| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 24.5 | Very low | 26.3 | Very low | 201 Ų | 201 | 135.7 Ų | 135.7 | 99% | 0.99 | 81% | 0.806 | S | S | * | * | 0 | 141.2 | 0 | -72.3 | 174.6 | 167.6 | 0 | 0 | 107.4 | M223 | M1-M223 HydrophobicContact SD-CE 4.46Š| |||
| 2 | A | 23.8 | Very low | 26.6 | Very low | 93 Ų | 93 | 137.9 Ų | 137.9 | 77% | 0.769 | 81% | 0.811 | S | S | * | * | trans | -82 | 155.2 | -173.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | G4 | A2-G4 PolarHBondContact O-N 3.45Š| ||
| 3 | S | 28.2 | Very low | 26.7 | Very low | 128 Ų | 128 | 132.5 Ų | 132.5 | 90% | 0.895 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -61.9 | 122.9 | 179.4 | 56 | 0 | 0 | 0 | 0 | 112 | ||
| 4 | G | 32.6 | Very low | 26.9 | Very low | 68 Ų | 68 | 131.1 Ų | 131.1 | 70% | 0.701 | 80% | 0.801 | S | S | * | * | trans | 152.6 | 4.6 | 168.1 | 0 | 0 | 0 | 0 | 0 | 119.5 | A2 | A2-G4 PolarHBondContact O-N 3.45Š| ||
| 5 | D | 25.8 | Very low | 27.1 | Very low | 158 Ų | 158 | 134.9 Ų | 134.9 | 85% | 0.845 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -99.1 | 123.2 | -178.1 | -67 | -22 | 0 | 0 | 0 | 112.5 | ||
| 6 | T | 25.7 | Very low | 27.3 | Very low | 121 Ų | 121 | 137.6 Ų | 137.6 | 74% | 0.742 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 122.5 | 175.5 | -43.8 | 0 | 0 | 0 | 0 | 110.9 | Y8 | T6-Y8 HydrophobicContact CG2-CE2 4.42Š|
| 7 | L | 25.6 | Very low | 27.9 | Very low | 140 Ų | 140 | 136.4 Ų | 136.4 | 73% | 0.733 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -91.8 | 135.7 | -177.2 | -173.8 | 74.6 | 0 | 0 | 0 | 111.5 | I9 | L7-I9 HydrophobicContact CD2-CD1 4.09Å; L7-I9 HydrophobicContact CD2-CG1 3.99Å; L7-I9 HydrophobicContact CG-CG1 4.22Å |
| 8 | Y | 26.1 | Very low | 27.8 | Very low | 211 Ų | 211 | 134.1 Ų | 134.1 | 83% | 0.827 | 81% | 0.806 | S | S | * | * | trans | -116.6 | 128.4 | 167.1 | -68.3 | -90 | 0 | 0 | 0 | 109.8 | T6 | T6-Y8 HydrophobicContact CG2-CE2 4.42Š| ||
| 9 | I | 25.9 | Very low | 27.7 | Very low | 140 Ų | 140 | 136.8 Ų | 136.8 | 72% | 0.718 | 81% | 0.809 | S | S | * | * | trans | -108.2 | 125.2 | 179.6 | -51.7 | 175.7 | 0 | 0 | 0 | 108.9 | L7 | L7-I9 HydrophobicContact CD2-CD1 4.09Å; L7-I9 HydrophobicContact CD2-CG1 3.99Å; L7-I9 HydrophobicContact CG-CG1 4.22Å | ||
| 10 | A | 25.4 | Very low | 27.6 | Very low | 99 Ų | 99 | 137.8 Ų | 137.8 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | -100.9 | 139.1 | 164.8 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 11 | T | 25.6 | Very low | 27.4 | Very low | 134 Ų | 134 | 136.6 Ų | 136.6 | 82% | 0.822 | 80% | 0.803 | S | S | * | * | trans | -110.7 | 105.6 | 178.1 | 45.7 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 12 | D | 29.4 | Very low | 27.4 | Very low | 162 Ų | 162 | 135.4 Ų | 135.4 | 87% | 0.866 | 80% | 0.795 | S | S | * | * | trans | -169.9 | 142.3 | 130.8 | 62.4 | -7.7 | 0 | 0 | 0 | 113 | ||||
| 13 | G | 28.1 | Very low | 27.6 | Very low | 67 Ų | 67 | 136.5 Ų | 136.5 | 69% | 0.691 | 79% | 0.787 | S | S | * | * | trans | 87.1 | 85.5 | 143.7 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 14 | S | 29.2 | Very low | 27.5 | Very low | 113 Ų | 113 | 139.4 Ų | 139.4 | 79% | 0.79 | 79% | 0.786 | S | S | * | * | 46.5 | 127.8 | 128.1 | 66 | 0 | 0 | 0 | 0 | 119.4 | |||||
| 15 | E | 29.8 | Very low | 27.3 | Very low | 189 Ų | 189 | 145 Ų | 145 | 88% | 0.883 | 80% | 0.795 | S | S | * | * | -168.3 | 154.5 | 54.2 | -73.8 | -178.8 | 140.7 | 0 | 0 | 111 | |||||
| 16 | M | 31.2 | Very low | 27.2 | Very low | 177 Ų | 177 | 145.6 Ų | 145.6 | 87% | 0.872 | 80% | 0.796 | S | S | * | * | trans | -71.5 | 178.7 | 176.9 | -69.7 | -139.6 | -59 | 0 | 0 | 113.9 | ||||
| 17 | P | 36.6 | Very low | 27.1 | Very low | 117 Ų | 117 | 149 Ų | 149 | 76% | 0.76 | 80% | 0.803 | S | S | * | * | cis | -150.9 | 164.5 | 26.7 | 41.1 | -17.4 | 0 | 0 | 0 | 122 | ||||
| 18 | A | 26.1 | Very low | 27 | Very low | 95 Ų | 95 | 148.6 Ų | 148.6 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | trans | 38.6 | 129.7 | 139.4 | 0 | 0 | 0 | 0 | 0 | 125.5 | ||||
| 19 | E | 26.9 | Very low | 27 | Very low | 186 Ų | 186 | 147.8 Ų | 147.8 | 87% | 0.869 | 81% | 0.81 | S | S | * | * | -167 | 157.5 | 128 | -113 | 178.2 | -177.4 | 0 | 0 | 113.3 | |||||
| 20 | I | 25.6 | Very low | 27.1 | Very low | 157 Ų | 157 | 147.5 Ų | 147.5 | 81% | 0.805 | 82% | 0.815 | S | S | * | * | trans | -103.6 | 143.5 | -161 | -61.8 | 160.6 | 0 | 0 | 0 | 112.7 | ||||
| 21 | V | 22.6 | Very low | 27 | Very low | 112 Ų | 112 | 150.7 Ų | 150.7 | 68% | 0.679 | 82% | 0.816 | S | S | * | * | trans | -152.1 | 149.3 | 152.4 | -171.1 | 0 | 0 | 0 | 0 | 112.4 | Q211 | V21-Q211 PolarHBondContact O-OE1 3.47Š| ||
| 22 | E | 25.5 | Very low | 27.1 | Very low | 177 Ų | 177 | 150.2 Ų | 150.2 | 83% | 0.827 | 82% | 0.816 | S | S | * | * | trans | -71.8 | 165.8 | -161.8 | -74 | 172.1 | 126.4 | 0 | 0 | 121.8 | ||||
| 23 | L | 26.6 | Very low | 27 | Very low | 116 Ų | 116 | 149.3 Ų | 149.3 | 61% | 0.607 | 82% | 0.816 | S | S | * | * | trans | -73.3 | 159.7 | -177.1 | -71.1 | 121.1 | 0 | 0 | 0 | 117.9 | K213 | L23-K213 HydrophobicContact CD2-CD 3.9Å; L23-K213 HydrophobicContact CG-CD 4.46Å | ||
| 24 | H | 28 | Very low | 27.2 | Very low | 188 Ų | 188 | 154.5 Ų | 154.5 | 87% | 0.87 | 82% | 0.822 | S | S | * | * | trans | -142.2 | 144.6 | 145.6 | -83.7 | 78.6 | 0 | 0 | 0 | 110.8 | ||||
| 25 | E | 27.6 | Very low | 27.1 | Very low | 187 Ų | 187 | 155.8 Ų | 155.8 | 87% | 0.874 | 83% | 0.825 | S | S | * | * | trans | -86.2 | 158.6 | -163.7 | -65 | 169 | 142.5 | 0 | 0 | 116.1 | ||||
| 26 | I | 23.5 | Very low | 27 | Very low | 169 Ų | 169 | 154.3 Ų | 154.3 | 87% | 0.867 | 82% | 0.822 | S | S | * | * | trans | -143.6 | 132.1 | 157.5 | -55.5 | -178.9 | 0 | 0 | 0 | 110.7 | ||||
| 27 | E | 24.1 | Very low | 26.8 | Very low | 192 Ų | 192 | 155.4 Ų | 155.4 | 90% | 0.897 | 83% | 0.825 | S | S | * | * | trans | -80.6 | 159 | -179 | -69.4 | 175.8 | 137.9 | 0 | 0 | 114.7 | ||||
| 28 | V | 24 | Very low | 26.2 | Very low | 133 Ų | 133 | 155.9 Ų | 155.9 | 81% | 0.806 | 83% | 0.826 | S | S | * | * | trans | -132.2 | 137 | 178.1 | -177.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 29 | E | 25.1 | Very low | 26.2 | Very low | 194 Ų | 194 | 158.3 Ų | 158.3 | 91% | 0.907 | 83% | 0.831 | S | S | * | * | trans | -112.7 | 149.8 | 170.8 | -83.1 | -169.8 | 148.9 | 0 | 0 | 112.6 | ||||
| 30 | T | 27.7 | Very low | 26.2 | Very low | 134 Ų | 134 | 156.1 Ų | 156.1 | 82% | 0.822 | 83% | 0.83 | S | S | * | * | trans | -124.2 | 151 | -176.4 | 53.3 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 31 | I | 24.1 | Very low | 26.2 | Very low | 165 Ų | 165 | 155.5 Ų | 155.5 | 85% | 0.846 | 83% | 0.833 | S | S | * | * | trans | -134.3 | 144.3 | 177.6 | -54.7 | 178.5 | 0 | 0 | 0 | 111.5 | ||||
| 32 | P | 28.2 | Very low | 26.4 | Very low | 124 Ų | 124 | 153.6 Ų | 153.6 | 81% | 0.805 | 84% | 0.836 | S | S | * | * | trans | -99.1 | 168.3 | -170.2 | 38.3 | -33.1 | 0 | 0 | 0 | 116.4 | ||||
| 33 | V | 26.9 | Very low | 26.5 | Very low | 143 Ų | 143 | 154.4 Ų | 154.4 | 87% | 0.867 | 84% | 0.84 | S | S | * | * | trans | -113.6 | 140.3 | -171.3 | -179.4 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 34 | E | 31.6 | Very low | 26.6 | Very low | 177 Ų | 177 | 158 Ų | 158 | 83% | 0.827 | 85% | 0.854 | S | S | * | * | trans | -127.4 | 125.8 | 171 | -72.6 | -167.1 | 158.7 | 0 | 0 | 114.6 | ||||
| 35 | T | 28.2 | Very low | 26.8 | Very low | 139 Ų | 139 | 158.4 Ų | 158.4 | 85% | 0.853 | 86% | 0.856 | S | S | * | * | trans | 58.9 | 131.9 | 143.4 | 55.9 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 36 | I | 26.7 | Very low | 27.1 | Very low | 159 Ų | 159 | 158.4 Ų | 158.4 | 82% | 0.815 | 86% | 0.856 | S | S | * | * | trans | -107.8 | 145.1 | 178.5 | -61.1 | 164.6 | 0 | 0 | 0 | 109.9 | ||||
| 37 | E | 26.6 | Very low | 27.4 | Very low | 199 Ų | 199 | 159.7 Ų | 159.7 | 93% | 0.93 | 86% | 0.858 | S | S | * | * | trans | -125.5 | 150 | 160.6 | -76.4 | -166.9 | 156.5 | 0 | 0 | 111.6 | ||||
| 38 | T | 25.8 | Very low | 27.5 | Very low | 127 Ų | 127 | 158 Ų | 158 | 78% | 0.779 | 86% | 0.855 | S | S | * | * | trans | -121.6 | 144.3 | -170.3 | 43.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 39 | T | 24.3 | Very low | 28.2 | Very low | 146 Ų | 146 | 160.1 Ų | 160.1 | 90% | 0.896 | 86% | 0.856 | S | S | * | * | trans | -141.9 | 144.4 | 165.7 | 47.9 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 40 | V | 28.5 | Very low | 28.4 | Very low | 141 Ų | 141 | 157.8 Ų | 157.8 | 86% | 0.855 | 85% | 0.85 | S | S | * | * | trans | -108.3 | 137.9 | -171.4 | 176.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 41 | V | 24.6 | Very low | 28.7 | Very low | 144 Ų | 144 | 154.6 Ų | 154.6 | 87% | 0.873 | 83% | 0.828 | S | S | * | * | trans | -142.7 | 119.7 | 165.4 | -172.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 42 | G | 26.9 | Very low | 29.2 | Very low | 71 Ų | 71 | 154.9 Ų | 154.9 | 73% | 0.732 | 83% | 0.826 | S | S | * | * | trans | 59.4 | 116.5 | 130.4 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 43 | E | 28.4 | Very low | 29.5 | Very low | 194 Ų | 194 | 156 Ų | 156 | 91% | 0.907 | 83% | 0.825 | S | S | * | * | trans | -73.9 | 139.1 | 170.8 | -59.9 | 164.9 | 157 | 0 | 0 | 112.4 | ||||
| 44 | E | 26.8 | Very low | 29.7 | Very low | 193 Ų | 193 | 151.3 Ų | 151.3 | 90% | 0.902 | 81% | 0.806 | S | S | * | * | trans | -133.9 | 132.5 | 153.8 | -68.8 | -169 | 175.6 | 0 | 0 | 108.9 | ||||
| 45 | E | 33.3 | Very low | 30.3 | Very low | 196 Ų | 196 | 147.4 Ų | 147.4 | 92% | 0.916 | 81% | 0.813 | S | S | * | * | trans | -81.3 | 130.1 | -177.8 | -60.8 | 175.2 | 151.4 | 0 | 0 | 110 | ||||
| 46 | E | 33.3 | Very low | 30.4 | Very low | 186 Ų | 186 | 144.5 Ų | 144.5 | 87% | 0.869 | 81% | 0.81 | S | S | * | * | trans | -128.5 | 142.2 | 163.3 | -71.9 | -152.9 | 172 | 0 | 0 | 111 | ||||
| 47 | E | 30.3 | Very low | 30.6 | Very low | 196 Ų | 196 | 139.3 Ų | 139.3 | 92% | 0.916 | 80% | 0.796 | S | S | * | * | trans | -78 | 120.1 | -170.6 | -62.2 | 175.8 | 163.5 | 0 | 0 | 111.3 | E49 | E47-E49 PolarHBondContact O-N 3.36Š| ||
| 48 | D | 27.1 | Very low | 30.8 | Very low | 156 Ų | 156 | 135.9 Ų | 135.9 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | trans | -71.6 | 114.9 | 175.6 | -64.5 | -53.6 | 0 | 0 | 0 | 111.3 | ||||
