U2M
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O | C | doub | 1.21Å | 1.18Å | |
CA | C | sing | 1.51Å | 1.32Å | |
CA | N | sing | 1.47Å | 1.26Å | |
CA | CB | sing | 1.53Å | 1.53Å | |
CG | CB | sing | 1.53Å | 1.52Å | |
CG | CD | sing | 1.53Å | 1.53Å | |
SH | CZ | sing | 1.81Å | 1.60Å | |
CE | CZ | sing | 1.53Å | 1.52Å | |
CE | CD | sing | 1.53Å | 1.52Å | |
N | H | sing | 1.01Å | 1.00Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
CB | H6 | sing | 1.09Å | 1.10Å | |
CB | H7 | sing | 1.09Å | 1.10Å | |
CG | H8 | sing | 1.09Å | 1.10Å | |
CG | H9 | sing | 1.09Å | 1.10Å | |
CD | H10 | sing | 1.09Å | 1.10Å | |
CD | H11 | sing | 1.09Å | 1.10Å | |
CE | H12 | sing | 1.09Å | 1.10Å | |
CE | H13 | sing | 1.09Å | 1.10Å | |
CZ | H14 | sing | 1.09Å | 1.10Å | |
CZ | H15 | sing | 1.09Å | 1.10Å | |
SH | H16 | sing | 1.34Å | 1.30Å | |
C | OXT | sing | 1.34Å | 1.33Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O | C | CA | 120.4° | 120.0° |
O | C | OXT | 123.2° | 119.9° |
C | CA | N | 117.8° | 109.5° |
C | CA | CB | 106.8° | 109.5° |
C | CA | HA | 108.8° | 109.4° |
CA | C | OXT | 116.4° | 120.1° |
N | CA | CB | 107.1° | 109.5° |
CA | N | H | 109.5° | 111.0° |
CA | N | H2 | 109.5° | 111.0° |
N | CA | HA | 109.7° | 109.5° |
CA | CB | CG | 110.6° | 109.5° |
CB | CA | HA | 106.1° | 109.4° |
CA | CB | H6 | 109.2° | 109.4° |
CA | CB | H7 | 109.2° | 109.6° |
CB | CG | CD | 108.3° | 109.5° |
CG | CB | H6 | 109.2° | 109.4° |
CG | CB | H7 | 109.2° | 109.5° |
CB | CG | H8 | 109.8° | 109.5° |
CB | CG | H9 | 109.8° | 109.5° |
CG | CD | CE | 108.8° | 109.5° |
CD | CG | H8 | 109.8° | 109.5° |
CD | CG | H9 | 109.8° | 109.4° |
CG | CD | H10 | 109.6° | 109.5° |
CG | CD | H11 | 109.7° | 109.4° |
SH | CZ | CE | 111.3° | 109.5° |
SH | CZ | H14 | 109.0° | 109.5° |
SH | CZ | H15 | 109.0° | 109.5° |
CZ | SH | H16 | 102.0° | 103.0° |
CZ | CE | CD | 109.1° | 109.5° |
CZ | CE | H12 | 109.6° | 109.5° |
CZ | CE | H13 | 109.6° | 109.5° |
CE | CZ | H14 | 109.0° | 109.5° |
CE | CZ | H15 | 109.0° | 109.5° |
CE | CD | H10 | 109.6° | 109.5° |
CE | CD | H11 | 109.6° | 109.5° |
CD | CE | H12 | 109.5° | 109.5° |
CD | CE | H13 | 109.6° | 109.5° |
H | N | H2 | 109.5° | 111.0° |
H6 | CB | H7 | 109.4° | 109.5° |
H8 | CG | H9 | 109.4° | 109.5° |
H10 | CD | H11 | 109.5° | 109.5° |
H12 | CE | H13 | 109.5° | 109.5° |
H14 | CZ | H15 | 109.5° | 109.5° |
C | OXT | HXT | 109.5° | 117.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O | C | CA | OXT | 178.7° | 179.9° |
O | C | CA | N | 143.7° | 20.0° |
O | C | CA | CB | 95.9° | 100.0° |
O | C | CA | HA | 18.2° | 140.0° |
O | C | OXT | HXT | 0.0° | 0.0° |
C | CA | N | CB | 120.2° | 120.0° |
C | CA | N | HA | 125.1° | 120.0° |
C | CA | CB | HA | 115.9° | 119.9° |
C | CA | CB | CG | 121.2° | 175.0° |
C | CA | N | H | 180.0° | 60.0° |
C | CA | N | H2 | 60.0° | 176.0° |
C | CA | CB | H6 | 118.6° | 65.1° |
