TP7
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N | CA | sing | 1.46Å | 1.45Å | |
N | C1 | sing | 1.35Å | 1.35Å | |
P | O1P | doub | 1.48Å | 1.51Å | |
P | O2P | sing | 1.61Å | 1.61Å | |
P | O3P | sing | 1.61Å | 1.51Å | |
P | O4P | sing | 1.61Å | 1.52Å | |
O4P | CB | sing | 1.43Å | 3.81Å | |
CB | CA | sing | 1.53Å | 1.53Å | |
CB | CG | sing | 1.53Å | 1.51Å | |
C | O | sing | 1.34Å | 1.28Å | |
C | OXT | doub | 1.21Å | 1.25Å | |
C | CA | sing | 1.51Å | 1.52Å | |
O1 | C1 | doub | 1.21Å | 1.25Å | |
C1 | C2 | sing | 1.51Å | 1.52Å | |
C2 | C3 | sing | 1.53Å | 1.52Å | |
C3 | C4 | sing | 1.53Å | 1.57Å | |
C4 | C5 | sing | 1.53Å | 1.55Å | |
C5 | C6 | sing | 1.53Å | 1.53Å | |
C6 | C7 | sing | 1.53Å | 1.54Å | |
C7 | S7 | sing | 1.81Å | 1.81Å | |
N | H | sing | 0.97Å | 65.64Å | |
CA | HA | sing | 1.09Å | 64.80Å | |
O2P | H2P | sing | 0.97Å | 64.27Å | |
O3P | H3P | sing | 0.97Å | 64.33Å | |
CB | HB | sing | 1.09Å | 64.92Å | |
CG | HG1C | sing | 1.09Å | 66.34Å | |
CG | HG2C | sing | 1.09Å | 66.34Å | |
CG | HG3C | sing | 1.09Å | 66.34Å | |
O | HC | sing | 0.97Å | 63.00Å | |
C2 | H21C | sing | 1.09Å | 67.46Å | |
C2 | H22C | sing | 1.09Å | 67.46Å | |
C3 | H31C | sing | 1.09Å | 68.42Å | |
C3 | H32C | sing | 1.09Å | 68.42Å | |
C4 | H41C | sing | 1.09Å | 68.85Å | |
C4 | H42C | sing | 1.09Å | 68.85Å | |
C5 | H51C | sing | 1.09Å | 69.54Å | |
C5 | H52C | sing | 1.09Å | 69.54Å | |
C6 | H61C | sing | 1.09Å | 70.82Å | |
C6 | H62C | sing | 1.09Å | 70.82Å | |
C7 | H71C | sing | 1.09Å | 71.89Å | |
C7 | H72C | sing | 1.09Å | 71.89Å | |
S7 | H7 | sing | 1.34Å | 73.46Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CA | N | C1 | 123.2° | 120.0° |
N | CA | CB | 111.9° | 109.4° |
N | CA | C | 109.7° | 109.5° |
CA | N | H | 54.4° | 120.0° |
N | CA | HA | 124.5° | 109.5° |
N | C1 | O1 | 120.5° | 120.0° |
N | C1 | C2 | 116.2° | 120.0° |
C1 | N | H | 150.8° | 120.0° |
O1P | P | O2P | 107.7° | 109.5° |
O1P | P | O3P | 113.9° | 109.5° |
O1P | P | O4P | 112.7° | 109.5° |
O2P | P | O3P | 108.1° | 109.5° |
O2P | P | O4P | 101.7° | 109.4° |
P | O2P | H2P | 55.7° | 114.0° |
O3P | P | O4P | 111.9° | 109.5° |
P | O3P | H3P | 50.3° | 114.0° |
P | O4P | CB | 33.1° | 123.0° |
O4P | CB | CA | 114.1° | 109.5° |
O4P | CB | CG | 115.6° | 109.5° |
O4P | CB | HB | 53.8° | 109.4° |
CA | CB | CG | 114.6° | 109.5° |
CB | CA | C | 110.6° | 109.5° |
CB | CA | HA | 93.6° | 109.4° |
CA | CB | HB | 85.1° | 109.5° |