| 49 | E | 37.7 | Very low | 31.2 | Very low | 178 Ų | 178 | 138.8 Ų | 138.8 | 83% | 0.832 | 79% | 0.788 | S | S | * | * | trans | -101.5 | 106.7 | 159.1 | -76.3 | -169.4 | 171.9 | 0 | 0 | 109.1 | E47 D51 | E47-E49 PolarHBondContact O-N 3.36Å; E49-D51 PolarHBondContact O-N 2.79Å | ||
| 50 | D | 30.2 | Very low | 31.7 | Very low | 146 Ų | 146 | 135.6 Ų | 135.6 | 78% | 0.781 | 78% | 0.784 | S | S | * | * | trans | -50.9 | 114.1 | 175.3 | -66.9 | -59.2 | 0 | 0 | 0 | 111.6 | E52 | D50-E52 PolarHBondContact O-N 3.37Š| ||
| 51 | D | 32.3 | Very low | 31.8 | Very low | 67 Ų | 67 | 132.9 Ų | 132.9 | 36% | 0.358 | 79% | 0.785 | S | S | . | * | trans | -69.6 | 80.9 | 164.6 | -81.2 | -44 | 0 | 0 | 0 | 108.5 | E49 D53 K351 | E49-D51 PolarHBondContact O-N 2.79Å; D51-D53 PolarHBondContact O-N 2.84Å; D51-K351 WeakPolarHBondContact OD1-CE 3.16Å; D51-K351 IonicContact OD1-NZ 2.79Å; D51-K351 PolarHBondContact OD1-NZ 3.11Å; D51-K351 WeakPolarHBondContact OD2-CE 3.03Å; D51-K351 IonicContact OD2-NZ 3.08Å; D51-K351 PolarHBondContact OD2-NZ 3.42Å | ||
| 52 | E | 34.6 | Very low | 31.9 | Very low | 170 Ų | 170 | 129.9 Ų | 129.9 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | trans | -59.9 | 110.6 | 166.9 | -76.7 | -143.8 | 170.9 | 0 | 0 | 109.4 | D50 G54 | D50-E52 PolarHBondContact O-N 3.37Å; E52-G54 PolarHBondContact O-N 3.49Å | ||
| 53 | D | 36.1 | Very low | 32 | Very low | 149 Ų | 149 | 130.6 Ų | 130.6 | 80% | 0.797 | 79% | 0.791 | S | S | * | * | trans | -66.2 | 70.6 | 159.1 | -162.1 | 11.1 | 0 | 0 | 0 | 108.1 | D51 | D51-D53 PolarHBondContact O-N 2.84Š| ||
| 54 | G | 29.8 | Very low | 31.9 | Very low | 44 Ų | 44 | 125.1 Ų | 125.1 | 45% | 0.454 | 79% | 0.786 | S | S | . | * | trans | -148.1 | 109.8 | -171.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | E52 G56 | E52-G54 PolarHBondContact O-N 3.49Å; G54-G56 PolarHBondContact O-N 3.1Å | ||
| 55 | G | 43.7 | Very low | 32.1 | Very low | 95 Ų | 95 | 125.2 Ų | 125.2 | 98% | 0.979 | 79% | 0.786 | S | S | * | * | trans | -57.9 | 121 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 56 | G | 30.9 | Very low | 31.9 | Very low | 77 Ų | 77 | 119.1 Ų | 119.1 | 79% | 0.794 | 78% | 0.776 | S | S | * | * | trans | -175 | 138.5 | 167.9 | 0 | 0 | 0 | 0 | 0 | 107.6 | G54 | G54-G56 PolarHBondContact O-N 3.1Š| ||
| 57 | G | 31.6 | Very low | 31.7 | Very low | 50 Ų | 50 | 119.9 Ų | 119.9 | 52% | 0.515 | 78% | 0.779 | S | S | . | * | cis | 134.8 | 76.3 | 28.9 | 0 | 0 | 0 | 0 | 0 | 106.3 | H59 | G57-H59 PolarHBondContact O-N 3.36Å; G57-H59 PolarHBondContact O-ND1 3.49Å | ||
| 58 | D | 31.4 | Very low | 31.8 | Very low | 127 Ų | 127 | 115.3 Ų | 115.3 | 68% | 0.679 | 78% | 0.775 | S | S | * | * | trans | -58.7 | 108.9 | 175.7 | -90 | -79.3 | 0 | 0 | 0 | 110.5 | ||||
| 59 | H | 34.2 | Very low | 31.9 | Very low | 188 Ų | 188 | 111.2 Ų | 111.2 | 87% | 0.87 | 77% | 0.77 | S | S | * | * | trans | -86.6 | 114.9 | 165.4 | -81.9 | 46.1 | 0 | 0 | 0 | 109.4 | G57 | G57-H59 PolarHBondContact O-N 3.36Å; G57-H59 PolarHBondContact O-ND1 3.49Å | ||
| 60 | G | 33.3 | Very low | 31.4 | Very low | 79 Ų | 79 | 111 Ų | 111 | 81% | 0.814 | 77% | 0.768 | S | S | * | * | trans | -131.6 | 82.2 | 166.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 61 | G | 30.3 | Very low | 31.4 | Very low | 85 Ų | 85 | 112.6 Ų | 112.6 | 88% | 0.876 | 77% | 0.771 | S | S | * | * | trans | 54.3 | 117.5 | 143.9 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 62 | G | 27.1 | Very low | 31.1 | Very low | 81 Ų | 81 | 117.9 Ų | 117.9 | 84% | 0.835 | 79% | 0.793 | S | S | * | * | trans | 174 | 59.1 | 160 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 63 | G | 28.7 | Very low | 30.8 | Very low | 86 Ų | 86 | 118 Ų | 118 | 89% | 0.887 | 79% | 0.793 | S | S | * | * | trans | 65.2 | 123.7 | 147.4 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 64 | G | 28 | Very low | 30.4 | Very low | 78 Ų | 78 | 119.4 Ų | 119.4 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | trans | 155.7 | 109.2 | 157 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 65 | H | 29.9 | Very low | 30.3 | Very low | 196 Ų | 196 | 125 Ų | 125 | 91% | 0.907 | 81% | 0.808 | S | S | * | * | trans | -17.3 | 130.7 | 172.1 | -62.5 | -56.7 | 0 | 0 | 0 | 121.5 | ||||
| 66 | G | 29.5 | Very low | 29.5 | Very low | 68 Ų | 68 | 128.4 Ų | 128.4 | 70% | 0.701 | 80% | 0.798 | S | S | * | * | 82.7 | 110.1 | 116.8 | 0 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 67 | H | 29.6 | Very low | 29.2 | Very low | 202 Ų | 202 | 132.2 Ų | 132.2 | 94% | 0.935 | 80% | 0.795 | S | S | * | * | 173 | 139.2 | 114.7 | -103.9 | -127.8 | 0 | 0 | 0 | 110.8 | |||||
| 68 | A | 31.3 | Very low | 29.1 | Very low | 99 Ų | 99 | 137.2 Ų | 137.2 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | -79.6 | 143.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 69 | G | 28.7 | Very low | 28.8 | Very low | 71 Ų | 71 | 139.7 Ų | 139.7 | 73% | 0.732 | 81% | 0.812 | S | S | * | * | trans | -159.5 | 100.9 | 167.3 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 70 | H | 29.1 | Very low | 28.6 | Very low | 174 Ų | 174 | 138.5 Ų | 138.5 | 81% | 0.806 | 81% | 0.806 | S | S | * | * | trans | -73.9 | 123.3 | 174.7 | -81 | 84.4 | 0 | 0 | 0 | 110.1 | ||||
| 71 | H | 28.8 | Very low | 28.2 | Very low | 179 Ų | 179 | 139.7 Ų | 139.7 | 83% | 0.829 | 80% | 0.8 | S | S | * | * | trans | -117.1 | 114.9 | 160.8 | -90.9 | -85.1 | 0 | 0 | 0 | 108.4 | ||||
| 72 | H | 27.3 | Very low | 28 | Very low | 177 Ų | 177 | 141.8 Ų | 141.8 | 82% | 0.819 | 80% | 0.798 | S | S | * | * | trans | -75.5 | 122.5 | 170 | -84 | 75 | 0 | 0 | 0 | 109.2 | ||||
| 73 | H | 28.2 | Very low | 27.9 | Very low | 173 Ų | 173 | 146.6 Ų | 146.6 | 80% | 0.801 | 80% | 0.801 | S | S | * | * | trans | -96.1 | 125.4 | 162 | -102.3 | 87.4 | 0 | 0 | 0 | 108.7 | ||||
| 74 | H | 26.1 | Very low | 27.7 | Very low | 179 Ų | 179 | 150 Ų | 150 | 83% | 0.829 | 80% | 0.798 | S | S | * | * | trans | -78.5 | 114.4 | 170.8 | -108.9 | -77.6 | 0 | 0 | 0 | 108.8 | ||||
| 75 | H | 27.7 | Very low | 27.5 | Very low | 160 Ų | 160 | 150.7 Ų | 150.7 | 74% | 0.741 | 80% | 0.795 | S | S | * | * | trans | -81.8 | 125.2 | 165.4 | -96 | -97.1 | 0 | 0 | 0 | 109.7 | ||||
| 76 | H | 26.9 | Very low | 27.2 | Very low | 167 Ų | 167 | 149.2 Ų | 149.2 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | trans | -87.7 | 110.5 | 164.5 | -101.1 | -85.3 | 0 | 0 | 0 | 108.1 | H78 | H76-H78 PolarHBondContact O-N 3.18Š| ||
| 77 | H | 26.5 | Very low | 27 | Very low | 158 Ų | 158 | 154.5 Ų | 154.5 | 73% | 0.731 | 80% | 0.8 | S | S | * | * | trans | -76.1 | 114.5 | 167.9 | -81.4 | -84.9 | 0 | 0 | 0 | 109.4 | ||||
| 78 | H | 28.4 | Very low | 26.9 | Very low | 154 Ų | 154 | 150.7 Ų | 150.7 | 71% | 0.713 | 79% | 0.793 | S | S | * | * | trans | -93.1 | 109.9 | 159.6 | -83.8 | -78.5 | 0 | 0 | 0 | 108 | H76 H80 | H76-H78 PolarHBondContact O-N 3.18Å; H78-H80 PolarHBondContact O-N 3.4Å | ||
| 79 | H | 25.6 | Very low | 26.5 | Very low | 180 Ų | 180 | 153.4 Ų | 153.4 | 83% | 0.833 | 79% | 0.793 | S | S | * | * | trans | -71 | 115.4 | 168 | -76.3 | -81.2 | 0 | 0 | 0 | 109 | ||||
| 80 | H | 28.9 | Very low | 26.6 | Very low | 162 Ų | 162 | 156.1 Ų | 156.1 | 75% | 0.75 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -92.5 | 146.1 | 162.3 | -74.8 | -90.4 | 0 | 0 | 0 | 109.5 | H78 | H78-H80 PolarHBondContact O-N 3.4Š|
| 81 | P | 25.3 | Very low | 26.6 | Very low | 105 Ų | 105 | 152.9 Ų | 152.9 | 68% | 0.682 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 156.3 | 175.9 | 29.6 | -33 | 0 | 0 | 0 | 111.4 | ||
| 82 | P | 26.2 | Very low | 26.8 | Very low | 128 Ų | 128 | 152.2 Ų | 152.2 | 83% | 0.831 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 137.9 | -172.3 | 28.7 | -34 | 0 | 0 | 0 | 111.7 | ||
| 83 | M | 25.1 | Very low | 27 | Very low | 182 Ų | 182 | 148.5 Ų | 148.5 | 90% | 0.897 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -94.7 | 129.9 | 173 | -69.7 | -76.5 | -79.5 | 0 | 0 | 109.5 | ||
| 84 | I | 24 | Very low | 27.3 | Very low | 159 Ų | 159 | 146.4 Ų | 146.4 | 82% | 0.815 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -82 | 118.3 | 175.2 | -63.6 | 168.9 | 0 | 0 | 0 | 108.3 | ||
| 85 | A | 24.4 | Very low | 27.7 | Very low | 91 Ų | 91 | 142.9 Ų | 142.9 | 75% | 0.752 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -89 | 122.1 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||
| 86 | L | 24.6 | Very low | 27.9 | Very low | 165 Ų | 165 | 142.1 Ų | 142.1 | 86% | 0.864 | 77% | 0.766 | S | S | * | * | trans | -88.8 | 109.9 | 167.4 | -69.1 | 170.2 | 0 | 0 | 0 | 108.2 | ||||
| 87 | Q | 25.5 | Very low | 28 | Very low | 180 Ų | 180 | 140.6 Ų | 140.6 | 84% | 0.841 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 133.7 | 165.2 | -67.5 | -173.1 | -2.7 | 0 | 0 | 109.3 | L89 | Q87-L89 PolarHBondContact O-N 3.46Š|
| 88 | P | 25.7 | Very low | 28 | Very low | 122 Ų | 122 | 140.4 Ų | 140.4 | 79% | 0.792 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 127.3 | 171.4 | 26.7 | -29.3 | 0 | 0 | 0 | 110.4 | V90 | P88-V90 PolarHBondContact O-N 3.26Š|
| 89 | L | 24.1 | Very low | 28 | Very low | 155 Ų | 155 | 141.9 Ų | 141.9 | 81% | 0.812 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -61 | 122.8 | 172.1 | -132.4 | 93.3 | 0 | 0 | 0 | 109.3 | Q87 T91 | Q87-L89 PolarHBondContact O-N 3.46Å; L89-T91 HydrophobicContact CD2-CG2 4.27Å; L89-T91 PolarHBondContact O-N 3.03Å |
| 90 | V | 30.3 | Very low | 28 | Very low | 128 Ų | 128 | 142 Ų | 142 | 78% | 0.776 | 78% | 0.775 | S | S | * | * | trans | -75.7 | 112.7 | 166.5 | 179.2 | 0 | 0 | 0 | 0 | 107.5 | P88 | P88-V90 PolarHBondContact O-N 3.26Š| ||
| 91 | T | 29.5 | Very low | 27.9 | Very low | 107 Ų | 107 | 143.1 Ų | 143.1 | 66% | 0.656 | 78% | 0.78 | S | S | * | * | trans | -105.1 | 122.5 | 166.5 | 59.7 | 0 | 0 | 0 | 0 | 109 | L89 D93 | L89-T91 HydrophobicContact CD2-CG2 4.27Å; L89-T91 PolarHBondContact O-N 3.03Å; T91-D93 PolarHBondContact O-N 3.42Å | ||
| 92 | D | 33.6 | Very low | 27.9 | Very low | 164 Ų | 164 | 147.1 Ų | 147.1 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | trans | -73 | 85.2 | 175.3 | -67.7 | -52.7 | 0 | 0 | 0 | 111.1 | ||||
| 93 | D | 30.8 | Very low | 27.6 | Very low | 99 Ų | 99 | 147.2 Ų | 147.2 | 53% | 0.529 | 79% | 0.788 | S | S | . | * | trans | -146.1 | 113 | 160.6 | -167.5 | -26.2 | 0 | 0 | 0 | 110.6 | T91 T95 | T91-D93 PolarHBondContact O-N 3.42Å; D93-T95 VanDerWaalsContact C-N 3.27Å; D93-T95 PolarHBondContact O-N 2.92Å; D93-T95 PolarHBondContact OD1-N 3.46Å; D93-T95 PolarHBondContact OD1-OG1 3.03Å | ||