C | CA | CB | H7 | 1.0° | 54.9° |
CA | C | OXT | HXT | 178.6° | 180.0° |
N | CA | CB | HA | 117.1° | 120.0° |
N | CA | CB | CG | 111.8° | 65.0° |
CA | N | H | H2 | 120.0° | 124.0° |
N | CA | CB | H6 | 8.4° | 55.0° |
N | CA | CB | H7 | 128.0° | 175.0° |
N | CA | C | OXT | 37.6° | 160.0° |
CA | CB | CG | H6 | 120.2° | 119.9° |
CA | CB | CG | H7 | 120.2° | 120.1° |
CA | CB | CG | CD | 167.2° | 179.9° |
CB | CA | N | H | 59.8° | 60.0° |
CB | CA | N | H2 | 179.8° | 64.0° |
CA | CB | H6 | H7 | 119.5° | 120.1° |
CA | CB | CG | H8 | 73.0° | 60.1° |
CA | CB | CG | H9 | 47.4° | 60.0° |
CB | CA | C | OXT | 82.7° | 79.9° |
CB | CG | CD | H8 | 119.8° | 120.0° |
CB | CG | CD | H9 | 119.8° | 120.0° |
CB | CG | CD | CE | 138.7° | NaN° |
CG | CB | CA | HA | 5.3° | 55.1° |
CG | CB | H6 | H7 | 119.5° | 120.0° |
CB | CG | H8 | H9 | 120.5° | 120.0° |
CB | CG | CD | H10 | 101.4° | 60.0° |
CB | CG | CD | H11 | 18.8° | 60.0° |
CG | CD | CE | CZ | 149.0° | 180.0° |
CG | CD | CE | H10 | 119.9° | 120.0° |
CG | CD | CE | H11 | 119.9° | 120.0° |
CD | CG | CB | H6 | 47.0° | 60.0° |
CD | CG | CB | H7 | 72.6° | 59.9° |
CD | CG | H8 | H9 | 120.5° | 120.0° |
CG | CD | H10 | H11 | 120.3° | 120.0° |
CG | CD | CE | H12 | 29.0° | 60.0° |
CG | CD | CE | H13 | 91.1° | 60.0° |
SH | CZ | CE | H14 | 120.3° | 120.0° |
SH | CZ | CE | H15 | 120.3° | 120.0° |
SH | CZ | CE | CD | 172.3° | 180.0° |
SH | CZ | CE | H12 | 52.4° | 60.0° |
SH | CZ | CE | H13 | 67.7° | 60.0° |
SH | CZ | H14 | H15 | 119.2° | 120.0° |
CZ | CE | CD | H12 | 120.0° | 120.0° |
CZ | CE | CD | H13 | 119.9° | 120.0° |
CZ | CE | CD | H10 | 29.1° | 60.0° |
CZ | CE | CD | H11 | 91.1° | 60.0° |
CZ | CE | H12 | H13 | 120.2° | 120.0° |
CE | CZ | H14 | H15 | 119.2° | 120.0° |
CE | CZ | SH | H16 | 180.0° | 180.0° |
CE | CD | CG | H8 | 18.9° | 60.0° |
CE | CD | CG | H9 | 101.5° | 60.0° |
CE | CD | H10 | H11 | 120.3° | 120.0° |
CD | CE | H12 | H13 | 120.1° | 120.0° |
CD | CE | CZ | H14 | 67.4° | 60.0° |
CD | CE | CZ | H15 | 52.0° | 60.0° |
H | N | CA | HA | 54.9° | 180.0° |
H2 | N | CA | HA | 65.1° | 56.0° |
HA | CA | CB | H6 | 125.5° | 175.0° |
HA | CA | CB | H7 | 114.9° | 65.0° |
HA | CA | C | OXT | 163.1° | 40.0° |
H6 | CB | CG | H8 | 166.9° | 180.0° |
H6 | CB | CG | H9 | 72.8° | 60.0° |
H7 | CB | CG | H8 | 47.2° | 60.1° |
H7 | CB | CG | H9 | 167.6° | 179.9° |
H8 | CG | CD | H10 | 138.7° | 180.0° |
H8 | CG | CD | H11 | 101.0° | 60.0° |
H9 | CG | CD | H10 | 18.4° | 60.0° |
H9 | CG | CD | H11 | 138.6° | 180.0° |
H10 | CD | CE | H12 | 90.9° | 180.0° |
H10 | CD | CE | H13 | 149.0° | 60.0° |
H11 | CD | CE | H12 | 148.9° | 60.0° |
H11 | CD | CE | H13 | 28.8° | 180.0° |
H12 | CE | CZ | H14 | 172.6° | 180.0° |
H12 | CE | CZ | H15 | 67.9° | 60.0° |
H13 | CE | CZ | H14 | 52.5° | 60.0° |
H13 | CE | CZ | H15 | 172.0° | 180.0° |
H14 | CZ | SH | H16 | 59.7° | 60.0° |
H15 | CZ | SH | H16 | 59.7° | 60.0° |