01X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N' | CA' | sing | 1.47Å | 1.46Å | |
| N' | H' | sing | 1.01Å | 1.00Å | |
| CA' | CB' | sing | 1.51Å | 1.51Å | |
| CA' | HA'1 | sing | 1.09Å | 1.10Å | |
| CA' | HA'2 | sing | 1.09Å | 1.10Å | |
| CB' | CG' | doub | 1.39Å | 1.39Å | Aromatic |
| CB' | CGB | sing | 1.38Å | 1.41Å | Aromatic |
| CG' | CD' | sing | 1.39Å | 1.41Å | Aromatic |
| CG' | OL | sing | 1.36Å | 1.38Å | |
| CD' | CE' | doub | 1.38Å | 1.38Å | Aromatic |
| CD' | HD' | sing | 1.08Å | 1.08Å | |
| CE' | CDB | sing | 1.38Å | 1.41Å | Aromatic |
| CE' | HE' | sing | 1.08Å | 1.08Å | |
| CDB | CGB | doub | 1.38Å | 1.41Å | Aromatic |
| CDB | CL | sing | 1.74Å | 1.71Å | |
| CGB | HG' | sing | 1.08Å | 1.08Å | |
| OL | CF | sing | 1.43Å | 1.43Å | |
| CF | CH | sing | 1.51Å | 1.51Å | |
| CF | HF1 | sing | 1.09Å | 1.10Å | |
| CF | HF2 | sing | 1.09Å | 1.10Å | |
| CH | OH | doub | 1.21Å | 1.23Å | |
| N' | H2 | sing | 1.01Å | 1.00Å | |
| CH | OXT | sing | 1.34Å | 29.82Å | |
| OXT | HXT | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA' | N' | H' | 109.5° | 111.0° |
| N' | CA' | CB' | 113.1° | 109.5° |
| N' | CA' | HA'1 | 108.3° | 109.5° |
| N' | CA' | HA'2 | 108.3° | 109.5° |
| CA' | N' | H2 | 109.4° | 111.0° |
| H' | N' | H2 | 109.5° | 111.1° |
| CB' | CA' | HA'1 | 108.3° | 109.5° |
| CB' | CA' | HA'2 | 108.3° | 109.5° |
| CA' | CB' | CG' | 119.7° | 120.1° |
| CA' | CB' | CGB | 120.8° | 120.0° |
| HA'1 | CA' | HA'2 | 110.7° | 109.4° |
| CG' | CB' | CGB | 119.1° | 120.0° |
| CB' | CG' | CD' | 119.8° | 119.9° |
| CB' | CG' | OL | 117.1° | 120.0° |
| CB' | CGB | CDB | 121.4° | 120.0° |
| CB' | CGB | HG' | 119.3° | 120.0° |
| CD' | CG' | OL | 122.2° | 120.1° |
| CG' | CD' | CE' | 120.7° | 120.0° |
| CG' | CD' | HD' | 119.7° | 120.0° |
| CG' | OL | CF | 113.4° | 117.0° |
| CE' | CD' | HD' | 119.7° | 120.0° |
| CD' | CE' | CDB | 120.8° | 120.0° |
| CD' | CE' | HE' | 119.6° | 120.0° |
| CDB | CE' | HE' | 119.6° | 120.0° |
| CE' | CDB | CGB | 118.2° | 120.2° |
| CE' | CDB | CL | 121.6° | 119.9° |
| CGB | CDB | CL | 120.1° | 119.9° |
| CDB | CGB | HG' | 119.3° | 120.0° |
| OL | CF | CH | 111.2° | 109.5° |
| OL | CF | HF1 | 108.9° | 109.5° |
| OL | CF | HF2 | 108.9° | 109.5° |
| CH | CF | HF1 | 108.9° | 109.5° |
| CH | CF | HF2 | 108.9° | 109.4° |
| CF | CH | OH | 120.7° | 120.0° |
| CF | CH | OXT | 83.1° | 120.0° |
| HF1 | CF | HF2 | 110.0° | 109.5° |
| OH | CH | OXT | 148.5° | 120.0° |
| CH | OXT | HXT | 90.0° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA' | N' | H' | H2 | 120.0° | 123.9° |
| N' | CA' | CB' | HA'1 | 120.0° | 120.0° |
| N' | CA' | CB' | HA'2 | 120.0° | 120.0° |