| 94 | P | 34.5 | Very low | 27.6 | Very low | 130 Ų | 130 | 145.6 Ų | 145.6 | 84% | 0.844 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | 24 | -172.5 | 34.3 | -34.7 | 0 | 0 | 0 | 114.8 | ||
| 95 | T | 33.9 | Very low | 27.4 | Very low | 104 Ų | 104 | 145.6 Ų | 145.6 | 64% | 0.638 | 78% | 0.782 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.9 | 9.3 | -174.2 | 60.5 | 0 | 0 | 0 | 0 | 117.6 | D93 | D93-T95 VanDerWaalsContact C-N 3.27Å; D93-T95 PolarHBondContact O-N 2.92Å; D93-T95 PolarHBondContact OD1-N 3.46Å; D93-T95 PolarHBondContact OD1-OG1 3.03Å |
| 96 | Q | 32.6 | Very low | 27.3 | Very low | 144 Ų | 144 | 146.6 Ų | 146.6 | 67% | 0.673 | 78% | 0.779 | S | S | * | * | trans | -115.5 | 115.8 | 177 | -64.2 | -71.3 | -12.6 | 0 | 0 | 111.8 | H98 | Q96-H98 PolarHBondContact O-N 2.79Š| ||
| 97 | V | 28 | Very low | 27.1 | Very low | 136 Ų | 136 | 147.5 Ų | 147.5 | 82% | 0.824 | 78% | 0.778 | S | S | * | * | trans | -83.3 | 107 | 172.7 | 178.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 98 | H | 27.9 | Very low | 26.9 | Very low | 154 Ų | 154 | 144.7 Ų | 144.7 | 71% | 0.713 | 77% | 0.773 | S | S | * | * | trans | -86.5 | 117.9 | 172.2 | -77.3 | -94.8 | 0 | 0 | 0 | 110.7 | Q96 H100 | Q96-H98 PolarHBondContact O-N 2.79Å; H98-H100 PolarHBondContact O-N 2.84Å | ||
| 99 | H | 27.6 | Very low | 26.8 | Very low | 184 Ų | 184 | 148.6 Ų | 148.6 | 85% | 0.852 | 77% | 0.772 | S | S | * | * | trans | -70.8 | 111.9 | 158.4 | -86.3 | -22.2 | 0 | 0 | 0 | 108.8 | Q101 | H99-Q101 PolarHBondContact O-N 3.23Š| ||
| 100 | H | 25.9 | Very low | 26.9 | Very low | 184 Ų | 184 | 149.7 Ų | 149.7 | 85% | 0.852 | 77% | 0.774 | S | S | * | * | trans | -76.4 | 111.9 | 162.4 | -93.5 | -90.8 | 0 | 0 | 0 | 108.6 | H98 | H98-H100 PolarHBondContact O-N 2.84Š| ||
| 101 | Q | 25.8 | Very low | 26.7 | Very low | 185 Ų | 185 | 150.5 Ų | 150.5 | 86% | 0.864 | 77% | 0.769 | S | S | * | * | trans | -93.1 | 111.6 | 169.7 | -162.9 | 161.7 | 30.6 | 0 | 0 | 107 | H99 | H99-Q101 PolarHBondContact O-N 3.23Š| ||
| 102 | E | 25.4 | Very low | 26.6 | Very low | 188 Ų | 188 | 152 Ų | 152 | 88% | 0.879 | 78% | 0.777 | S | S | * | * | trans | -74.1 | 126.3 | 174.8 | -74.3 | -172.9 | 149.4 | 0 | 0 | 110.3 | ||||
| 103 | V | 21.6 | Very low | 26.4 | Very low | 130 Ų | 130 | 151 Ų | 151 | 79% | 0.788 | 78% | 0.777 | S | S | * | * | trans | -79.8 | 120.4 | 174.1 | 175.4 | 0 | 0 | 0 | 0 | 108.5 | L105 | V103-L105 PolarHBondContact O-N 3.18Š| ||
| 104 | I | 23.8 | Very low | 26.1 | Very low | 148 Ų | 148 | 149.9 Ų | 149.9 | 76% | 0.759 | 79% | 0.789 | S | S | * | * | trans | -83.5 | 112.4 | 170.3 | -58.8 | 175.3 | 0 | 0 | 0 | 108.1 | V106 | I104-V106 HydrophobicContact CG2-CG2 3.92Å; I104-V106 PolarHBondContact O-N 3.12Å | ||
| 105 | L | 19.8 | Very low | 25.6 | Very low | 159 Ų | 159 | 146.4 Ų | 146.4 | 83% | 0.832 | 78% | 0.777 | S | S | * | * | trans | -77.4 | 106 | 166.4 | -112.7 | 129.4 | 0 | 0 | 0 | 108.6 | V103 | V103-L105 PolarHBondContact O-N 3.18Š| ||
| 106 | V | 23.3 | Very low | 25.2 | Very low | 113 Ų | 113 | 148.5 Ų | 148.5 | 69% | 0.685 | 78% | 0.784 | S | S | * | * | trans | -92.4 | 106.8 | 168.4 | -176.9 | 0 | 0 | 0 | 0 | 107.8 | I104 T108 | I104-V106 HydrophobicContact CG2-CG2 3.92Å; I104-V106 PolarHBondContact O-N 3.12Å; V106-T108 HydrophobicContact CG1-CG2 4.35Å | ||
| 107 | Q | 20.7 | Very low | 24.9 | Very low | 183 Ų | 183 | 148.8 Ų | 148.8 | 86% | 0.855 | 79% | 0.79 | S | S | * | * | trans | -89.2 | 105.4 | 170.2 | -156.7 | 169.4 | 17.3 | 0 | 0 | 108.2 | ||||
| 108 | T | 20.9 | Very low | 25 | Very low | 121 Ų | 121 | 146.8 Ų | 146.8 | 74% | 0.742 | 78% | 0.782 | S | S | * | * | trans | -78.4 | 120.3 | 168.8 | 48.2 | 0 | 0 | 0 | 0 | 108.5 | V106 | V106-T108 HydrophobicContact CG1-CG2 4.35Š| ||
| 109 | R | 23.1 | Very low | 24.9 | Very low | 204 Ų | 204 | 147.2 Ų | 147.2 | 77% | 0.77 | 79% | 0.79 | S | S | * | * | trans | -92.5 | 113.3 | 164.8 | -171.3 | 175.8 | -178.3 | -132 | -4.9 | 108 | E111 | R109-E111 IonicContact CZ-OE1 3.26Å; R109-E111 IonicContact NH1-OE1 3.68Å; R109-E111 PolarHBondContact NH1-OE1 3.09Å; R109-E111 IonicContact NH2-OE1 3.84Å | ||
| 110 | E | 25.3 | Very low | 24.9 | Very low | 179 Ų | 179 | 141.6 Ų | 141.6 | 84% | 0.836 | 78% | 0.782 | S | S | * | * | trans | -71.3 | 121.5 | 161.6 | -71.5 | -175.8 | 130.9 | 0 | 0 | 108.4 | ||||
| 111 | E | 26.1 | Very low | 24.9 | Very low | 144 Ų | 144 | 141.3 Ų | 141.3 | 67% | 0.673 | 79% | 0.786 | S | S | * | * | trans | -93.7 | 113.3 | 163.3 | -68.4 | -150.7 | 147.1 | 0 | 0 | 109.2 | R109 | R109-E111 IonicContact CZ-OE1 3.26Å; R109-E111 IonicContact NH1-OE1 3.68Å; R109-E111 PolarHBondContact NH1-OE1 3.09Å; R109-E111 IonicContact NH2-OE1 3.84Å | ||
| 112 | V | 27.3 | Very low | 24.9 | Very low | 138 Ų | 138 | 143.3 Ų | 143.3 | 84% | 0.836 | 79% | 0.785 | S | S | * | * | trans | -79.2 | 119.7 | 166.1 | 178.3 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 113 | V | 30 | Very low | 25 | Very low | 144 Ų | 144 | 138.5 Ų | 138.5 | 87% | 0.873 | 78% | 0.778 | S | S | * | * | trans | -79.4 | 132.2 | 178 | -172.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 114 | G | 24.2 | Very low | 25.3 | Very low | 75 Ų | 75 | 139.7 Ų | 139.7 | 77% | 0.773 | 78% | 0.775 | S | S | * | * | trans | 162.1 | 133.5 | 162 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 115 | G | 24.1 | Very low | 25.4 | Very low | 58 Ų | 58 | 140 Ų | 140 | 60% | 0.598 | 78% | 0.777 | S | S | * | * | cis | 172.4 | 135 | 2.4 | 0 | 0 | 0 | 0 | 0 | 104 | ||||
| 116 | D | 26.1 | Very low | 25.6 | Very low | 147 Ų | 147 | 136.2 Ų | 136.2 | 79% | 0.786 | 78% | 0.777 | S | S | * | * | trans | 45.9 | 111.2 | 149.4 | -1.5 | -48.7 | 0 | 0 | 0 | 119.8 | ||||
| 117 | D | 27.1 | Very low | 25.6 | Very low | 151 Ų | 151 | 140.8 Ų | 140.8 | 81% | 0.807 | 79% | 0.788 | S | S | * | * | 164.9 | 125 | 105.1 | -85.1 | -32.1 | 0 | 0 | 0 | 113.7 | |||||
| 118 | S | 29.4 | Very low | 25.9 | Very low | 93 Ų | 93 | 140.3 Ų | 140.3 | 65% | 0.65 | 79% | 0.786 | S | S | * | * | trans | 21.6 | 116.6 | 149.2 | 47.8 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 119 | D | 26.8 | Very low | 26.1 | Very low | 163 Ų | 163 | 142.3 Ų | 142.3 | 87% | 0.872 | 79% | 0.792 | S | S | * | * | 171.5 | 129.8 | 91.3 | -97.4 | -36.3 | 0 | 0 | 0 | 113 | |||||
| 120 | G | 27.3 | Very low | 26.2 | Very low | 66 Ų | 66 | 139.3 Ų | 139.3 | 68% | 0.68 | 79% | 0.787 | S | S | * | * | trans | 64.7 | 104.8 | 147.5 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 121 | L | 25.9 | Very low | 26.1 | Very low | 179 Ų | 179 | 138.1 Ų | 138.1 | 94% | 0.937 | 79% | 0.785 | S | S | * | * | 176.3 | 128.1 | 112.7 | -87.5 | 166.2 | 0 | 0 | 0 | 112 | |||||
| 122 | R | 25.8 | Very low | 26.1 | Very low | 227 Ų | 227 | 137.1 Ų | 137.1 | 86% | 0.857 | 78% | 0.783 | S | S | * | * | trans | -4.6 | 115.4 | 163.7 | -128.5 | 159.7 | 82.1 | 95.4 | -1.4 | 118.4 | ||||
| 123 | A | 26.2 | Very low | 25.9 | Very low | 87 Ų | 87 | 137.6 Ų | 137.6 | 72% | 0.719 | 78% | 0.78 | S | S | * | * | trans | -86.8 | 136.6 | 162.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 124 | E | 27.6 | Very low | 25.7 | Very low | 155 Ų | 155 | 136.4 Ų | 136.4 | 72% | 0.724 | 78% | 0.775 | S | S | * | * | trans | -151.7 | 136.4 | 147.1 | -70.4 | -58.9 | 153.3 | 0 | 0 | 108.1 | ||||
| 125 | D | 26.4 | Very low | 25.7 | Very low | 153 Ų | 153 | 139 Ų | 139 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | trans | 74.7 | 92 | 164.6 | -51.4 | -31.8 | 0 | 0 | 0 | 119.4 | ||||
| 126 | G | 24.4 | Very low | 25.8 | Very low | 80 Ų | 80 | 142 Ų | 142 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 140.8 | 172.4 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 127 | F | 24.2 | Very low | 25.9 | Very low | 209 Ų | 209 | 139.1 Ų | 139.1 | 92% | 0.917 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -95 | 125.5 | 162.5 | -118 | -101.8 | 0 | 0 | 0 | 107.5 | ||
| 128 | E | 27 | Very low | 25.9 | Very low | 174 Ų | 174 | 138 Ų | 138 | 81% | 0.813 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 123.2 | 172.8 | -67.2 | 178.1 | 135.7 | 0 | 0 | 109.5 | Q130 | E128-Q130 PolarHBondContact O-N 3.35Š|
| 129 | D | 24.8 | Very low | 25.9 | Very low | 162 Ų | 162 | 138.8 Ų | 138.8 | 87% | 0.866 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 118.4 | 173.8 | -73.1 | -42 | 0 | 0 | 0 | 110.6 | ||
| 130 | Q | 25.6 | Very low | 26 | Very low | 142 Ų | 142 | 135 Ų | 135 | 66% | 0.664 | 79% | 0.794 | S | S | * | * | trans | -99.5 | 115.1 | 169.7 | -68.4 | 179.3 | 34.2 | 0 | 0 | 109.2 | E128 | E128-Q130 PolarHBondContact O-N 3.35Š| ||
| 131 | I | 22.9 | Very low | 26 | Very low | 154 Ų | 154 | 135.1 Ų | 135.1 | 79% | 0.79 | 79% | 0.794 | S | S | * | * | trans | -88.9 | 119.4 | 169.5 | -59.7 | 172.7 | 0 | 0 | 0 | 107.5 | ||||
| 132 | L | 25.6 | Very low | 26.3 | Very low | 123 Ų | 123 | 134.7 Ų | 134.7 | 64% | 0.644 | 79% | 0.793 | S | S | * | * | trans | -112.7 | 118.2 | 171.7 | -74.6 | 171.3 | 0 | 0 | 0 | 109.7 | ||||
| 133 | I | 22.8 | Very low | 26.6 | Very low | 148 Ų | 148 | 131 Ų | 131 | 76% | 0.759 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 121.9 | 172.8 | -55.4 | 174.3 | 0 | 0 | 0 | 107.8 | ||
| 134 | P | 25.6 | Very low | 26.9 | Very low | 118 Ų | 118 | 135 Ų | 135 | 77% | 0.766 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 131 | 176.6 | 26.9 | -30.1 | 0 | 0 | 0 | 111.2 | ||
| 135 | V | 25.2 | Very low | 27 | Very low | 131 Ų | 131 | 136.1 Ų | 136.1 | 79% | 0.794 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -90 | 130.6 | 166.8 | -178.6 | 0 | 0 | 0 | 0 | 108 | ||
| 136 | P | 25.2 | Very low | 27 | Very low | 119 Ų | 119 | 135.3 Ų | 135.3 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 135.8 | 178.8 | 25.4 | -32.1 | 0 | 0 | 0 | 111.5 | ||
| 137 | A | 29.3 | Very low | 27 | Very low | 87 Ų | 87 | 138.6 Ų | 138.6 | 72% | 0.719 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 144.5 | 170.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 138 | P | 25.4 | Very low | 27.2 | Very low | 127 Ų | 127 | 136.8 Ų | 136.8 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 137.8 | 174.8 | 27.7 | -32.5 | 0 | 0 | 0 | 110.6 | G140 | P138-G140 PolarHBondContact O-N 2.83Š|