CG | CB | HB | 160.2° | 109.4° |
CB | CG | HG1C | 19.4° | 109.5° |
CB | CG | HG2C | 19.4° | 109.5° |
CB | CG | HG3C | 19.4° | 109.5° |
O | C | OXT | 125.8° | 119.9° |
O | C | CA | 117.5° | 120.0° |
C | O | HC | 106.2° | 117.0° |
OXT | C | CA | 116.6° | 120.0° |
C | CA | HA | 18.3° | 109.5° |
O1 | C1 | C2 | 123.3° | 120.0° |
C1 | C2 | C3 | 112.1° | 109.5° |
C1 | C2 | H21C | 64.6° | 109.4° |
C1 | C2 | H22C | 64.6° | 109.5° |
C2 | C3 | C4 | 111.5° | 109.5° |
C3 | C2 | H21C | 128.4° | 109.4° |
C3 | C2 | H22C | 128.4° | 109.5° |
C2 | C3 | H31C | 50.6° | 109.4° |
C2 | C3 | H32C | 50.6° | 109.5° |
C3 | C4 | C5 | 114.0° | 109.5° |
C4 | C3 | H31C | 105.5° | 109.5° |
C4 | C3 | H32C | 105.5° | 109.5° |
C3 | C4 | H41C | 73.3° | 109.5° |
C3 | C4 | H42C | 73.3° | 109.5° |
C4 | C5 | C6 | 115.4° | 109.4° |
C5 | C4 | H41C | 115.7° | 109.5° |
C5 | C4 | H42C | 115.7° | 109.5° |
C4 | C5 | H51C | 63.1° | 109.5° |
C4 | C5 | H52C | 63.1° | 109.5° |
C5 | C6 | C7 | 110.1° | 109.4° |
C6 | C5 | H51C | 147.0° | 109.5° |
C6 | C5 | H52C | 147.0° | 109.5° |
C5 | C6 | H61C | 32.4° | 109.5° |
C5 | C6 | H62C | 32.4° | 109.5° |
C6 | C7 | S7 | 112.8° | 109.4° |
C7 | C6 | H61C | 133.8° | 109.5° |
C7 | C6 | H62C | 133.8° | 109.5° |
C6 | C7 | H71C | 45.3° | 109.5° |
C6 | C7 | H72C | 45.3° | 109.5° |
S7 | C7 | H71C | 149.7° | 109.4° |
S7 | C7 | H72C | 149.7° | 109.5° |
C7 | S7 | H7 | 29.6° | 103.0° |
HG1C | CG | HG2C | 0.0° | 109.4° |
HG1C | CG | HG3C | 0.0° | 109.4° |
HG2C | CG | HG3C | 0.0° | 109.4° |
H21C | C2 | H22C | 0.0° | 109.5° |
H31C | C3 | H32C | 0.0° | 109.5° |
H41C | C4 | H42C | 0.0° | 109.5° |
H51C | C5 | H52C | 0.0° | 109.5° |
H61C | C6 | H62C | 0.0° | 109.5° |
H71C | C7 | H72C | 0.0° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CA | N | C1 | H | 75.2° | 179.7° |
N | CA | CB | O4P | 83.1° | 65.0° |
N | CA | CB | C | 122.6° | 120.0° |
N | CA | CB | HA | 129.6° | 120.0° |
N | CA | CB | CG | 53.3° | 55.0° |
N | CA | C | O | 27.1° | 180.0° |
N | CA | C | OXT | 151.4° | 0.0° |
N | CA | C | HA | 146.6° | 120.1° |
CA | N | C1 | O1 | 10.5° | 0.1° |
CA | N | C1 | C2 | 168.3° | 180.0° |
N | CA | CB | HB | 129.6° | 175.0° |
C1 | N | CA | CB | 104.4° | 155.0° |
C1 | N | CA | C | 132.4° | 85.0° |
N | C1 | O1 | C2 | 178.6° | 180.0° |
N | C1 | C2 | C3 | 155.0° | 180.0° |
C1 | N | CA | HA | 144.6° | 35.1° |
N | C1 | C2 | H21C | 31.6° | 60.1° |
N | C1 | C2 | H22C | 31.6° | 59.9° |
O1P | P | O2P | O3P | 123.5° | 120.0° |
