GEE
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C | O | doub | 1.21Å | 1.22Å | |
C | O1 | sing | 1.34Å | 1.43Å | |
C | CA | sing | 1.51Å | 1.50Å | |
N | CA | sing | 1.47Å | 1.44Å | |
C1 | O1 | sing | 1.45Å | 1.42Å | |
C1 | C2 | sing | 1.53Å | 1.50Å | |
N | H | sing | 1.01Å | 1.00Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
C1 | H1A | sing | 1.09Å | 1.10Å | |
C1 | H1B | sing | 1.09Å | 1.10Å | |
C2 | H2A | sing | 1.09Å | 1.10Å | |
C2 | H2B | sing | 1.09Å | 1.10Å | |
C2 | H2C | sing | 1.09Å | 1.10Å | |
CA | HA2 | sing | 1.09Å | 1.10Å | |
CA | HA3 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O | C | O1 | 119.3° | 120.0° |
O | C | CA | 121.5° | 120.0° |
O1 | C | CA | 119.1° | 120.0° |
C | O1 | C1 | 119.1° | 117.0° |
C | CA | N | 108.4° | 109.5° |
C | CA | HA2 | 109.8° | 109.5° |
C | CA | HA3 | 109.8° | 109.5° |
CA | N | H | 109.5° | 111.0° |
CA | N | H2 | 109.5° | 111.0° |
N | CA | HA2 | 109.8° | 109.5° |
N | CA | HA3 | 109.8° | 109.5° |
O1 | C1 | C2 | 107.6° | 109.5° |
O1 | C1 | H1A | 110.1° | 109.5° |
O1 | C1 | H1B | 110.1° | 109.5° |
C2 | C1 | H1A | 110.1° | 109.5° |
C2 | C1 | H1B | 110.1° | 109.4° |
C1 | C2 | H2A | 109.5° | 109.5° |
C1 | C2 | H2B | 109.5° | 109.5° |
C1 | C2 | H2C | 109.4° | 109.5° |
H | N | H2 | 109.5° | 111.0° |
H1A | C1 | H1B | 108.8° | 109.5° |
H2A | C2 | H2B | 109.5° | 109.5° |
H2A | C2 | H2C | 109.4° | 109.5° |
H2B | C2 | H2C | 109.5° | 109.4° |
HA2 | CA | HA3 | 109.1° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O | C | O1 | CA | 178.8° | 179.7° |
O | C | CA | N | 29.7° | 0.0° |
O | C | O1 | C1 | 15.4° | 0.1° |
O | C | CA | HA2 | 90.3° | 120.0° |
O | C | CA | HA3 | 149.7° | 120.0° |
O1 | C | CA | N | 149.1° | 179.7° |
C | O1 | C1 | C2 | 155.6° | 180.0° |
C | O1 | C1 | H1A | 35.6° | 60.0° |
C | O1 | C1 | H1B | 84.4° | 60.1° |
O1 | C | CA | HA2 | 90.9° | 60.3° |
O1 | C | CA | HA3 | 29.1° | 59.7° |
C | CA | N | HA2 | 120.0° | 120.0° |
C | CA | N | HA3 | 120.0° | 120.0° |
CA | C | O1 | C1 | 163.4° | 179.7° |
C | CA | N | H | 180.0° | 56.1° |
C | CA | N | H2 | 60.0° | 180.0° |
C | CA | HA2 | HA3 | 120.4° | 120.0° |
CA | N | H | H2 | 120.0° | 123.9° |
N | CA | HA2 | HA3 | 120.4° | 120.0° |
O1 | C1 | C2 | H1A | 120.0° | 120.0° |
O1 | C1 | C2 | H1B | 120.0° | 120.0° |
O1 | C1 | H1A | H1B | 120.7° | 120.1° |
O1 | C1 | C2 | H2A | 180.0° | 60.0° |
O1 | C1 | C2 | H2B | 60.0° | 60.0° |
O1 | C1 | C2 | H2C | 60.0° | 180.0° |
C2 | C1 | H1A | H1B | 120.8° | 120.0° |
C1 | C2 | H2A | H2B | 120.0° | 120.0° |
C1 | C2 | H2A | H2C | 120.0° | 120.0° |
C1 | C2 | H2B | H2C | 120.0° | 120.0° |
H | N | CA | HA2 | 60.0° | 64.0° |
H | N | CA | HA3 | 60.0° | 176.1° |
H2 | N | CA | HA2 | 180.0° | 60.0° |
H2 | N | CA | HA3 | 60.0° | 60.0° |
H1A | C1 | C2 | H2A | 60.0° | 180.0° |
H1A | C1 | C2 | H2B | 180.0° | 60.0° |
H1A | C1 | C2 | H2C | 60.0° | 60.0° |
H1B | C1 | C2 | H2A | 60.0° | 60.0° |
H1B | C1 | C2 | H2B | 60.0° | 180.0° |
H1B | C1 | C2 | H2C | 180.0° | 60.0° |
H2A | C2 | H2B | H2C | 120.0° | 120.0° |