E7L
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OAD | CAB | doub | 1.21Å | 1.24Å | |
NAA | CAB | sing | 1.35Å | 1.34Å | |
NAA | CAE | sing | 1.46Å | 1.47Å | |
CAB | CAC | sing | 1.51Å | 1.54Å | |
O | C | doub | 1.21Å | 1.23Å | |
CAE | CAF | sing | 1.53Å | 1.52Å | |
CAF | SAG | sing | 1.81Å | 1.84Å | |
C | CA | sing | 1.51Å | 1.54Å | |
C | SAG | sing | 1.71Å | 1.79Å | |
CD1 | CG | sing | 1.53Å | 1.52Å | |
CA | N | sing | 1.47Å | 1.49Å | |
CA | CB | sing | 1.53Å | 1.54Å | |
CG | CB | sing | 1.53Å | 1.54Å | |
CG | CD2 | sing | 1.53Å | 1.54Å | |
N | H1 | sing | 1.01Å | 1.00Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
CA | H4 | sing | 1.09Å | 1.10Å | |
CB | H5 | sing | 1.09Å | 1.10Å | |
CB | H6 | sing | 1.09Å | 1.10Å | |
CG | H7 | sing | 1.09Å | 1.10Å | |
CD1 | H8 | sing | 1.09Å | 1.10Å | |
CD1 | H9 | sing | 1.09Å | 1.10Å | |
CD1 | H10 | sing | 1.09Å | 1.10Å | |
CD2 | H11 | sing | 1.09Å | 1.10Å | |
CD2 | H12 | sing | 1.09Å | 1.10Å | |
CD2 | H13 | sing | 1.09Å | 1.10Å | |
CAC | H14 | sing | 1.09Å | 1.10Å | |
CAC | H15 | sing | 1.09Å | 1.10Å | |
CAC | H16 | sing | 1.09Å | 1.10Å | |
CAE | H17 | sing | 1.09Å | 1.10Å | |
CAE | H18 | sing | 1.09Å | 1.10Å | |
CAF | H19 | sing | 1.09Å | 1.10Å | |
CAF | H20 | sing | 1.09Å | 1.10Å | |
NAA | H21 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OAD | CAB | NAA | 123.1° | 120.0° |
OAD | CAB | CAC | 122.5° | 120.0° |
CAB | NAA | CAE | 123.3° | 120.0° |
NAA | CAB | CAC | 114.4° | 120.0° |
CAB | NAA | H21 | 118.3° | 120.0° |
NAA | CAE | CAF | 102.9° | 109.5° |
NAA | CAE | H17 | 111.1° | 109.4° |
NAA | CAE | H18 | 111.1° | 109.5° |
CAE | NAA | H21 | 118.4° | 120.0° |
CAB | CAC | H14 | 109.5° | 109.5° |
CAB | CAC | H15 | 109.4° | 109.5° |
CAB | CAC | H16 | 109.4° | 109.5° |
O | C | CA | 119.1° | 120.0° |
O | C | SAG | 124.6° | 120.0° |
CAE | CAF | SAG | 114.1° | 109.5° |
CAF | CAE | H17 | 111.1° | 109.4° |
CAF | CAE | H18 | 111.1° | 109.5° |
CAE | CAF | H19 | 108.3° | 109.5° |
CAE | CAF | H20 | 108.3° | 109.4° |
CAF | SAG | C | 104.1° | 100.0° |
SAG | CAF | H19 | 108.3° | 109.5° |
SAG | CAF | H20 | 108.3° | 109.5° |
CA | C | SAG | 116.2° | 120.0° |
C | CA | N | 112.7° | 109.5° |
C | CA | CB | 108.2° | 109.5° |
C | CA | H4 | 107.2° | 109.5° |
CD1 | CG | CB | 109.9° | 109.5° |
CD1 | CG | CD2 | 109.8° | 109.5° |
CD1 | CG | H7 | 109.0° | 109.5° |
CG | CD1 | H8 | 109.5° | 109.5° |
CG | CD1 | H9 | 109.4° | 109.5° |
CG | CD1 | H10 | 109.5° | 109.5° |
N | CA | CB | 113.4° | 109.5° |
CA | N | H1 | 109.5° | 111.0° |
CA | N | H2 | 109.5° | 111.0° |
N | CA | H4 | 107.9° | 109.5° |
CA | CB | CG | 108.3° | 109.5° |
CB | CA | H4 | 107.2° | 109.4° |