| N' | CA' | HA'1 | HA'2 | 118.5° | 120.0° |
| N' | CA' | CB' | CG' | 108.5° | 80.0° |
| N' | CA' | CB' | CGB | 78.5° | 100.2° |
| H' | N' | CA' | CB' | 180.0° | 56.1° |
| H' | N' | CA' | HA'1 | 60.0° | 176.1° |
| H' | N' | CA' | HA'2 | 60.0° | 64.0° |
| CB' | CA' | HA'1 | HA'2 | 118.5° | 120.0° |
| CA' | CB' | CG' | CGB | 173.1° | 179.8° |
| CA' | CB' | CG' | CD' | 172.7° | 180.0° |
| CA' | CB' | CG' | OL | 18.3° | 0.0° |
| CA' | CB' | CGB | CDB | 173.3° | 179.7° |
| CA' | CB' | CGB | HG' | 6.7° | 0.0° |
| CB' | CA' | N' | H2 | 60.0° | 179.9° |
| HA'1 | CA' | CB' | CG' | 131.5° | 40.0° |
| HA'1 | CA' | CB' | CGB | 41.5° | 139.7° |
| HA'1 | CA' | N' | H2 | 60.0° | 59.9° |
| HA'2 | CA' | CB' | CG' | 11.5° | 160.0° |
| HA'2 | CA' | CB' | CGB | 161.5° | 19.8° |
| HA'2 | CA' | N' | H2 | 180.0° | 60.0° |
| CB' | CG' | CD' | OL | 168.4° | 179.9° |
| CB' | CG' | CD' | CE' | 0.9° | 0.0° |
| CB' | CG' | CD' | HD' | 179.1° | 180.0° |
| CG' | CB' | CGB | CDB | 0.3° | 0.5° |
| CG' | CB' | CGB | HG' | 179.7° | 179.7° |
| CB' | CG' | OL | CF | 109.7° | 180.0° |
| CGB | CB' | CG' | CD' | 0.4° | 0.3° |
| CGB | CB' | CG' | OL | 168.6° | 179.8° |
| CB' | CGB | CDB | CE' | 0.4° | 0.6° |
| CB' | CGB | CDB | HG' | 180.0° | 179.7° |
| CB' | CGB | CDB | CL | 179.0° | 179.7° |
| CG' | CD' | CE' | HD' | 180.0° | 180.0° |
| CG' | CD' | CE' | CDB | 0.7° | 0.1° |
| CG' | CD' | CE' | HE' | 179.3° | 180.0° |
| CD' | CG' | OL | CF | 59.0° | 0.1° |
| OL | CG' | CD' | CE' | 167.5° | 180.0° |
| OL | CG' | CD' | HD' | 12.5° | 0.1° |
| CG' | OL | CF | CH | 159.0° | 180.0° |
| CG' | OL | CF | HF1 | 81.0° | 60.0° |
| CG' | OL | CF | HF2 | 39.0° | 60.1° |
| CD' | CE' | CDB | HE' | 180.0° | 180.0° |
| CD' | CE' | CDB | CGB | 0.1° | 0.3° |
| CD' | CE' | CDB | CL | 178.5° | 180.0° |
| HD' | CD' | CE' | CDB | 179.3° | 180.0° |
| HD' | CD' | CE' | HE' | 0.7° | 0.0° |
| CE' | CDB | CGB | CL | 178.6° | 179.7° |
| CE' | CDB | CGB | HG' | 179.6° | 179.7° |
| HE' | CE' | CDB | CGB | 180.0° | 179.7° |
| HE' | CE' | CDB | CL | 1.5° | 0.0° |
| CL | CDB | CGB | HG' | 1.0° | 0.0° |
| OL | CF | CH | HF1 | 120.0° | 120.1° |
| OL | CF | CH | HF2 | 120.0° | 120.0° |
| OL | CF | HF1 | HF2 | 119.3° | 120.0° |
| OL | CF | CH | OH | 157.3° | 0.0° |
| OL | CF | CH | OXT | 0.6° | 179.9° |
| CH | CF | HF1 | HF2 | 119.3° | 120.0° |
| CF | CH | OH | OXT | 134.5° | 180.0° |
| CF | CH | OXT | HXT | 90.0° | 179.9° |
| HF1 | CF | CH | OH | 82.7° | 120.0° |
| HF1 | CF | CH | OXT | 119.4° | 60.0° |
| HF2 | CF | CH | OH | 37.3° | 120.0° |
| HF2 | CF | CH | OXT | 120.6° | 60.0° |
| OH | CH | OXT | HXT | 90.0° | 0.1° |