O1P | P | O2P | O4P | 118.7° | 120.0° |
O1P | P | O3P | O4P | 129.3° | 120.0° |
O1P | P | O4P | CB | 108.6° | 55.0° |
O1P | P | O2P | H2P | 51.4° | 180.0° |
O1P | P | O3P | H3P | 54.9° | 60.0° |
O2P | P | O3P | O4P | 111.1° | 120.0° |
O2P | P | O4P | CB | 6.4° | 65.0° |
O2P | P | O3P | H3P | 174.5° | 60.0° |
O3P | P | O4P | CB | 121.5° | 175.0° |
O3P | P | O2P | H2P | 174.9° | 60.0° |
P | O4P | CB | CA | 146.8° | 120.0° |
P | O4P | CB | CG | 77.3° | 119.9° |
O4P | P | O2P | H2P | 67.3° | 60.0° |
O4P | P | O3P | H3P | 74.4° | 179.9° |
P | O4P | CB | HB | 83.2° | 0.0° |
O4P | CB | CA | CG | 136.4° | 120.0° |
O4P | CB | CA | HB | 46.5° | 120.0° |
O4P | CB | CG | HB | 52.8° | 119.9° |
O4P | CB | CA | C | 39.5° | 55.0° |
O4P | CB | CA | HA | 46.5° | 175.0° |
O4P | CB | CG | HG1C | 52.8° | 180.0° |
O4P | CB | CG | HG2C | 52.8° | 60.1° |
O4P | CB | CG | HG3C | 52.8° | 59.9° |
CA | CB | CG | HB | 171.5° | 120.0° |
CB | CA | C | O | 96.9° | 60.0° |
CB | CA | C | OXT | 84.7° | 120.0° |
CB | CA | C | HA | 22.7° | 120.0° |
CB | CA | N | H | 111.0° | 25.3° |
CA | CB | CG | HG1C | 171.5° | 60.0° |
CA | CB | CG | HG2C | 171.5° | 60.0° |
CA | CB | CG | HG3C | 171.5° | 180.0° |
CG | CB | CA | C | 175.9° | 175.0° |
CG | CB | CA | HA | 177.1° | 65.0° |
CB | CG | HG1C | HG2C | 90.0° | 120.0° |
CB | CG | HG1C | HG3C | 90.0° | 120.1° |
CB | CG | HG2C | HG3C | 90.0° | 120.1° |
O | C | OXT | CA | 178.3° | 180.0° |
O | C | CA | HA | 119.5° | 60.0° |
OXT | C | CA | HA | 62.0° | 120.0° |
OXT | C | O | HC | 18.8° | 0.0° |
C | CA | N | H | 12.1° | 94.7° |
C | CA | CB | HB | 7.0° | 65.0° |
CA | C | O | HC | 162.9° | 180.0° |
O1 | C1 | C2 | C3 | 23.7° | 0.0° |
O1 | C1 | N | H | 85.7° | 179.7° |
O1 | C1 | C2 | H21C | 147.1° | 120.0° |
O1 | C1 | C2 | H22C | 147.1° | 120.0° |
C1 | C2 | C3 | H21C | 74.5° | 119.9° |
C1 | C2 | C3 | H22C | 74.5° | 120.0° |
C1 | C2 | C3 | C4 | 167.1° | 180.0° |
C2 | C1 | N | H | 93.0° | 0.3° |
C1 | C2 | H21C | H22C | 90.0° | 120.0° |
C1 | C2 | C3 | H31C | 74.5° | 60.1° |
C1 | C2 | C3 | H32C | 74.5° | 60.0° |
C2 | C3 | C4 | H31C | 53.2° | 120.0° |
C2 | C3 | C4 | H32C | 53.2° | 120.0° |
C2 | C3 | C4 | C5 | 58.1° | 180.0° |
C3 | C2 | H21C | H22C | 90.0° | 120.0° |
C2 | C3 | H31C | H32C | 90.0° | 120.0° |
C2 | C3 | C4 | H41C | 53.2° | 60.0° |
C2 | C3 | C4 | H42C | 53.2° | 60.0° |
C3 | C4 | C5 | H41C | 82.3° | 120.0° |
C3 | C4 | C5 | H42C | 82.3° | 120.0° |
C3 | C4 | C5 | C6 | 60.9° | 180.0° |