| 139 | A | 29.5 | Very low | 27.1 | Very low | 111 Ų | 111 | 134.3 Ų | 134.3 | 92% | 0.917 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -68.8 | 124.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 140 | G | 30 | Very low | 27 | Very low | 84 Ų | 84 | 133 Ų | 133 | 87% | 0.866 | 77% | 0.77 | S | S | * | * | trans | 125.7 | 100.7 | 162.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | P138 | P138-G140 PolarHBondContact O-N 2.83Š| ||
| 141 | G | 25.9 | Very low | 26.9 | Very low | 67 Ų | 67 | 131 Ų | 131 | 69% | 0.691 | 77% | 0.768 | S | S | * | * | trans | 152.1 | 109.9 | 168.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | D143 | G141-D143 PolarHBondContact O-N 3.23Š| ||
| 142 | D | 33.5 | Very low | 26.9 | Very low | 170 Ų | 170 | 129 Ų | 129 | 91% | 0.909 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -72.3 | 74.1 | 174.6 | -57.3 | -47 | 0 | 0 | 0 | 110.1 | ||
| 143 | D | 30.6 | Very low | 26.8 | Very low | 150 Ų | 150 | 129.6 Ų | 129.6 | 80% | 0.802 | 77% | 0.771 | S | S | * | * | trans | -154.7 | 102.8 | 169.3 | -81.8 | -46.8 | 0 | 0 | 0 | 108.9 | G141 Y145 | G141-D143 PolarHBondContact O-N 3.23Å; D143-Y145 VanDerWaalsContact C-N 3.34Å; D143-Y145 PolarHBondContact O-N 3.31Å | ||
| 144 | D | 32.8 | Very low | 26.7 | Very low | 172 Ų | 172 | 127.1 Ų | 127.1 | 92% | 0.92 | 77% | 0.773 | S | S | * | * | trans | -67.1 | 86.8 | 175.6 | -83.6 | -42 | 0 | 0 | 0 | 110.9 | ||||
| 145 | Y | 30.4 | Very low | 26.6 | Very low | 178 Ų | 178 | 126.4 Ų | 126.4 | 70% | 0.698 | 78% | 0.777 | S | S | * | * | trans | -133.5 | 91.1 | 161.6 | -159.1 | -97.1 | 0 | 0 | 0 | 109.1 | D143 E147 | D143-Y145 VanDerWaalsContact C-N 3.34Å; D143-Y145 PolarHBondContact O-N 3.31Å; Y145-E147 HydrophobicContact CD1-CG 3.84Å; Y145-E147 HydrophobicContact CE1-CG 3.46Å; Y145-E147 VanDerWaalsContact CE1-CG 3.46Å; Y145-E147 PolarHBondContact O-N 3.01Å | ||
| 146 | I | 27.4 | Very low | 26.6 | Very low | 135 Ų | 135 | 124.8 Ų | 124.8 | 69% | 0.692 | 78% | 0.777 | S | S | * | * | trans | -84.8 | 108.3 | 169.1 | -54.5 | -179.5 | 0 | 0 | 0 | 107.6 | Q148 | I146-Q148 HydrophobicContact CG2-CG 3.58Å; I146-Q148 PolarHBondContact O-N 3.26Å | ||
| 147 | E | 24.2 | Very low | 26.6 | Very low | 149 Ų | 149 | 122.8 Ų | 122.8 | 70% | 0.696 | 78% | 0.779 | S | S | * | * | trans | -74.6 | 102.3 | 159 | -70.8 | -154 | 155.3 | 0 | 0 | 108.7 | Y145 | Y145-E147 HydrophobicContact CD1-CG 3.84Å; Y145-E147 HydrophobicContact CE1-CG 3.46Å; Y145-E147 VanDerWaalsContact CE1-CG 3.46Å; Y145-E147 PolarHBondContact O-N 3.01Å | ||
| 148 | Q | 27.6 | Very low | 26.6 | Very low | 172 Ų | 172 | 128.7 Ų | 128.7 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -85.1 | 113.3 | 167.7 | -65.7 | -170.9 | -49 | 0 | 0 | 109 | I146 | I146-Q148 HydrophobicContact CG2-CG 3.58Å; I146-Q148 PolarHBondContact O-N 3.26Å | ||
| 149 | T | 24.4 | Very low | 26.7 | Very low | 122 Ų | 122 | 128.7 Ų | 128.7 | 75% | 0.748 | 79% | 0.791 | S | S | * | * | trans | -80.7 | 117.1 | 166.9 | -58.1 | 0 | 0 | 0 | 0 | 108.3 | V151 | T149-V151 HydrophobicContact CG2-CG2 4.49Š| ||
| 150 | L | 23 | Very low | 26.6 | Very low | 134 Ų | 134 | 127.3 Ų | 127.3 | 70% | 0.702 | 79% | 0.788 | S | S | * | * | trans | -79.2 | 119.4 | 177.5 | -150.5 | 101.1 | 0 | 0 | 0 | 109.2 | ||||
| 151 | V | 23.5 | Very low | 26.4 | Very low | 101 Ų | 101 | 127.3 Ų | 127.3 | 61% | 0.612 | 79% | 0.788 | S | S | * | * | trans | -114.9 | 107.1 | 171.4 | -178 | 0 | 0 | 0 | 0 | 108.7 | T149 V153 | T149-V151 HydrophobicContact CG2-CG2 4.49Å; V151-V153 HydrophobicContact CG1-CG2 4.33Å | ||
| 152 | T | 22.7 | Very low | 26.4 | Very low | 112 Ų | 112 | 128.3 Ų | 128.3 | 69% | 0.687 | 80% | 0.798 | S | S | * | * | trans | -84.7 | 119.7 | 169.1 | 30.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 153 | V | 23 | Very low | 26 | Very low | 134 Ų | 134 | 124.2 Ų | 124.2 | 81% | 0.812 | 80% | 0.796 | S | S | * | * | trans | -101 | 110.4 | 169.5 | -173.4 | 0 | 0 | 0 | 0 | 108.2 | V151 | V151-V153 HydrophobicContact CG1-CG2 4.33Š| ||
| 154 | A | 22.4 | Very low | 25.9 | Very low | 97 Ų | 97 | 122.6 Ų | 122.6 | 80% | 0.802 | 80% | 0.796 | S | S | * | * | trans | -86.2 | 116.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | A156 | A154-A156 PolarHBondContact O-N 2.82Š| ||
| 155 | A | 23.1 | Very low | 25.7 | Very low | 103 Ų | 103 | 120.3 Ų | 120.3 | 85% | 0.851 | 79% | 0.794 | S | S | * | * | trans | -78.9 | 102.5 | 170 | 0 | 0 | 0 | 0 | 0 | 109.7 | G157 | A155-G157 PolarHBondContact O-N 3.44Š| ||
| 156 | A | 24.8 | Very low | 25.5 | Very low | 96 Ų | 96 | 116.9 Ų | 116.9 | 79% | 0.793 | 80% | 0.796 | S | S | * | * | trans | -82.8 | 89.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | A154 K158 | A154-A156 PolarHBondContact O-N 2.82Å; A156-K158 PolarHBondContact O-N 3.14Å | ||
| 157 | G | 26 | Very low | 25.6 | Very low | 78 Ų | 78 | 116 Ų | 116 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | trans | -71.7 | 106.1 | 167.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | A155 | A155-G157 PolarHBondContact O-N 3.44Š| ||
| 158 | K | 28.2 | Very low | 25.6 | Very low | 211 Ų | 211 | 113.1 Ų | 113.1 | 92% | 0.917 | 81% | 0.811 | S | S | * | * | trans | -82.5 | 117.7 | 166.1 | -77.8 | 171.2 | 173.3 | 174.1 | 0 | 109 | A156 | A156-K158 PolarHBondContact O-N 3.14Š| ||
| 159 | S | 27.9 | Very low | 25.5 | Very low | 126 Ų | 126 | 109 Ų | 109 | 88% | 0.881 | 82% | 0.815 | S | S | * | * | trans | -113.9 | 114.4 | 155.3 | 61.9 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 160 | G | 26.7 | Very low | 25.6 | Very low | 83 Ų | 83 | 107 Ų | 107 | 86% | 0.856 | 82% | 0.819 | S | S | * | * | trans | -95.3 | 145.6 | 166.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 161 | G | 26.5 | Very low | 25.9 | Very low | 84 Ų | 84 | 112.1 Ų | 112.1 | 87% | 0.866 | 83% | 0.829 | S | S | * | * | trans | 173.7 | 107 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 162 | G | 25.9 | Very low | 26.1 | Very low | 88 Ų | 88 | 113.2 Ų | 113.2 | 91% | 0.907 | 84% | 0.835 | S | S | * | * | trans | -87.6 | -172.4 | -172.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 163 | G | 25.2 | Very low | 26.5 | Very low | 83 Ų | 83 | 117.2 Ų | 117.2 | 86% | 0.856 | 84% | 0.843 | S | S | * | * | trans | 146.1 | 105.1 | 166.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 164 | S | 27.5 | Very low | 26.9 | Very low | 117 Ų | 117 | 121 Ų | 121 | 82% | 0.818 | 85% | 0.849 | S | S | * | * | trans | -55.6 | 150.9 | 177.5 | 48.3 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 165 | S | 28.7 | Very low | 27.1 | Very low | 123 Ų | 123 | 120 Ų | 120 | 86% | 0.86 | 85% | 0.848 | S | S | * | * | -175.2 | 160.7 | 115.8 | 52.9 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 166 | S | 27.5 | Very low | 27.3 | Very low | 106 Ų | 106 | 119.1 Ų | 119.1 | 74% | 0.741 | 85% | 0.849 | S | S | * | * | trans | -67 | 153 | -164.9 | 51.4 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 167 | S | 27.9 | Very low | 27.4 | Very low | 118 Ų | 118 | 118 Ų | 118 | 83% | 0.825 | 85% | 0.847 | S | S | * | * | 155.5 | 141.3 | 98.9 | 58 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 168 | G | 25.8 | Very low | 27.6 | Very low | 87 Ų | 87 | 124.8 Ų | 124.8 | 90% | 0.897 | 85% | 0.854 | S | S | * | * | trans | 75.6 | 130.5 | 159.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 169 | G | 25.4 | Very low | 27.7 | Very low | 85 Ų | 85 | 124.4 Ų | 124.4 | 88% | 0.876 | 85% | 0.853 | S | S | * | * | cis | 154.8 | 135.3 | 7.8 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 170 | G | 25.8 | Very low | 27.7 | Very low | 80 Ų | 80 | 124.3 Ų | 124.3 | 83% | 0.825 | 85% | 0.852 | S | S | * | * | trans | 125.5 | 97.4 | 157.6 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 171 | R | 28.8 | Very low | 27.6 | Very low | 243 Ų | 243 | 123.4 Ų | 123.4 | 92% | 0.917 | 84% | 0.842 | S | S | * | * | 88.3 | 89.1 | 122.2 | -148.5 | 170.8 | -166.7 | 161.9 | 2.5 | 121.5 | |||||
| 172 | V | 28.3 | Very low | 27.6 | Very low | 124 Ų | 124 | 128.4 Ų | 128.4 | 75% | 0.752 | 84% | 0.84 | S | S | * | * | 27.1 | 123.6 | 122.5 | -162.5 | 0 | 0 | 0 | 0 | 120.6 | |||||
| 173 | K | 31.4 | Very low | 27.5 | Very low | 196 Ų | 196 | 131.5 Ų | 131.5 | 85% | 0.852 | 83% | 0.829 | S | S | * | * | 171.5 | 115.1 | 112.1 | -90.4 | -177.6 | -177.6 | 176.2 | 0 | 109.8 | |||||
| 174 | K | 30.4 | Very low | 27.5 | Very low | 212 Ų | 212 | 131.4 Ų | 131.4 | 92% | 0.922 | 82% | 0.815 | S | S | * | * | 82 | 126.9 | 77.1 | -118.7 | -165.7 | -173.3 | -177.8 | 0 | 115.9 | |||||
| 175 | G | 26.7 | Very low | 27.2 | Very low | 77 Ų | 77 | 135 Ų | 135 | 79% | 0.794 | 81% | 0.812 | S | S | * | * | trans | 115 | 101.4 | 156.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 176 | G | 27.9 | Very low | 26.9 | Very low | 84 Ų | 84 | 136.8 Ų | 136.8 | 87% | 0.866 | 81% | 0.811 | S | S | * | * | 92.7 | 103.2 | 70.1 | 0 | 0 | 0 | 0 | 0 | 107.1 | |||||
| 177 | G | 26.9 | Very low | 26.8 | Very low | 73 Ų | 73 | 137.3 Ų | 137.3 | 75% | 0.753 | 82% | 0.815 | S | S | * | * | 101.4 | 114.3 | 51.8 | 0 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 178 | K | 30.6 | Very low | 26.5 | Very low | 220 Ų | 220 | 135.7 Ų | 135.7 | 96% | 0.957 | 82% | 0.817 | S | S | * | * | 178.8 | 130.1 | 129.4 | -96.9 | 168.8 | -174.4 | -176.1 | 0 | 111.8 | |||||
| 179 | K | 30.4 | Very low | 26.4 | Very low | 204 Ų | 204 | 135.5 Ų | 135.5 | 89% | 0.887 | 82% | 0.815 | S | S | * | * | trans | -88.9 | 151.7 | 171.5 | -62.6 | 172.1 | 173.3 | 176.3 | 0 | 109.4 | ||||
| 180 | S | 27.1 | Very low | 26.4 | Very low | 124 Ų | 124 | 136.6 Ų | 136.6 | 87% | 0.867 | 82% | 0.815 | S | S | * | * | trans | 176.7 | 128.2 | 138.8 | 51.3 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 181 | G | 24.9 | Very low | 26.2 | Very low | 63 Ų | 63 | 136.6 Ų | 136.6 | 65% | 0.649 | 82% | 0.816 | S | S | * | * | cis | 133.1 | 118.4 | 27.4 | 0 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 182 | K | 26.3 | Very low | 26.1 | Very low | 189 Ų | 189 | 130 Ų | 130 | 82% | 0.822 | 81% | 0.813 | S | S | * | * | 60 | 141.8 | 119.1 | -66.2 | 180 | 179.9 | 177.3 | 0 | 114.6 | |||||
| 183 | K | 24.3 | Very low | 26 | Very low | 153 Ų | 153 | 129.3 Ų | 129.3 | 67% | 0.665 | 82% | 0.821 | S | S | * | * | cis | 176.5 | 133.9 | 12.6 | -114.9 | 178.9 | -179.3 | -167.3 | 0 | 103.7 | ||||
