ELL
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAE | NAH | sing | 1.47Å | 0.00Å | |
CAE | CD1 | sing | 1.55Å | 0.00Å | |
NAH | CD2 | sing | 1.34Å | 0.00Å | |
CD1 | CG | sing | 1.55Å | 0.00Å | |
CD2 | CG | sing | 1.51Å | 0.00Å | |
CD2 | OAD | doub | 1.21Å | 0.00Å | |
CG | CB | sing | 1.53Å | 0.00Å | |
O | C | doub | 1.21Å | 0.00Å | |
CB | CA | sing | 1.53Å | 0.00Å | |
CA | C | sing | 1.51Å | 0.00Å | |
CA | N | sing | 1.47Å | 0.00Å | |
NAH | H1 | sing | 0.97Å | 0.00Å | |
CAE | H9 | sing | 1.09Å | 0.00Å | |
CAE | H3 | sing | 1.09Å | 0.00Å | |
CD1 | H4 | sing | 1.09Å | 0.00Å | |
CD1 | H5 | sing | 1.09Å | 0.00Å | |
CG | H6 | sing | 1.09Å | 0.00Å | |
CB | H7 | sing | 1.09Å | 0.00Å | |
CB | H8 | sing | 1.09Å | 0.00Å | |
CA | HA | sing | 1.09Å | 0.00Å | |
N | H | sing | 1.01Å | 0.00Å | |
N | H2 | sing | 1.01Å | 0.00Å | |
C | H13 | sing | 1.08Å | 0.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
NAH | CAE | CD1 | 90.0° | 105.5° |
CAE | NAH | CD2 | 90.0° | 111.3° |
CAE | NAH | H1 | 90.0° | 124.4° |
NAH | CAE | H9 | 90.0° | 110.2° |
NAH | CAE | H3 | 90.0° | 110.3° |
CAE | CD1 | CG | 90.0° | 101.8° |
CD1 | CAE | H9 | 90.0° | 110.2° |
CD1 | CAE | H3 | 90.0° | 110.3° |
CAE | CD1 | H4 | 90.0° | 111.0° |
CAE | CD1 | H5 | 90.0° | 110.9° |
NAH | CD2 | CG | 90.0° | 110.1° |
NAH | CD2 | OAD | 90.0° | 124.9° |
CD2 | NAH | H1 | 90.0° | 124.4° |
CD1 | CG | CD2 | 90.0° | 104.2° |
CD1 | CG | CB | 90.0° | 110.3° |
CG | CD1 | H4 | 90.0° | 111.0° |
CG | CD1 | H5 | 90.0° | 111.0° |
CD1 | CG | H6 | 90.0° | 110.7° |
CG | CD2 | OAD | 90.0° | 125.0° |
CD2 | CG | CB | 90.0° | 110.4° |
CD2 | CG | H6 | 90.0° | 110.5° |
CG | CB | CA | 90.0° | 109.5° |
CB | CG | H6 | 90.0° | 110.6° |
CG | CB | H7 | 90.0° | 109.5° |
CG | CB | H8 | 90.0° | 109.5° |
O | C | CA | 90.0° | 120.0° |
O | C | H13 | 90.0° | 120.0° |
CB | CA | C | 90.0° | 109.5° |
CB | CA | N | 90.0° | 109.5° |
CA | CB | H7 | 90.0° | 109.4° |
CA | CB | H8 | 90.0° | 109.4° |
CB | CA | HA | 90.0° | 109.5° |
C | CA | N | 90.0° | 109.5° |
C | CA | HA | 90.0° | 109.5° |
CA | C | H13 | 90.0° | 120.0° |
N | CA | HA | 90.0° | 109.5° |
CA | N | H | 90.0° | 111.0° |
CA | N | H2 | 90.0° | 111.0° |
H9 | CAE | H3 | 90.0° | 110.3° |
H4 | CD1 | H5 | 90.0° | 110.9° |
H7 | CB | H8 | 90.0° | 109.5° |
H | N | H2 | 90.0° | 111.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
NAH | CAE | CD1 | H9 | 90.0° | 119.0° |
NAH | CAE | CD1 | H3 | 90.0° | 119.0° |
CAE | NAH | CD2 | H1 | 90.0° | 180.0° |
NAH | CAE | CD1 | CG | 90.0° | 25.4° |
CAE | NAH | CD2 | CG | 90.0° | 0.3° |
CAE | NAH | CD2 | OAD | 90.0° | 179.8° |
NAH | CAE | H9 | H3 | 90.0° | 122.0° |
NAH | CAE | CD1 | H4 | 90.0° | 143.5° |
NAH | CAE | CD1 | H5 | 90.0° | 92.8° |
CD1 | CAE | NAH | CD2 | 90.0° | 17.0° |
CAE | CD1 | CG | H4 | 90.0° | 118.1° |
CAE | CD1 | CG | H5 | 90.0° | 118.1° |