C4 | C3 | C2 | H21C | 92.7° | 60.0° |
C4 | C3 | C2 | H22C | 92.7° | 60.0° |
C4 | C3 | H31C | H32C | 90.0° | 120.0° |
C3 | C4 | H41C | H42C | 90.0° | 120.0° |
C3 | C4 | C5 | H51C | 82.3° | 60.0° |
C3 | C4 | C5 | H52C | 82.3° | 60.0° |
C4 | C5 | C6 | H51C | 79.1° | 120.0° |
C4 | C5 | C6 | H52C | 79.1° | 120.0° |
C4 | C5 | C6 | C7 | 63.9° | NaN° |
C5 | C4 | C3 | H31C | 111.3° | 60.0° |
C5 | C4 | C3 | H32C | 111.3° | 60.0° |
C5 | C4 | H41C | H42C | 90.0° | 120.0° |
C4 | C5 | H51C | H52C | 90.0° | 120.0° |
C4 | C5 | C6 | H61C | 79.1° | 60.0° |
C4 | C5 | C6 | H62C | 79.1° | 60.0° |
C5 | C6 | C7 | H61C | 26.5° | 120.0° |
C5 | C6 | C7 | H62C | 26.5° | 120.0° |
C5 | C6 | C7 | S7 | 179.1° | 180.0° |
C6 | C5 | C4 | H41C | 143.1° | 60.0° |
C6 | C5 | C4 | H42C | 143.1° | 60.0° |
C6 | C5 | H51C | H52C | 90.0° | 120.0° |
C5 | C6 | H61C | H62C | 90.0° | 120.0° |
C5 | C6 | C7 | H71C | 26.5° | 60.0° |
C5 | C6 | C7 | H72C | 26.5° | 60.0° |
C6 | C7 | S7 | H71C | 37.5° | 120.0° |
C6 | C7 | S7 | H72C | 37.5° | 120.0° |
C7 | C6 | C5 | H51C | 143.0° | 60.0° |
C7 | C6 | C5 | H52C | 143.0° | 60.0° |
C7 | C6 | H61C | H62C | 90.0° | 120.0° |
C6 | C7 | H71C | H72C | 90.0° | 120.0° |
C6 | C7 | S7 | H7 | 37.5° | 180.0° |
S7 | C7 | C6 | H61C | 154.4° | 60.0° |
S7 | C7 | C6 | H62C | 154.4° | 60.0° |
S7 | C7 | H71C | H72C | 90.0° | 120.0° |
H | N | CA | HA | 0.0° | 145.2° |
HA | CA | CB | HB | 0.0° | 55.0° |
HB | CB | CG | HG1C | 0.0° | 60.1° |
HB | CB | CG | HG2C | 0.0° | 180.0° |
HB | CB | CG | HG3C | 0.0° | 60.0° |
HG1C | CG | HG2C | HG3C | 90.0° | 119.9° |
H21C | C2 | C3 | H31C | 0.0° | 180.0° |
H21C | C2 | C3 | H32C | 0.0° | 60.0° |
H22C | C2 | C3 | H31C | 0.0° | 60.0° |
H22C | C2 | C3 | H32C | 0.0° | 180.0° |
H31C | C3 | C4 | H41C | 0.0° | 180.0° |
H31C | C3 | C4 | H42C | 0.0° | 60.0° |
H32C | C3 | C4 | H41C | 0.0° | 60.0° |
H32C | C3 | C4 | H42C | 0.0° | 180.0° |
H41C | C4 | C5 | H51C | 0.0° | 180.0° |
H41C | C4 | C5 | H52C | 0.0° | 60.0° |
H42C | C4 | C5 | H51C | 0.0° | 60.0° |
H42C | C4 | C5 | H52C | 0.0° | 180.0° |
H51C | C5 | C6 | H61C | 0.0° | 180.0° |
H51C | C5 | C6 | H62C | 0.0° | 60.0° |
H52C | C5 | C6 | H61C | 0.0° | 60.0° |
H52C | C5 | C6 | H62C | 0.0° | 180.0° |
H61C | C6 | C7 | H71C | 0.0° | 180.0° |
H61C | C6 | C7 | H72C | 0.0° | 60.0° |
H62C | C6 | C7 | H71C | 0.0° | 59.9° |
H62C | C6 | C7 | H72C | 0.0° | 180.0° |
H71C | C7 | S7 | H7 | 0.0° | 60.0° |
H72C | C7 | S7 | H7 | 0.0° | 60.0° |