CA | CB | H5 | 109.8° | 109.5° |
CA | CB | H6 | 109.8° | 109.5° |
CB | CG | CD2 | 110.6° | 109.5° |
CG | CB | H5 | 109.8° | 109.5° |
CG | CB | H6 | 109.7° | 109.5° |
CB | CG | H7 | 108.8° | 109.5° |
CD2 | CG | H7 | 108.7° | 109.4° |
CG | CD2 | H11 | 109.5° | 109.4° |
CG | CD2 | H12 | 109.5° | 109.5° |
CG | CD2 | H13 | 109.5° | 109.4° |
H1 | N | H2 | 109.5° | 111.0° |
H5 | CB | H6 | 109.5° | 109.4° |
H8 | CD1 | H9 | 109.5° | 109.4° |
H8 | CD1 | H10 | 109.4° | 109.5° |
H9 | CD1 | H10 | 109.5° | 109.4° |
H11 | CD2 | H12 | 109.5° | 109.5° |
H11 | CD2 | H13 | 109.5° | 109.4° |
H12 | CD2 | H13 | 109.4° | 109.5° |
H14 | CAC | H15 | 109.4° | 109.4° |
H14 | CAC | H16 | 109.5° | 109.5° |
H15 | CAC | H16 | 109.5° | 109.4° |
H17 | CAE | H18 | 109.5° | 109.5° |
H19 | CAF | H20 | 109.4° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OAD | CAB | NAA | CAC | 178.4° | 180.0° |
OAD | CAB | NAA | CAE | 178.7° | 0.0° |
OAD | CAB | CAC | H14 | 0.0° | 120.0° |
OAD | CAB | CAC | H15 | 120.0° | 0.0° |
OAD | CAB | CAC | H16 | 120.0° | 119.9° |
OAD | CAB | NAA | H21 | 1.3° | 180.0° |
CAB | NAA | CAE | H21 | 180.0° | 180.0° |
CAB | NAA | CAE | CAF | 103.5° | 180.0° |
NAA | CAB | CAC | H14 | 178.4° | 60.0° |
NAA | CAB | CAC | H15 | 61.6° | 180.0° |
NAA | CAB | CAC | H16 | 58.4° | 60.0° |
CAB | NAA | CAE | H17 | 137.6° | 60.0° |
CAB | NAA | CAE | H18 | 15.5° | 59.9° |
CAE | NAA | CAB | CAC | 2.9° | 180.0° |
NAA | CAE | CAF | H17 | 119.0° | 120.0° |
NAA | CAE | CAF | H18 | 118.9° | 120.1° |
NAA | CAE | CAF | SAG | 89.3° | 180.0° |
NAA | CAE | H17 | H18 | 123.0° | 120.0° |
NAA | CAE | CAF | H19 | 31.4° | 60.0° |
NAA | CAE | CAF | H20 | 150.0° | 60.0° |
CAB | CAC | H14 | H15 | 120.0° | 120.0° |
CAB | CAC | H14 | H16 | 120.0° | 120.1° |
CAB | CAC | H15 | H16 | 120.0° | 120.0° |
CAC | CAB | NAA | H21 | 177.1° | 0.0° |
O | C | SAG | CAF | 32.9° | 0.1° |
O | C | CA | SAG | 175.8° | 179.9° |
O | C | CA | N | 140.1° | 20.0° |
O | C | CA | CB | 93.7° | 100.1° |
O | C | CA | H4 | 21.6° | 140.0° |
CAE | CAF | SAG | H19 | 120.7° | 120.0° |
CAE | CAF | SAG | H20 | 120.7° | 120.0° |
CAE | CAF | SAG | C | 115.7° | 180.0° |
CAF | CAE | H17 | H18 | 123.0° | 120.0° |
CAE | CAF | H19 | H20 | 117.9° | 120.0° |
CAF | CAE | NAA | H21 | 76.5° | 0.0° |
CAF | SAG | C | CA | 151.5° | 180.0° |
SAG | CAF | CAE | H17 | 151.7° | 60.0° |
SAG | CAF | CAE | H18 | 29.7° | 60.0° |
SAG | CAF | H19 | H20 | 117.9° | 120.0° |
C | CA | N | CB | 123.3° | 120.0° |
C | CA | N | H4 | 118.1° | 120.0° |
C | CA | CB | H4 | 115.3° | 120.0° |
C | CA | CB | CG | 88.7° | 175.0° |
C | CA | N | H1 | 180.0° | 60.0° |
C | CA | N | H2 | 60.0° | 63.9° |