| 184 | S | 24.5 | Very low | 25.6 | Very low | 82 Ų | 82 | 124 Ų | 124 | 57% | 0.573 | 82% | 0.822 | S | S | * | * | 60.3 | 158.1 | 110.4 | 74.8 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 185 | Y | 21.6 | Very low | 25.5 | Very low | 192 Ų | 192 | 117.8 Ų | 117.8 | 75% | 0.753 | 82% | 0.818 | S | S | * | * | trans | 104.9 | 103.9 | 172.5 | -55.8 | -67.7 | 0 | 0 | 0 | 113.4 | ||||
| 186 | L | 23.1 | Very low | 25.4 | Very low | 160 Ų | 160 | 118.5 Ų | 118.5 | 84% | 0.838 | 83% | 0.825 | S | S | * | * | 54.5 | 128 | 76.4 | -64.6 | 174.6 | 0 | 0 | 0 | 110.8 | |||||
| 187 | S | 24.4 | Very low | 25.2 | Very low | 117 Ų | 117 | 118.1 Ų | 118.1 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | cis | -176.8 | 156.9 | 24.4 | 46.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 188 | G | 22.6 | Very low | 25.3 | Very low | 85 Ų | 85 | 119.5 Ų | 119.5 | 88% | 0.876 | 83% | 0.825 | S | S | * | * | trans | 112.4 | 126.8 | 138.1 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 189 | G | 23.5 | Very low | 25.2 | Very low | 82 Ų | 82 | 116.3 Ų | 116.3 | 85% | 0.845 | 82% | 0.819 | S | S | * | * | trans | 146.8 | 79.4 | 155 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 190 | A | 24.7 | Very low | 25.3 | Very low | 108 Ų | 108 | 112.5 Ų | 112.5 | 89% | 0.893 | 82% | 0.815 | S | S | * | * | trans | -4.1 | 132.6 | 160.6 | 0 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 191 | G | 22.9 | Very low | 25.5 | Very low | 81 Ų | 81 | 109.7 Ų | 109.7 | 84% | 0.835 | 81% | 0.805 | S | S | * | * | 104.7 | 99.7 | 116.9 | 0 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 192 | A | 25.5 | Very low | 26 | Very low | 104 Ų | 104 | 115.1 Ų | 115.1 | 86% | 0.86 | 82% | 0.82 | S | S | * | * | 172.4 | 124.4 | 126.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 193 | A | 25.6 | Very low | 26.6 | Very low | 110 Ų | 110 | 113.8 Ų | 113.8 | 91% | 0.909 | 81% | 0.813 | S | S | * | * | trans | 15.3 | 131.4 | 155.8 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 194 | G | 24.6 | Very low | 26.9 | Very low | 85 Ų | 85 | 115.3 Ų | 115.3 | 88% | 0.876 | 82% | 0.82 | S | S | * | * | trans | 134 | 110.1 | 135.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 195 | G | 26.8 | Very low | 27.4 | Very low | 81 Ų | 81 | 118.2 Ų | 118.2 | 84% | 0.835 | 82% | 0.819 | S | S | * | * | trans | 124 | 97.9 | 159.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 196 | G | 24.7 | Very low | 27.8 | Very low | 91 Ų | 91 | 113.8 Ų | 113.8 | 94% | 0.938 | 81% | 0.805 | S | S | * | * | trans | -71.6 | 127.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 197 | G | 25.3 | Very low | 28.3 | Very low | 77 Ų | 77 | 111.6 Ų | 111.6 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | trans | -120.7 | 116.7 | 154 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 198 | A | 28.7 | Very low | 28.8 | Very low | 102 Ų | 102 | 111.6 Ų | 111.6 | 84% | 0.843 | 78% | 0.776 | S | S | * | * | trans | -94 | 125 | 175.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 199 | D | 28.2 | Very low | 29.2 | Very low | 152 Ų | 152 | 113.1 Ų | 113.1 | 81% | 0.813 | 76% | 0.76 | S | S | * | * | trans | -45.4 | 136.9 | 161.2 | -87.5 | -84.8 | 0 | 0 | 0 | 112.6 | ||||
| 200 | P | 32.7 | Very low | 29.7 | Very low | 125 Ų | 125 | 112.4 Ų | 112.4 | 81% | 0.812 | 74% | 0.739 | S | S | * | * | trans | -75.1 | 126 | 164.9 | 28.3 | -27 | 0 | 0 | 0 | 110.3 | ||||
| 201 | G | 31.5 | Very low | 29.9 | Very low | 64 Ų | 64 | 111.3 Ų | 111.3 | 66% | 0.66 | 72% | 0.715 | S | S | * | * | trans | -62.9 | 150.7 | -167.8 | 0 | 0 | 0 | 0 | 0 | 117.3 | K203 | G201-K203 PolarHBondContact O-N 2.97Š| ||
| 202 | N | 34.4 | Very low | 30.4 | Very low | 178 Ų | 178 | 111.1 Ų | 111.1 | 95% | 0.952 | 69% | 0.694 | S | S | * | * | trans | -41.7 | 115 | 162.3 | -103.8 | -3.2 | 0 | 0 | 0 | 112.1 | ||||
| 203 | K | 38.3 | Very low | 30.5 | Very low | 160 Ų | 160 | 110.1 Ų | 110.1 | 70% | 0.696 | 67% | 0.671 | S | S | * | * | trans | -92.9 | 127 | 167.1 | -64.7 | -176.8 | -179.2 | -177.9 | 0 | 109.2 | G201 W205 | G201-K203 PolarHBondContact O-N 2.97Å; K203-W205 VanDerWaalsContact O-CD1 3.32Å | ||
| 204 | K | 30.9 | Very low | 30.9 | Very low | 186 Ų | 186 | 108.3 Ų | 108.3 | 81% | 0.809 | 65% | 0.648 | S | S | * | * | trans | -87.4 | 115.8 | 177.7 | -172.5 | -177.5 | 178.8 | -168.3 | 0 | 108.3 | ||||
| 205 | W | 34.8 | Very low | 31 | Very low | 142 Ų | 142 | 113.1 Ų | 113.1 | 54% | 0.538 | 65% | 0.653 | S | S | . | * | P | Polyproline II helix | trans | -101 | 137.2 | 176.7 | -59.7 | 88.8 | 0 | 0 | 0 | 109.5 | K203 W224 | K203-W205 VanDerWaalsContact O-CD1 3.32Å; W205-W224 HydrophobicContact CB-CE3 3.68Å; W205-W224 HydrophobicContact CB-CZ3 4.16Å; W205-W224 HydrophobicContact CE3-CB 4.43Å |
| 206 | E | 30.9 | Very low | 31.3 | Very low | 100 Ų | 100 | 118.8 Ų | 118.8 | 47% | 0.467 | 66% | 0.658 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -100.5 | 129.4 | 169.1 | -84 | -166.8 | 164.7 | 0 | 0 | 110.5 | K208 W224 S225 | E206-K208 IonicContact OE2-NZ 3.62Å; E206-W224 WeakPolarHBondContact O-CA 3.47Å; E206-S225 PolarHBondContact N-O 3.14Å; E206-S225 PolarHBondContact O-N 3.43Å; E206-S225 VanDerWaalsContact O-N 3.12Å |
| 207 | Q | 33.2 | Very low | 31.6 | Very low | 114 Ų | 114 | 116.2 Ų | 116.2 | 53% | 0.533 | 63% | 0.631 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -92.3 | 127 | 175.4 | -169.2 | 177.5 | 2.2 | 0 | 0 | 109.4 | T222 M223 W224 | Q207-T222 HydrophobicContact CG-CG2 3.55Å; Q207-M223 CarbonylContact C-O 3.46Å; Q207-M223 WeakPolarHBondContact CA-O 3.4Å; Q207-W224 HydrophobicContact CB-CD2 4.08Å; Q207-W224 HydrophobicContact CB-CE3 3.79Å; Q207-W224 HydrophobicContact CB-CH2 3.76Å; Q207-W224 HydrophobicContact CB-CZ2 4.01Å; Q207-W224 HydrophobicContact CB-CZ3 3.65Å; Q207-W224 VanDerWaalsContact CD-CZ2 3.42Å; Q207-W224 HydrophobicContact CG-CD2 4.19Å; Q207-W224 HydrophobicContact CG-CE3 4.37Å; Q207-W224 HydrophobicContact CG-CH2 3.97Å; Q207-W224 HydrophobicContact CG-CZ2 3.71Å; Q207-W224 HydrophobicContact CG-CZ3 4.3Å |
| 208 | K | 35 | Very low | 31.7 | Very low | 116 Ų | 116 | 116 Ų | 116 | 50% | 0.504 | 61% | 0.609 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -131.4 | 129.8 | 174 | -73.4 | 178.8 | -177.6 | 161.5 | 0 | 110 | E206 M223 | E206-K208 IonicContact OE2-NZ 3.62Å; K208-M223 PolarHBondContact N-O 3.27Å; K208-M223 PolarHBondContact O-N 2.86Å |
| 209 | Q | 31.7 | Very low | 31.9 | Very low | 118 Ų | 118 | 116.1 Ų | 116.1 | 55% | 0.551 | 59% | 0.591 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -101.7 | 129.8 | 179 | -158.2 | 168.4 | -10.7 | 0 | 0 | 109.4 | S220 T222 | Q209-S220 PolarHBondContact NE2-OG 3.3Å; Q209-T222 HydrophobicContact CB-CG2 3.9Å; Q209-T222 HydrophobicContact CG-CG2 4.02Å |
| 210 | V | 33.1 | Very low | 31.8 | Very low | 66 Ų | 66 | 111.3 Ų | 111.3 | 40% | 0.4 | 57% | 0.57 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -121.9 | 128.8 | -178.4 | -177.1 | 0 | 0 | 0 | 0 | 108.2 | S220 V221 | V210-S220 CarbonylContact O-C 3.55Å; V210-S220 WeakPolarHBondContact O-CA 3.43Å; V210-V221 PolarHBondContact N-O 2.75Å; V210-V221 PolarHBondContact O-N 3.21Å |
| 211 | Q | 30.3 | Very low | 31.9 | Very low | 85 Ų | 85 | 108.4 Ų | 108.4 | 40% | 0.397 | 55% | 0.55 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.9 | 137.4 | 174.5 | -66.8 | -151.7 | -20.3 | 0 | 0 | 111 | V21 E218 | V21-Q211 PolarHBondContact O-OE1 3.47Å; Q211-E218 PolarHBondContact OE1-OE1 3.25Å |
| 212 | I | 32.1 | Very low | 31.9 | Very low | 77 Ų | 77 | 108.1 Ų | 108.1 | 40% | 0.395 | 54% | 0.535 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.2 | 119.6 | -179.6 | -54.5 | 176.4 | 0 | 0 | 0 | 107.3 | T214 F219 V221 | I212-T214 HydrophobicContact CG2-CG2 4.46Å; I212-F219 HydrophobicContact CB-CE2 4.31Å; I212-F219 PolarHBondContact N-O 2.75Å; I212-F219 PolarHBondContact O-N 3.29Å; I212-V221 HydrophobicContact CD1-CG2 4.48Å |
| 213 | K | 28.7 | Very low | 31.9 | Very low | 83 Ų | 83 | 104 Ų | 104 | 36% | 0.361 | 51% | 0.511 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.5 | 128.6 | 173.8 | -72.9 | 176.1 | 161.5 | 77.1 | 0 | 109.7 | L23 E218 | L23-K213 HydrophobicContact CD2-CD 3.9Å; L23-K213 HydrophobicContact CG-CD 4.46Å; K213-E218 VanDerWaalsContact CE-OE1 3.32Å; K213-E218 WeakPolarHBondContact CE-OE1 3.13Å; K213-E218 WeakPolarHBondContact CE-OE2 3.49Å; K213-E218 HydrophobicContact CG-CB 3.87Å; K213-E218 HydrophobicContact CG-CG 3.54Å; K213-E218 WeakPolarHBondContact CG-OE1 3.42Å; K213-E218 IonicContact NZ-OE1 3.99Å; K213-E218 PolarHBondContact NZ-OE1 3.32Å; K213-E218 IonicContact NZ-OE2 2.59Å; K213-E218 PolarHBondContact NZ-OE2 2.84Å |
| 214 | T | 33.5 | Very low | 31.7 | Very low | 72 Ų | 72 | 103.5 Ų | 103.5 | 44% | 0.442 | 51% | 0.505 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.5 | 170.8 | 167.1 | 72.8 | 0 | 0 | 0 | 0 | 110.1 | I212 E216 G217 F219 | I212-T214 HydrophobicContact CG2-CG2 4.46Å; T214-E216 PolarHBondContact O-N 3.02Å; T214-E216 VanDerWaalsContact O-N 3.16Å; T214-G217 PolarHBondContact N-O 3.19Å; T214-G217 PolarHBondContact O-N 3.35Å; T214-G217 PolarHBondContact OG1-O 3.17Å; T214-F219 HydrophobicContact CG2-CE1 3.99Å; T214-F219 HydrophobicContact CG2-CZ 4.07Å |
| 215 | L | 27.2 | Very low | 31.9 | Very low | 187 Ų | 187 | 97.4 Ų | 97.4 | 98% | 0.979 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64 | -15.8 | -179.8 | -66.7 | 171.2 | 0 | 0 | 0 | 113.5 | ||
| 216 | E | 32.2 | Very low | 31.8 | Very low | 199 Ų | 199 | 93.8 Ų | 93.8 | 93% | 0.93 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.4 | 1.1 | 179.3 | -61.5 | -171.2 | 146.6 | 0 | 0 | 113.3 | T214 | T214-E216 PolarHBondContact O-N 3.02Å; T214-E216 VanDerWaalsContact O-N 3.16Å |
| 217 | G | 31.9 | Very low | 32.1 | Very low | 37 Ų | 37 | 96 Ų | 96 | 38% | 0.381 | 50% | 0.497 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 143.8 | 168.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | T214 | T214-G217 PolarHBondContact N-O 3.19Å; T214-G217 PolarHBondContact O-N 3.35Å; T214-G217 PolarHBondContact OG1-O 3.17Å |