CAE | CD1 | CG | CD2 | 90.0° | 24.8° |
CAE | CD1 | CG | CB | 90.0° | 143.4° |
CD1 | CAE | NAH | H1 | 90.0° | 163.0° |
CD1 | CAE | H9 | H3 | 90.0° | 122.0° |
CAE | CD1 | H4 | H5 | 90.0° | 123.7° |
CAE | CD1 | CG | H6 | 90.0° | 94.0° |
NAH | CD2 | CG | CD1 | 90.0° | 16.3° |
NAH | CD2 | CG | OAD | 90.0° | 179.8° |
NAH | CD2 | CG | CB | 90.0° | 134.7° |
CD2 | NAH | CAE | H9 | 90.0° | 102.0° |
CD2 | NAH | CAE | H3 | 90.0° | 136.0° |
NAH | CD2 | CG | H6 | 90.0° | 102.6° |
CD1 | CG | CD2 | CB | 90.0° | 118.4° |
CD1 | CG | CD2 | H6 | 90.0° | 118.9° |
CD1 | CG | CD2 | OAD | 90.0° | 163.5° |
CD1 | CG | CB | H6 | 90.0° | 122.7° |
CD1 | CG | CB | CA | 90.0° | 70.8° |
CG | CD1 | CAE | H9 | 90.0° | 93.6° |
CG | CD1 | CAE | H3 | 90.0° | 144.4° |
CG | CD1 | H4 | H5 | 90.0° | 123.9° |
CD1 | CG | CB | H7 | 90.0° | 49.2° |
CD1 | CG | CB | H8 | 90.0° | 169.3° |
CD2 | CG | CB | H6 | 90.0° | 122.7° |
CD2 | CG | CB | CA | 90.0° | 174.6° |
CG | CD2 | NAH | H1 | 90.0° | 179.6° |
CD2 | CG | CD1 | H4 | 90.0° | 143.0° |
CD2 | CG | CD1 | H5 | 90.0° | 93.2° |
CD2 | CG | CB | H7 | 90.0° | 65.5° |
CD2 | CG | CB | H8 | 90.0° | 54.6° |
OAD | CD2 | CG | CB | 90.0° | 45.1° |
OAD | CD2 | NAH | H1 | 90.0° | 0.2° |
OAD | CD2 | CG | H6 | 90.0° | 77.6° |
CG | CB | CA | H7 | 90.0° | 120.0° |
CG | CB | CA | H8 | 90.0° | 119.9° |
CG | CB | CA | C | 90.0° | 174.7° |
CG | CB | CA | N | 90.0° | 65.3° |
CB | CG | CD1 | H4 | 90.0° | 98.5° |
CB | CG | CD1 | H5 | 90.0° | 25.3° |
CG | CB | H7 | H8 | 90.0° | 120.0° |
CG | CB | CA | HA | 90.0° | 54.7° |
O | C | CA | CB | 90.0° | 120.0° |
O | C | CA | H13 | 90.0° | 179.9° |
O | C | CA | N | 90.0° | 0.0° |
O | C | CA | HA | 90.0° | 120.0° |
CB | CA | C | N | 90.0° | 120.0° |
CB | CA | C | HA | 90.0° | 120.0° |
CB | CA | N | HA | 90.0° | 120.0° |
CA | CB | CG | H6 | 90.0° | 51.9° |
CA | CB | H7 | H8 | 90.0° | 120.0° |
CB | CA | N | H | 90.0° | 176.0° |
CB | CA | N | H2 | 90.0° | 59.9° |
CB | CA | C | H13 | 90.0° | 60.0° |
C | CA | N | HA | 90.0° | 120.0° |
C | CA | CB | H7 | 90.0° | 54.7° |
C | CA | CB | H8 | 90.0° | 65.3° |
C | CA | N | H | 90.0° | 64.0° |
C | CA | N | H2 | 90.0° | 60.0° |
N | CA | CB | H7 | 90.0° | 174.7° |
N | CA | CB | H8 | 90.0° | 54.6° |
CA | N | H | H2 | 90.0° | 124.0° |
N | CA | C | H13 | 90.0° | 180.0° |
H1 | NAH | CAE | H9 | 90.0° | 78.0° |
H1 | NAH | CAE | H3 | 90.0° | 44.0° |
H9 | CAE | CD1 | H4 | 90.0° | 24.6° |
H9 | CAE | CD1 | H5 | 90.0° | 148.3° |
H3 | CAE | CD1 | H4 | 90.0° | 97.4° |
H3 | CAE | CD1 | H5 | 90.0° | 26.3° |
H4 | CD1 | CG | H6 | 90.0° | 24.1° |
H5 | CD1 | CG | H6 | 90.0° | 147.9° |
H6 | CG | CB | H7 | 90.0° | 171.9° |
H6 | CG | CB | H8 | 90.0° | 68.0° |
H7 | CB | CA | HA | 90.0° | 65.3° |
H8 | CB | CA | HA | 90.0° | 174.7° |
HA | CA | N | H | 90.0° | 56.0° |
HA | CA | N | H2 | 90.0° | 179.9° |
HA | CA | C | H13 | 90.0° | 60.0° |