C | CA | CB | H5 | 31.1° | 54.9° |
C | CA | CB | H6 | 151.4° | 65.0° |
SAG | C | CA | N | 44.1° | 159.9° |
SAG | C | CA | CB | 82.1° | 80.0° |
SAG | C | CA | H4 | 162.6° | 39.9° |
C | SAG | CAF | H19 | 5.0° | 60.0° |
C | SAG | CAF | H20 | 123.6° | 60.0° |
CD1 | CG | CB | CA | 89.5° | 65.0° |
CD1 | CG | CB | CD2 | 121.4° | 120.0° |
CD1 | CG | CB | H7 | 119.2° | 120.1° |
CD1 | CG | CD2 | H7 | 119.2° | 120.0° |
CD1 | CG | CB | H5 | 30.3° | 55.0° |
CD1 | CG | CB | H6 | 150.6° | 175.0° |
CG | CD1 | H8 | H9 | 120.0° | 120.0° |
CG | CD1 | H8 | H10 | 120.0° | 120.0° |
CG | CD1 | H9 | H10 | 120.0° | 120.0° |
CD1 | CG | CD2 | H11 | 180.0° | 180.0° |
CD1 | CG | CD2 | H12 | 60.0° | 60.0° |
CD1 | CG | CD2 | H13 | 60.0° | 60.0° |
N | CA | CB | H4 | 119.0° | 120.0° |
N | CA | CB | CG | 145.5° | 65.0° |
CA | N | H1 | H2 | 120.0° | 124.0° |
N | CA | CB | H5 | 94.6° | 175.0° |
N | CA | CB | H6 | 25.7° | 55.1° |
CA | CB | CG | H5 | 119.8° | 120.1° |
CA | CB | CG | H6 | 119.8° | 120.0° |
CA | CB | CG | CD2 | 149.0° | 175.0° |
CB | CA | N | H1 | 56.7° | 60.0° |
CB | CA | N | H2 | 63.3° | 176.0° |
CA | CB | H5 | H6 | 120.5° | 120.0° |
CA | CB | CG | H7 | 29.7° | 55.0° |
CB | CG | CD2 | H7 | 119.4° | 120.0° |
CG | CB | CA | H4 | 26.5° | 55.0° |
CG | CB | H5 | H6 | 120.5° | 120.0° |
CB | CG | CD1 | H8 | 180.0° | 60.0° |
CB | CG | CD1 | H9 | 60.0° | 180.0° |
CB | CG | CD1 | H10 | 60.0° | 60.0° |
CB | CG | CD2 | H11 | 58.6° | 60.0° |
CB | CG | CD2 | H12 | 178.6° | 180.0° |
CB | CG | CD2 | H13 | 61.4° | 60.0° |
CD2 | CG | CB | H5 | 91.1° | 65.0° |
CD2 | CG | CB | H6 | 29.2° | 55.0° |
CD2 | CG | CD1 | H8 | 58.1° | 60.0° |
CD2 | CG | CD1 | H9 | 178.1° | 60.0° |
CD2 | CG | CD1 | H10 | 61.9° | 180.0° |
CG | CD2 | H11 | H12 | 120.0° | 120.0° |
CG | CD2 | H11 | H13 | 120.0° | 119.9° |
CG | CD2 | H12 | H13 | 120.0° | 120.0° |
H1 | N | CA | H4 | 61.9° | 180.0° |
H2 | N | CA | H4 | 178.1° | 56.1° |
H4 | CA | CB | H5 | 146.4° | 65.0° |
H4 | CA | CB | H6 | 93.3° | 175.0° |
H5 | CB | CG | H7 | 149.5° | 175.1° |
H6 | CB | CG | H7 | 90.2° | 65.0° |
H7 | CG | CD1 | H8 | 60.9° | 180.0° |
H7 | CG | CD1 | H9 | 59.1° | 60.0° |
H7 | CG | CD1 | H10 | 179.1° | 60.0° |
H7 | CG | CD2 | H11 | 60.8° | 60.0° |
H7 | CG | CD2 | H12 | 59.2° | 60.0° |
H7 | CG | CD2 | H13 | 179.2° | 179.9° |
H8 | CD1 | H9 | H10 | 120.0° | 120.0° |
H11 | CD2 | H12 | H13 | 120.0° | 120.0° |
H14 | CAC | H15 | H16 | 120.0° | 120.0° |
H17 | CAE | CAF | H19 | 87.6° | 60.0° |
H17 | CAE | CAF | H20 | 31.0° | 180.0° |
H17 | CAE | NAA | H21 | 42.4° | 120.0° |
H18 | CAE | CAF | H19 | 150.3° | 180.0° |
H18 | CAE | CAF | H20 | 91.1° | 60.0° |
H18 | CAE | NAA | H21 | 164.5° | 120.0° |