| 218 | E | 27.6 | Very low | 32.2 | Very low | 72 Ų | 72 | 98.4 Ų | 98.4 | 34% | 0.336 | 51% | 0.509 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.5 | 135.3 | 179.3 | -175.7 | 165.2 | -151 | 0 | 0 | 112.1 | Q211 K213 | Q211-E218 PolarHBondContact OE1-OE1 3.25Å; K213-E218 VanDerWaalsContact CE-OE1 3.32Å; K213-E218 WeakPolarHBondContact CE-OE1 3.13Å; K213-E218 WeakPolarHBondContact CE-OE2 3.49Å; K213-E218 HydrophobicContact CG-CB 3.87Å; K213-E218 HydrophobicContact CG-CG 3.54Å; K213-E218 WeakPolarHBondContact CG-OE1 3.42Å; K213-E218 IonicContact NZ-OE1 3.99Å; K213-E218 PolarHBondContact NZ-OE1 3.32Å; K213-E218 IonicContact NZ-OE2 2.59Å; K213-E218 PolarHBondContact NZ-OE2 2.84Å |
| 219 | F | 31.7 | Very low | 32.4 | Very low | 106 Ų | 106 | 102.5 Ų | 102.5 | 47% | 0.465 | 53% | 0.526 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.6 | 148 | 174.7 | 48.3 | -89.2 | 0 | 0 | 0 | 112.1 | I212 T214 V221 | I212-F219 HydrophobicContact CB-CE2 4.31Å; I212-F219 PolarHBondContact N-O 2.75Å; I212-F219 PolarHBondContact O-N 3.29Å; T214-F219 HydrophobicContact CG2-CE1 3.99Å; T214-F219 HydrophobicContact CG2-CZ 4.07Å; F219-V221 HydrophobicContact CD2-CG2 4.3Å |
| 220 | S | 26.7 | Very low | 32.4 | Very low | 51 Ų | 51 | 105.1 Ų | 105.1 | 36% | 0.357 | 54% | 0.536 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.3 | 132.8 | 178.7 | 75.6 | 0 | 0 | 0 | 0 | 111.3 | Q209 V210 | Q209-S220 PolarHBondContact NE2-OG 3.3Å; V210-S220 CarbonylContact O-C 3.55Å; V210-S220 WeakPolarHBondContact O-CA 3.43Å |
| 221 | V | 34.5 | Very low | 32.2 | Very low | 64 Ų | 64 | 109.1 Ų | 109.1 | 39% | 0.388 | 56% | 0.555 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -113.7 | 132.6 | 175.3 | -179.4 | 0 | 0 | 0 | 0 | 109.1 | V210 I212 F219 M223 | V210-V221 PolarHBondContact N-O 2.75Å; V210-V221 PolarHBondContact O-N 3.21Å; I212-V221 HydrophobicContact CD1-CG2 4.48Å; F219-V221 HydrophobicContact CD2-CG2 4.3Å; V221-M223 HydrophobicContact CG1-CG 4.37Å |
| 222 | T | 32.2 | Very low | 32.1 | Very low | 57 Ų | 57 | 112.3 Ų | 112.3 | 35% | 0.35 | 57% | 0.573 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -103.4 | 124.8 | 178.8 | -29.2 | 0 | 0 | 0 | 0 | 110.3 | Q207 Q209 | Q207-T222 HydrophobicContact CG-CG2 3.55Å; Q209-T222 HydrophobicContact CB-CG2 3.9Å; Q209-T222 HydrophobicContact CG-CG2 4.02Å |
| 223 | M | 34.3 | Very low | 31.8 | Very low | 93 Ų | 93 | 115.8 Ų | 115.8 | 46% | 0.458 | 59% | 0.592 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -116.5 | 151.6 | -174.5 | -61.8 | 177.9 | 67 | 0 | 0 | 110.8 | M1 Q207 K208 V221 | M1-M223 HydrophobicContact SD-CE 4.46Å; Q207-M223 CarbonylContact C-O 3.46Å; Q207-M223 WeakPolarHBondContact CA-O 3.4Å; K208-M223 PolarHBondContact N-O 3.27Å; K208-M223 PolarHBondContact O-N 2.86Å; V221-M223 HydrophobicContact CG1-CG 4.37Å |
| 224 | W | 34.4 | Very low | 31.8 | Very low | 148 Ų | 148 | 120.6 Ų | 120.6 | 56% | 0.561 | 62% | 0.616 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -119.3 | 132.3 | 174.3 | -60.4 | 82.7 | 0 | 0 | 0 | 109.2 | W205 E206 Q207 | W205-W224 HydrophobicContact CB-CE3 3.68Å; W205-W224 HydrophobicContact CB-CZ3 4.16Å; W205-W224 HydrophobicContact CE3-CB 4.43Å; E206-W224 WeakPolarHBondContact O-CA 3.47Å; Q207-W224 HydrophobicContact CB-CD2 4.08Å; Q207-W224 HydrophobicContact CB-CE3 3.79Å; Q207-W224 HydrophobicContact CB-CH2 3.76Å; Q207-W224 HydrophobicContact CB-CZ2 4.01Å; Q207-W224 HydrophobicContact CB-CZ3 3.65Å; Q207-W224 VanDerWaalsContact CD-CZ2 3.42Å; Q207-W224 HydrophobicContact CG-CD2 4.19Å; Q207-W224 HydrophobicContact CG-CE3 4.37Å; Q207-W224 HydrophobicContact CG-CH2 3.97Å; Q207-W224 HydrophobicContact CG-CZ2 3.71Å; Q207-W224 HydrophobicContact CG-CZ3 4.3Å |
| 225 | S | 34.3 | Very low | 31.4 | Very low | 59 Ų | 59 | 126.1 Ų | 126.1 | 41% | 0.413 | 64% | 0.637 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -124.9 | 143.8 | -179.5 | 163.7 | 0 | 0 | 0 | 0 | 110.1 | E206 | E206-S225 PolarHBondContact N-O 3.14Å; E206-S225 PolarHBondContact O-N 3.43Å; E206-S225 VanDerWaalsContact O-N 3.12Å |
| 226 | S | 33.3 | Very low | 31.4 | Very low | 66 Ų | 66 | 123 Ų | 123 | 46% | 0.462 | 63% | 0.625 | S | S | . | * | trans | -125.4 | 126.9 | 172.1 | 179.4 | 0 | 0 | 0 | 0 | 108.6 | E228 | S226-E228 PolarHBondContact O-N 2.97Š| ||
| 227 | D | 36.6 | Very low | 31 | Very low | 145 Ų | 145 | 119.6 Ų | 119.6 | 78% | 0.775 | 62% | 0.618 | S | S | * | * | trans | -84 | 96.1 | -179 | -73.4 | -51 | 0 | 0 | 0 | 111.2 | ||||
| 228 | E | 34.4 | Very low | 30.7 | Very low | 166 Ų | 166 | 123.7 Ų | 123.7 | 78% | 0.776 | 64% | 0.635 | S | S | * | * | trans | -155.9 | 108.3 | 149.6 | -120.4 | -177.1 | 131.7 | 0 | 0 | 111.6 | S226 | S226-E228 PolarHBondContact O-N 2.97Š| ||
| 229 | K | 40.2 | Very low | 30.5 | Very low | 202 Ų | 202 | 129 Ų | 129 | 88% | 0.878 | 66% | 0.66 | S | S | * | * | trans | -75.1 | 128.9 | 169.6 | -113.2 | 174.4 | 175.4 | 173.5 | 0 | 109.1 | ||||
| 230 | K | 31.6 | Very low | 30.3 | Very low | 173 Ų | 173 | 132.9 Ų | 132.9 | 75% | 0.752 | 68% | 0.68 | S | S | * | * | trans | -130.8 | 123.3 | 160.2 | -79 | -171.8 | 179.2 | 174.2 | 0 | 110.5 | ||||
| 231 | D | 27.8 | Very low | 30.2 | Very low | 149 Ų | 149 | 139.3 Ų | 139.3 | 80% | 0.797 | 70% | 0.704 | S | S | * | * | trans | -61.7 | 141 | 175.2 | -56.8 | -61.8 | 0 | 0 | 0 | 110.8 | ||||
| 232 | I | 28.9 | Very low | 29.9 | Very low | 153 Ų | 153 | 144.4 Ų | 144.4 | 79% | 0.785 | 73% | 0.727 | S | S | * | * | trans | -123.8 | 116.7 | 170.9 | -61.3 | 174.6 | 0 | 0 | 0 | 107.8 | ||||
| 233 | D | 25.9 | Very low | 29.7 | Very low | 149 Ų | 149 | 149.4 Ų | 149.4 | 80% | 0.797 | 75% | 0.75 | S | S | * | * | trans | -76.5 | 124.4 | 177.9 | -4.6 | -42 | 0 | 0 | 0 | 109.8 | ||||
| 234 | H | 28.9 | Very low | 29.4 | Very low | 184 Ų | 184 | 147.7 Ų | 147.7 | 85% | 0.852 | 76% | 0.757 | S | S | * | * | trans | -84.5 | 121.2 | 169.6 | -96.8 | -94.6 | 0 | 0 | 0 | 109.6 | ||||
| 235 | E | 25.9 | Very low | 29.3 | Very low | 189 Ų | 189 | 149.8 Ų | 149.8 | 88% | 0.883 | 77% | 0.773 | S | S | * | * | trans | -126.1 | 111.3 | 161.2 | -151 | 175.5 | -178.9 | 0 | 0 | 109.6 | ||||
| 236 | T | 26.8 | Very low | 29.1 | Very low | 120 Ų | 120 | 154.2 Ų | 154.2 | 74% | 0.736 | 79% | 0.792 | S | S | * | * | trans | -76.3 | 128.7 | 178 | 38.3 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 237 | V | 22.7 | Very low | 28.9 | Very low | 128 Ų | 128 | 156.7 Ų | 156.7 | 78% | 0.776 | 81% | 0.809 | S | S | * | * | trans | -125.3 | 116.8 | 156.6 | 179 | 0 | 0 | 0 | 0 | 108 | ||||
| 238 | V | 26.2 | Very low | 28.6 | Very low | 123 Ų | 123 | 154.5 Ų | 154.5 | 75% | 0.745 | 80% | 0.803 | S | S | * | * | trans | -87.5 | 121.8 | 171.5 | 178.5 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 239 | E | 23.9 | Very low | 28.6 | Very low | 184 Ų | 184 | 150.6 Ų | 150.6 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | -133 | 111.3 | 155.3 | -79.6 | -167.1 | 154.8 | 0 | 0 | 109.1 | ||||
| 240 | E | 27.1 | Very low | 28.5 | Very low | 187 Ų | 187 | 147 Ų | 147 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | trans | -69.9 | 131 | 167.6 | -70.3 | -178.4 | 125.9 | 0 | 0 | 109.8 | ||||
| 241 | Q | 25.2 | Very low | 28.8 | Very low | 187 Ų | 187 | 144.6 Ų | 144.6 | 87% | 0.874 | 77% | 0.769 | S | S | * | * | trans | -139.6 | 119.8 | 159.5 | -129.7 | 177.7 | 3.6 | 0 | 0 | 112.3 | ||||
| 242 | I | 27.4 | Very low | 29.6 | Very low | 170 Ų | 170 | 140.8 Ų | 140.8 | 87% | 0.872 | 75% | 0.754 | S | S | * | * | trans | -58.1 | 122.5 | 179.6 | -62.2 | 160.6 | 0 | 0 | 0 | 110.6 | ||||
| 243 | I | 29 | Very low | 30 | Very low | 162 Ų | 162 | 139.6 Ų | 139.6 | 83% | 0.831 | 75% | 0.745 | S | S | * | * | trans | -92.3 | 101.5 | 171.6 | -53.9 | 175.3 | 0 | 0 | 0 | 108.7 | ||||
| 244 | G | 27.1 | Very low | 31 | Very low | 58 Ų | 58 | 136.1 Ų | 136.1 | 60% | 0.598 | 72% | 0.721 | S | S | * | * | trans | -85 | 124.3 | 162.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | N246 | G244-N246 PolarHBondContact O-N 3.43Š| ||
| 245 | E | 32 | Very low | 31.3 | Very low | 192 Ų | 192 | 135.3 Ų | 135.3 | 90% | 0.897 | 72% | 0.72 | S | S | * | * | trans | -67.3 | 95.7 | 172.1 | -65.1 | -177.8 | 135.4 | 0 | 0 | 110.7 | ||||
| 246 | N | 29.9 | Very low | 32.3 | Very low | 152 Ų | 152 | 130.4 Ų | 130.4 | 81% | 0.813 | 70% | 0.703 | S | S | * | * | trans | -115.5 | 112.5 | 161.3 | -80.4 | -42.3 | 0 | 0 | 0 | 108.4 | G244 | G244-N246 PolarHBondContact O-N 3.43Š| ||
| 247 | S | 30.5 | Very low | 33.1 | Very low | 117 Ų | 117 | 128.1 Ų | 128.1 | 82% | 0.818 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -60 | 131.8 | 158.5 | -79.3 | 0 | 0 | 0 | 0 | 108.1 | ||
| 248 | P | 30.2 | Very low | 34 | Very low | 100 Ų | 100 | 130.8 Ų | 130.8 | 65% | 0.649 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 141.2 | 175.6 | 26.2 | -30.5 | 0 | 0 | 0 | 109.3 | ||
| 249 | P | 34 | Very low | 34.6 | Very low | 83 Ų | 83 | 132.1 Ų | 132.1 | 54% | 0.539 | 70% | 0.7 | S | S | . | * | P | Polyproline II helix | trans | -60.9 | 150.5 | 171.5 | 21.7 | -26.9 | 0 | 0 | 0 | 110.3 | Y251 | P249-Y251 HydrophobicContact CG-CD2 4.27Å; P249-Y251 HydrophobicContact CG-CE2 3.58Å; P249-Y251 WeakPolarHBondContact O-CD2 3.31Å; P249-Y251 PolarHBondContact O-N 3.26Å |
| 250 | D | 36.6 | Very low | 35.6 | Very low | 126 Ų | 126 | 127.9 Ų | 127.9 | 67% | 0.674 | 68% | 0.683 | S | S | * | * | trans | -63.2 | 106.9 | 175.4 | -179.7 | -0.5 | 0 | 0 | 0 | 109.6 | S252 | D250-S252 VanDerWaalsContact C-N 3.31Å; D250-S252 WeakPolarHBondContact OD1-CB 3.42Å; D250-S252 PolarHBondContact OD1-N 3.2Å; D250-S252 PolarHBondContact OD1-OG 3.03Å; D250-S252 PolarHBondContact OD2-OG 3.29Å | ||
| 251 | Y | 39.4 | Very low | 36 | Very low | 124 Ų | 124 | 121.2 Ų | 121.2 | 49% | 0.486 | 66% | 0.656 | S | S | . | * | trans | -88 | 7.3 | -177 | -86.4 | -85.8 | 0 | 0 | 0 | 113.9 | P249 E253 Y254 M255 | P249-Y251 HydrophobicContact CG-CD2 4.27Å; P249-Y251 HydrophobicContact CG-CE2 3.58Å; P249-Y251 WeakPolarHBondContact O-CD2 3.31Å; P249-Y251 PolarHBondContact O-N 3.26Å; Y251-E253 PolarHBondContact O-N 3.32Å; Y251-Y254 AromaticContact CD1-CD2 3.26Å; Y251-Y254 HydrophobicContact CD1-CD2 3.26Å; Y251-Y254 AromaticContact CD1-CE2 3.7Å; Y251-Y254 HydrophobicContact CD1-CE2 3.7Å; Y251-Y254 AromaticContact CD1-CG 3.95Å; Y251-Y254 HydrophobicContact CD1-CG 3.95Å; Y251-Y254 AromaticContact CE1-CD2 3.96Å; Y251-Y254 HydrophobicContact CE1-CD2 3.96Å; Y251-Y254 HydrophobicContact CE1-CE2 4.07Å; Y251-Y254 AromaticContact CG-CD2 3.96Å; Y251-Y254 HydrophobicContact CG-CD2 3.96Å; Y251-Y254 HydrophobicContact CG-CE2 4.32Å; Y251-Y254 PolarHBondContact O-N 2.7Å; Y251-Y254 VanDerWaalsContact O-N 3.15Å; Y251-M255 PolarHBondContact O-N 3.37Å | ||
