| HG3 | CG | CB | HB2 | 175.6° | 179.9° |
| HG3 | CG | CB | HB3 | 56.0° | 60.0° |
| HG2 | CG | CB | HB2 | 64.4° | 60.0° |
| HG2 | CG | CB | HB3 | 175.9° | 180.0° |
| HB2 | CB | CA | HA | 71.2° | 65.0° |
| HB3 | CB | CA | HA | 169.1° | 175.0° |
| HA | CA | N | H | 63.0° | 56.0° |
| HA | CA | N | HN2 | 177.0° | 180.0° |
| HA | CA | C | H2 | 157.9° | 65.0° |
| HA | CA | C | S1 | 76.5° | 55.0° |
| H1 | O | C | H2 | 75.8° | 180.0° |
| H1 | O | C | S1 | 163.2° | 60.0° |
| H2 | C | S1 | O3 | 90.0° | 65.0° |
| H2 | C | S1 | O1 | 90.0° | 176.6° |
| H2 | C | S1 | O2 | 90.0° | 46.6° |
| C | S1 | O3 | O1 | 90.0° | 116.1° |
| C | S1 | O3 | O2 | 90.0° | 116.1° |
| C | S1 | O1 | O2 | 90.0° | 131.6° |
| C | S1 | O3 | H3 | 90.0° | 180.0° |
| O3 | S1 | O1 | O2 | 90.0° | 116.7° |
| O1 | S1 | O3 | H3 | 90.0° | 63.9° |
| O2 | S1 | O3 | H3 | 90.0° | 64.0° |