| 252 | S | 43.1 | Very low | 36.4 | Very low | 68 Ų | 68 | 117.7 Ų | 117.7 | 48% | 0.476 | 65% | 0.649 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -59 | -32.5 | -174.9 | 58.8 | 0 | 0 | 0 | 0 | 113.5 | D250 | D250-S252 VanDerWaalsContact C-N 3.31Å; D250-S252 WeakPolarHBondContact OD1-CB 3.42Å; D250-S252 PolarHBondContact OD1-N 3.2Å; D250-S252 PolarHBondContact OD1-OG 3.03Å; D250-S252 PolarHBondContact OD2-OG 3.29Å |
| 253 | E | 37.5 | Very low | 37.2 | Very low | 128 Ų | 128 | 113.6 Ų | 113.6 | 60% | 0.598 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.4 | -31.4 | 178.5 | -67 | -164.9 | 158.4 | 0 | 0 | 113.7 | Y251 T256 | Y251-E253 PolarHBondContact O-N 3.32Å; E253-T256 PolarHBondContact O-N 2.75Å; E253-T256 PolarHBondContact O-OG1 3.39Å |
| 254 | Y | 46.9 | Very low | 38.1 | Very low | 76 Ų | 76 | 107.7 Ų | 107.7 | 30% | 0.298 | 63% | 0.628 | S | S | . | * | G | 310 helix | trans | -77 | -26.2 | -178.6 | -50.5 | -83.2 | 0 | 0 | 0 | 112.6 | Y251 T256 G257 P261 | Y251-Y254 AromaticContact CD1-CD2 3.26Å; Y251-Y254 HydrophobicContact CD1-CD2 3.26Å; Y251-Y254 AromaticContact CD1-CE2 3.7Å; Y251-Y254 HydrophobicContact CD1-CE2 3.7Å; Y251-Y254 AromaticContact CD1-CG 3.95Å; Y251-Y254 HydrophobicContact CD1-CG 3.95Å; Y251-Y254 AromaticContact CE1-CD2 3.96Å; Y251-Y254 HydrophobicContact CE1-CD2 3.96Å; Y251-Y254 HydrophobicContact CE1-CE2 4.07Å; Y251-Y254 AromaticContact CG-CD2 3.96Å; Y251-Y254 HydrophobicContact CG-CD2 3.96Å; Y251-Y254 HydrophobicContact CG-CE2 4.32Å; Y251-Y254 PolarHBondContact O-N 2.7Å; Y251-Y254 VanDerWaalsContact O-N 3.15Å; Y254-T256 PolarHBondContact O-N 3.02Å; Y254-G257 PolarHBondContact O-N 2.89Å; Y254-P261 HydrophobicContact CD1-CB 4.31Å; Y254-P261 HydrophobicContact CE1-CB 4.35Å |
| 255 | M | 37 | Very low | 39.2 | Very low | 167 Ų | 167 | 107.9 Ų | 107.9 | 82% | 0.823 | 62% | 0.615 | S | S | * | * | G | 310 helix | trans | -66.9 | -16.9 | 175.8 | -66.9 | -66.8 | -131.8 | 0 | 0 | 113 | Y251 | Y251-M255 PolarHBondContact O-N 3.37Š|
| 256 | T | 47 | Very low | 39.6 | Very low | 87 Ų | 87 | 104.9 Ų | 104.9 | 53% | 0.534 | 61% | 0.612 | S | S | . | * | G | 310 helix | trans | -87.6 | -2.8 | 178.1 | 70.6 | 0 | 0 | 0 | 0 | 114 | E253 Y254 K258 | E253-T256 PolarHBondContact O-N 2.75Å; E253-T256 PolarHBondContact O-OG1 3.39Å; Y254-T256 PolarHBondContact O-N 3.02Å; T256-K258 PolarHBondContact O-N 2.74Å |
| 257 | G | 43.2 | Very low | 40.6 | Very low | 71 Ų | 71 | 101.3 Ų | 101.3 | 73% | 0.732 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 71.4 | 9.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | Y254 | Y254-G257 PolarHBondContact O-N 2.89Š|
| 258 | K | 41.3 | Very low | 41.8 | Very low | 184 Ų | 184 | 98 Ų | 98 | 80% | 0.8 | 58% | 0.584 | S | S | * | * | S | Bend | trans | -90.8 | -15.5 | -175.6 | -67.7 | -178.8 | -178.5 | 177.3 | 0 | 114.7 | T256 | T256-K258 PolarHBondContact O-N 2.74Š|
| 259 | K | 39.1 | Very low | 43.1 | Very low | 151 Ų | 151 | 97.5 Ų | 97.5 | 66% | 0.657 | 58% | 0.576 | S | S | * | * | S | Bend | trans | -145.8 | 142 | 176.4 | -75.2 | -174.6 | 179 | 174.9 | 0 | 111.1 | ||
| 260 | L | 43.4 | Very low | 44.2 | Very low | 95 Ų | 95 | 97.2 Ų | 97.2 | 50% | 0.497 | 57% | 0.569 | S | S | . | * | P | Polyproline II helix | trans | -79.6 | 149.4 | 172.6 | -78.8 | 161.1 | 0 | 0 | 0 | 111 | I265 L270 | L260-I265 HydrophobicContact CD2-CD1 4.33Å; L260-L270 HydrophobicContact CD1-CD1 3.77Å |
| 261 | P | 36.1 | Very low | 45.1 | Very low | 47 Ų | 47 | 96.1 Ų | 96.1 | 31% | 0.305 | 57% | 0.572 | S | S | . | * | P | Polyproline II helix | trans | -66.6 | 148.7 | 177.6 | 27.4 | -33.3 | 0 | 0 | 0 | 111.9 | Y254 G263 G264 | Y254-P261 HydrophobicContact CD1-CB 4.31Å; Y254-P261 HydrophobicContact CE1-CB 4.35Å; P261-G263 PolarHBondContact O-N 2.95Å; P261-G264 PolarHBondContact O-N 3.29Å |
| 262 | P | 33.8 | Very low | 46.3 | Very low | 113 Ų | 113 | 93 Ų | 93 | 73% | 0.734 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.8 | 118 | 176.6 | 25.7 | -30.1 | 0 | 0 | 0 | 109.7 | ||
| 263 | G | 44.9 | Very low | 47.4 | Very low | 84 Ų | 84 | 94.7 Ų | 94.7 | 87% | 0.866 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 120.7 | -8.4 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | P261 | P261-G263 PolarHBondContact O-N 2.95Š|
| 264 | G | 48.1 | Very low | 48.8 | Very low | 38 Ų | 38 | 96.4 Ų | 96.4 | 39% | 0.392 | 58% | 0.578 | S | S | . | * | trans | 68.6 | 173.5 | -174.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | P261 | P261-G264 PolarHBondContact O-N 3.29Š| ||
| 265 | I | 50 | Low | 49.5 | Very low | 62 Ų | 62 | 96.1 Ų | 96.1 | 32% | 0.318 | 58% | 0.579 | S | S | . | * | trans | -93.2 | 122.9 | 176 | -56.5 | 173.9 | 0 | 0 | 0 | 107.1 | L260 G267 I268 F279 | L260-I265 HydrophobicContact CD2-CD1 4.33Å; I265-G267 PolarHBondContact O-N 2.93Å; I265-G267 VanDerWaalsContact O-N 3.13Å; I265-I268 HydrophobicContact CB-CD1 4.23Å; I265-I268 HydrophobicContact CD1-CD1 4.35Å; I265-I268 HydrophobicContact CG2-CD1 3.86Å; I265-I268 HydrophobicContact CG2-CG1 4.26Å; I265-I268 PolarHBondContact O-N 3.11Å; I265-F279 HydrophobicContact CD1-CD2 4.47Å; I265-F279 HydrophobicContact CD1-CE2 3.6Å; I265-F279 HydrophobicContact CD1-CZ 3.73Å | ||
| 266 | P | 39.7 | Very low | 50.6 | Low | 129 Ų | 129 | 92.2 Ų | 92.2 | 84% | 0.838 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.9 | 120.6 | 179.8 | -23.1 | 32 | 0 | 0 | 0 | 111 | ||
| 267 | G | 51.6 | Low | 51.5 | Low | 78 Ų | 78 | 90.1 Ų | 90.1 | 80% | 0.804 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 93.7 | 5.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 117 | I265 | I265-G267 PolarHBondContact O-N 2.93Å; I265-G267 VanDerWaalsContact O-N 3.13Å |
| 268 | I | 54.9 | Low | 52.5 | Low | 46 Ų | 46 | 92.1 Ų | 92.1 | 24% | 0.236 | 54% | 0.543 | C | S | . | . | trans | -116 | 114.7 | 174.7 | -54.2 | 179.9 | 0 | 0 | 0 | 109.9 | I265 L270 Q275 F279 | I265-I268 HydrophobicContact CB-CD1 4.23Å; I265-I268 HydrophobicContact CD1-CD1 4.35Å; I265-I268 HydrophobicContact CG2-CD1 3.86Å; I265-I268 HydrophobicContact CG2-CG1 4.26Å; I265-I268 PolarHBondContact O-N 3.11Å; I268-L270 HydrophobicContact CG2-CD2 4.45Å; I268-L270 PolarHBondContact O-N 3.34Å; I268-Q275 HydrophobicContact CG2-CB 4.36Å; I268-F279 HydrophobicContact CD1-CD2 3.89Å; I268-F279 HydrophobicContact CD1-CE2 4.34Å | ||
| 269 | D | 58.1 | Low | 53.2 | Low | 90 Ų | 90 | 87.3 Ų | 87.3 | 48% | 0.481 | 52% | 0.522 | S | S | . | . | trans | -83 | 106.7 | 172.8 | -176 | 1.5 | 0 | 0 | 0 | 110.2 | S271 D272 | D269-S271 PolarHBondContact O-N 3.47Å; D269-S271 WeakPolarHBondContact OD1-CB 3.45Å; D269-S271 PolarHBondContact OD1-N 2.93Å; D269-S271 PolarHBondContact OD1-OG 3.4Å; D269-D272 PolarHBondContact O-N 3.42Å | ||
| 270 | L | 55.4 | Low | 54.2 | Low | 78 Ų | 78 | 84 Ų | 84 | 41% | 0.408 | 52% | 0.523 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.5 | -7.9 | -179.9 | -64.4 | 169.6 | 0 | 0 | 0 | 113.4 | L260 I268 L276 | L260-L270 HydrophobicContact CD1-CD1 3.77Å; I268-L270 HydrophobicContact CG2-CD2 4.45Å; I268-L270 PolarHBondContact O-N 3.34Å; L270-L276 HydrophobicContact CD2-CD1 4.16Å |
| 271 | S | 57 | Low | 55.1 | Low | 103 Ų | 103 | 89.6 Ų | 89.6 | 72% | 0.72 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83 | -18.2 | 175 | -30.6 | 0 | 0 | 0 | 0 | 112 | D269 P273 | D269-S271 PolarHBondContact O-N 3.47Å; D269-S271 WeakPolarHBondContact OD1-CB 3.45Å; D269-S271 PolarHBondContact OD1-N 2.93Å; D269-S271 PolarHBondContact OD1-OG 3.4Å; S271-P273 WeakPolarHBondContact O-CD 3.48Å |
| 272 | D | 64.3 | Low | 56 | Low | 59 Ų | 59 | 93.1 Ų | 93.1 | 32% | 0.316 | 55% | 0.552 | S | S | . | * | trans | -89.2 | 111.4 | 176.2 | -175.2 | -10.7 | 0 | 0 | 0 | 110.3 | D269 K274 Q275 L276 | D269-D272 PolarHBondContact O-N 3.42Å; D272-K274 PolarHBondContact O-N 3.02Å; D272-K274 VanDerWaalsContact O-N 3.09Å; D272-K274 WeakPolarHBondContact OD1-CB 3.33Å; D272-K274 PolarHBondContact OD1-N 3.29Å; D272-Q275 HydrophobicContact CB-CB 4.1Å; D272-Q275 HydrophobicContact CB-CG 3.98Å; D272-Q275 PolarHBondContact O-N 2.93Å; D272-Q275 VanDerWaalsContact O-N 3.14Å; D272-L276 PolarHBondContact O-N 3.18Å | ||
| 273 | P | 66.4 | Low | 56.8 | Low | 102 Ų | 102 | 96.6 Ų | 96.6 | 66% | 0.662 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -62.4 | -18 | -180 | 23.1 | -31.5 | 0 | 0 | 0 | 113.6 | S271 A277 | S271-P273 WeakPolarHBondContact O-CD 3.48Å; P273-A277 WeakPolarHBondContact O-CB 3.36Å; P273-A277 PolarHBondContact O-N 3.42Å; P273-A277 VanDerWaalsContact O-N 3.07Å |
| 274 | K | 66.8 | Low | 56.9 | Low | 165 Ų | 165 | 98.2 Ų | 98.2 | 72% | 0.717 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -75.6 | -45.3 | 173.4 | -66.4 | 179.9 | 180 | 175.3 | 0 | 111.8 | D272 L276 A277 E278 | D272-K274 PolarHBondContact O-N 3.02Å; D272-K274 VanDerWaalsContact O-N 3.09Å; D272-K274 WeakPolarHBondContact OD1-CB 3.33Å; D272-K274 PolarHBondContact OD1-N 3.29Å; K274-L276 VanDerWaalsContact C-N 3.35Å; K274-A277 PolarHBondContact O-N 3.41Å; K274-E278 WeakPolarHBondContact O-CB 3.27Å; K274-E278 PolarHBondContact O-N 3.47Å |
| 275 | Q | 60.3 | Low | 56.6 | Low | 70 Ų | 70 | 107.6 Ų | 107.6 | 33% | 0.327 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.8 | -41.2 | 175.8 | -72 | -91 | -22.8 | 0 | 0 | 111.1 | I268 D272 E278 F279 | I268-Q275 HydrophobicContact CG2-CB 4.36Å; D272-Q275 HydrophobicContact CB-CB 4.1Å; D272-Q275 HydrophobicContact CB-CG 3.98Å; D272-Q275 PolarHBondContact O-N 2.93Å; D272-Q275 VanDerWaalsContact O-N 3.14Å; Q275-E278 PolarHBondContact O-N 3.19Å; Q275-F279 WeakPolarHBondContact O-CB 3.45Å; Q275-F279 PolarHBondContact O-N 3.39Å |
| 276 | L | 60.8 | Low | 56.1 | Low | 84 Ų | 84 | 114 Ų | 114 | 44% | 0.44 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -65.5 | -40.9 | 175.2 | -174.5 | 62.9 | 0 | 0 | 0 | 112.3 | L270 D272 K274 E278 A280 | L270-L276 HydrophobicContact CD2-CD1 4.16Å; D272-L276 PolarHBondContact O-N 3.18Å; K274-L276 VanDerWaalsContact C-N 3.35Å; L276-E278 VanDerWaalsContact C-N 3.34Å; L276-A280 VanDerWaalsContact O-CB 3.28Å; L276-A280 WeakPolarHBondContact O-CB 3.38Å; L276-A280 PolarHBondContact O-N 3.01Å |
| 277 | A | 66.4 | Low | 56.2 | Low | 43 Ų | 43 | 113.8 Ų | 113.8 | 36% | 0.355 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -68.8 | -31.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | P273 K274 R281 | P273-A277 WeakPolarHBondContact O-CB 3.36Å; P273-A277 PolarHBondContact O-N 3.42Å; P273-A277 VanDerWaalsContact O-N 3.07Å; K274-A277 PolarHBondContact O-N 3.41Å; A277-R281 WeakPolarHBondContact O-CB 3.43Å; A277-R281 WeakPolarHBondContact O-CD 3.27Å; A277-R281 WeakPolarHBondContact O-CG 3.39Å; A277-R281 PolarHBondContact O-N 3.03Å; A277-R281 VanDerWaalsContact O-N 3.08Å |
| 278 | E | 63 | Low | 55.9 | Low | 114 Ų | 114 | 116.9 Ų | 116.9 | 53% | 0.533 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -70.6 | -44.4 | 174.9 | -168.4 | 173.5 | 175.8 | 0 | 0 | 111.4 | K274 Q275 L276 R281 M282 | K274-E278 WeakPolarHBondContact O-CB 3.27Å; K274-E278 PolarHBondContact O-N 3.47Å; Q275-E278 PolarHBondContact O-N 3.19Å; L276-E278 VanDerWaalsContact C-N 3.34Å; E278-R281 CarbonylContact O-C 3.53Å; E278-R281 WeakPolarHBondContact O-CB 3.42Å; E278-R281 PolarHBondContact O-N 3.46Å; E278-R281 VanDerWaalsContact O-N 3.1Å; E278-M282 PolarHBondContact O-N 3.42Å |
| 279 | F | 57.5 | Low | 55.6 | Low | 83 Ų | 83 | 124 Ų | 124 | 36% | 0.364 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -61.4 | -43.6 | 172.3 | -173.7 | -99.4 | 0 | 0 | 0 | 111.9 | I265 I268 Q275 R281 M282 | I265-F279 HydrophobicContact CD1-CD2 4.47Å; I265-F279 HydrophobicContact CD1-CE2 3.6Å; I265-F279 HydrophobicContact CD1-CZ 3.73Å; I268-F279 HydrophobicContact CD1-CD2 3.89Å; I268-F279 HydrophobicContact CD1-CE2 4.34Å; Q275-F279 WeakPolarHBondContact O-CB 3.45Å; Q275-F279 PolarHBondContact O-N 3.39Å; F279-R281 PolarHBondContact O-N 3.42Å; F279-M282 WeakPolarHBondContact O-CB 3.36Å; F279-M282 PolarHBondContact O-N 3.48Å; F279-M282 VanDerWaalsContact O-N 3.11Å |
| 280 | A | 59.6 | Low | 55.1 | Low | 82 Ų | 82 | 126.2 Ų | 126.2 | 68% | 0.678 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -65.8 | -20.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | L276 | L276-A280 VanDerWaalsContact O-CB 3.28Å; L276-A280 WeakPolarHBondContact O-CB 3.38Å; L276-A280 PolarHBondContact O-N 3.01Å |
| 281 | R | 62 | Low | 54.9 | Low | 211 Ų | 211 | 127.5 Ų | 127.5 | 80% | 0.796 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -90.5 | -14.5 | 174.5 | -76 | 170.8 | 174.8 | -165 | -0.9 | 113.2 | A277 E278 F279 K283 | A277-R281 WeakPolarHBondContact O-CB 3.43Å; A277-R281 WeakPolarHBondContact O-CD 3.27Å; A277-R281 WeakPolarHBondContact O-CG 3.39Å; A277-R281 PolarHBondContact O-N 3.03Å; A277-R281 VanDerWaalsContact O-N 3.08Å; E278-R281 CarbonylContact O-C 3.53Å; E278-R281 WeakPolarHBondContact O-CB 3.42Å; E278-R281 PolarHBondContact O-N 3.46Å; E278-R281 VanDerWaalsContact O-N 3.1Å; F279-R281 PolarHBondContact O-N 3.42Å; R281-K283 PolarHBondContact O-N 3.31Å |
| 282 | M | 56.1 | Low | 54.7 | Low | 122 Ų | 122 | 125.7 Ų | 125.7 | 60% | 0.601 | 62% | 0.624 | S | S | * | * | S | Bend | trans | -66.1 | 104 | 169.2 | -70.6 | -166.5 | -174 | 0 | 0 | 108.2 | E278 F279 | E278-M282 PolarHBondContact O-N 3.42Å; F279-M282 WeakPolarHBondContact O-CB 3.36Å; F279-M282 PolarHBondContact O-N 3.48Å; F279-M282 VanDerWaalsContact O-N 3.11Å |
| 283 | K | 49.3 | Very low | 54.4 | Low | 186 Ų | 186 | 127.9 Ų | 127.9 | 81% | 0.809 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 136.3 | 168.3 | -66.8 | 179.6 | -178.3 | 178.2 | 0 | 107.2 | R281 R285 | R281-K283 PolarHBondContact O-N 3.31Å; K283-R285 PolarHBondContact O-N 3.25Å; K283-R285 VanDerWaalsContact O-N 3.08Å |
| 284 | P | 47.5 | Very low | 54.3 | Low | 117 Ų | 117 | 134.1 Ų | 134.1 | 76% | 0.76 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 126.5 | 170.1 | 21.3 | -30.9 | 0 | 0 | 0 | 107 | K286 | P284-K286 PolarHBondContact O-N 2.92Š|
| 285 | R | 41 | Very low | 55.1 | Low | 235 Ų | 235 | 129.3 Ų | 129.3 | 89% | 0.887 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 119.4 | 170.7 | -85.4 | -174.4 | 170.7 | -138.7 | 1.2 | 105.3 | K283 I287 | K283-R285 PolarHBondContact O-N 3.25Å; K283-R285 VanDerWaalsContact O-N 3.08Å; R285-I287 PolarHBondContact O-N 3.22Å |
| 286 | K | 41 | Very low | 56.4 | Low | 197 Ų | 197 | 128.7 Ų | 128.7 | 86% | 0.857 | 63% | 0.634 | S | S | * | * | trans | -61.1 | 99 | 165.4 | -70.7 | -174.7 | 178.3 | -172.3 | 0 | 104.8 | P284 K288 | P284-K286 PolarHBondContact O-N 2.92Å; K286-K288 PolarHBondContact O-N 3.25Å | ||
| 287 | I | 41 | Very low | 57.9 | Low | 124 Ų | 124 | 127.7 Ų | 127.7 | 64% | 0.636 | 64% | 0.639 | S | S | * | * | trans | -54.7 | 112 | 161.7 | -59.2 | 178.3 | 0 | 0 | 0 | 102.7 | R285 D291 | R285-I287 PolarHBondContact O-N 3.22Å; I287-D291 HydrophobicContact CG2-CB 3.58Å | ||
| 288 | K | 45.7 | Very low | 59.2 | Low | 144 Ų | 144 | 126.2 Ų | 126.2 | 63% | 0.626 | 63% | 0.625 | S | S | * | * | trans | -61.8 | 144.1 | 172.9 | -66.6 | 176.7 | -177.8 | 175.4 | 0 | 104.8 | K286 D290 D291 | K286-K288 PolarHBondContact O-N 3.25Å; K288-D290 HydrophobicContact CB-CB 4.34Å; K288-D290 PolarHBondContact O-N 3.18Å; K288-D291 PolarHBondContact N-OD2 2.92Å; K288-D291 PolarHBondContact O-N 3.48Å | ||
| 289 | E | 48.1 | Very low | 60.5 | Low | 194 Ų | 194 | 125.2 Ų | 125.2 | 91% | 0.907 | 63% | 0.629 | S | S | * | * | G | 310 helix | trans | -54 | -15.7 | 177.7 | -69.5 | 174.5 | 156.6 | 0 | 0 | 112.2 | D291 | E289-D291 PolarHBondContact O-N 3.48Š|
| 290 | D | 48.8 | Very low | 62.1 | Low | 137 Ų | 137 | 125.1 Ų | 125.1 | 73% | 0.733 | 63% | 0.63 | S | S | * | * | G | 310 helix | trans | -73.9 | -11.1 | 173.4 | -49.3 | -48.6 | 0 | 0 | 0 | 115.9 | K288 | K288-D290 HydrophobicContact CB-CB 4.34Å; K288-D290 PolarHBondContact O-N 3.18Å |
| 291 | D | 49.4 | Very low | 63.6 | Low | 106 Ų | 106 | 130.7 Ų | 130.7 | 57% | 0.567 | 64% | 0.638 | S | S | * | * | G | 310 helix | trans | -99.1 | 3.2 | -177.5 | -66.6 | -42.5 | 0 | 0 | 0 | 113.1 | I287 K288 E289 | I287-D291 HydrophobicContact CG2-CB 3.58Å; K288-D291 PolarHBondContact N-OD2 2.92Å; K288-D291 PolarHBondContact O-N 3.48Å; E289-D291 PolarHBondContact O-N 3.48Å |
| 292 | A | 53.9 | Low | 65 | Low | 64 Ų | 64 | 124.4 Ų | 124.4 | 53% | 0.529 | 64% | 0.639 | S | S | . | * | S | Bend | trans | -60.8 | 130.4 | 171 | 0 | 0 | 0 | 0 | 0 | 108.8 | R294 | A292-R294 PolarHBondContact O-N 3.45Š|
| 293 | P | 57.3 | Low | 66.8 | Low | 106 Ų | 106 | 119.7 Ų | 119.7 | 69% | 0.688 | 62% | 0.618 | S | S | * | * | trans | -57.7 | 115.9 | 178.3 | 21.9 | -30.1 | 0 | 0 | 0 | 107.5 | T295 | P293-T295 VanDerWaalsContact C-N 3.25Å; P293-T295 HydrophobicContact CB-CG2 4.48Å; P293-T295 WeakPolarHBondContact O-CG2 3.29Å; P293-T295 PolarHBondContact O-N 3.23Å; P293-T295 PolarHBondContact O-OG1 3.45Å | ||
| 294 | R | 65.7 | Low | 68.9 | Low | 232 Ų | 232 | 117.3 Ų | 117.3 | 88% | 0.875 | 62% | 0.619 | S | S | * | * | trans | -58.9 | 96.2 | 174.8 | -72.3 | -177.4 | 179.1 | 175.7 | -0.5 | 107 | A292 | A292-R294 PolarHBondContact O-N 3.45Š| ||
| 295 | T | 83.3 | Confident | 71 | Confident | 64 Ų | 64 | 117.3 Ų | 117.3 | 39% | 0.393 | 61% | 0.607 | S | S | . | * | P | Polyproline II helix | trans | -97.1 | 138.9 | -177.7 | 35.6 | 0 | 0 | 0 | 0 | 107.6 | P293 M306 F307 | P293-T295 VanDerWaalsContact C-N 3.25Å; P293-T295 HydrophobicContact CB-CG2 4.48Å; P293-T295 WeakPolarHBondContact O-CG2 3.29Å; P293-T295 PolarHBondContact O-N 3.23Å; P293-T295 PolarHBondContact O-OG1 3.45Å; T295-M306 VanDerWaalsContact CB-CE 3.48Å; T295-M306 HydrophobicContact CG2-CE 4.32Å; T295-M306 WeakPolarHBondContact OG1-CE 3.41Å; T295-F307 CarbonylContact C-O 3.46Å; T295-F307 WeakPolarHBondContact CA-O 3.41Å |
| 296 | I | 88 | Confident | 73.5 | Confident | 57 Ų | 57 | 111.7 Ų | 111.7 | 29% | 0.292 | 59% | 0.592 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -100.5 | 118.6 | -174.3 | -62.3 | 160.7 | 0 | 0 | 0 | 107.2 | M306 F307 D309 N310 M313 | I296-M306 CarbonylContact O-C 3.25Å; I296-M306 WeakPolarHBondContact O-CA 3.37Å; I296-F307 PolarHBondContact N-O 3.47Å; I296-F307 WeakPolarHBondContact O-CD2 3.44Å; I296-F307 PolarHBondContact O-N 3.2Å; I296-D309 VanDerWaalsContact CD1-C 3.45Å; I296-N310 HydrophobicContact CD1-CB 3.82Å; I296-N310 VanDerWaalsContact CD1-N 3.25Å; I296-M313 HydrophobicContact CG2-CB 4.13Å; I296-M313 HydrophobicContact CG2-CE 4.23Å; I296-M313 HydrophobicContact CG2-CG 3.95Å |
| 297 | A | 91.4 | Very high | 75.8 | Confident | 64 Ų | 64 | 103.9 Ų | 103.9 | 53% | 0.529 | 56% | 0.559 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -74.3 | 149.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111 | P299 M306 | A297-P299 WeakPolarHBondContact O-CD 3.37Å; A297-M306 HydrophobicContact CB-CG 4.48Å |
| 298 | C | 93.6 | Very high | 78.1 | Confident | 11 Ų | 11 | 108.4 Ų | 108.4 | 7% | 0.074 | 57% | 0.568 | C | S | . | * | P | Polyproline II helix | trans | -65 | 129.6 | 171 | -172.9 | 0 | 0 | 0 | 0 | 110.4 | H300 C303 K305 F307 | C298-H300 PolarHBondContact O-N 3.08Å; C298-H300 PolarHBondContact SG-N 3.28Å; C298-C303 HydrophobicContact CB-CB 3.91Å; C298-K305 PolarHBondContact N-O 2.58Å; C298-F307 HydrophobicContact CB-CE2 4.25Å |
| 299 | P | 90 | Very high | 80.1 | Confident | 94 Ų | 94 | 105.2 Ų | 105.2 | 61% | 0.61 | 56% | 0.557 | S | S | * | * | trans | -68.9 | -16.3 | 175 | -21.4 | 33 | 0 | 0 | 0 | 114.3 | A297 K301 M313 | A297-P299 WeakPolarHBondContact O-CD 3.37Å; P299-K301 PolarHBondContact O-N 3.5Å; P299-M313 WeakPolarHBondContact CD-SD 3.25Å; P299-M313 HydrophobicContact CG-CE 4.5Å; P299-M313 HydrophobicContact CG-SD 4.01Å | ||
| 300 | H | 91.6 | Very high | 81.9 | Confident | 81 Ų | 81 | 99.3 Ų | 99.3 | 38% | 0.375 | 53% | 0.532 | S | S | . | . | S | Bend | trans | -66.8 | 127.8 | -175.8 | -173.9 | 80.3 | 0 | 0 | 0 | 111.2 | C298 G302 C303 L317 H320 | C298-H300 PolarHBondContact O-N 3.08Å; C298-H300 PolarHBondContact SG-N 3.28Å; H300-G302 PolarHBondContact O-N 2.99Å; H300-C303 HydrophobicContact CB-CB 3.99Å; H300-C303 WeakPolarHBondContact O-CB 3.34Å; H300-C303 PolarHBondContact O-N 3.33Å; H300-L317 HydrophobicContact CB-CD1 4.23Å; H300-H320 HydrophobicContact CB-CB 4.27Å; H300-H320 VanDerWaalsContact CB-CD2 3.48Å; H300-H320 WeakPolarHBondContact CB-CD2 3.49Å; H300-H320 AromaticContact CD2-CE1 3.74Å; H300-H320 AromaticContact CD2-CG 3.66Å; H300-H320 AromaticContact CD2-ND1 3.42Å; H300-H320 PolarHBondContact CD2-ND1 3.2Å; H300-H320 AromaticContact CG-CD2 3.71Å; H300-H320 AromaticContact CG-CG 3.45Å; H300-H320 VanDerWaalsContact CG-CG 3.45Å; H300-H320 AromaticContact CG-ND1 3.73Å; H300-H320 WeakPolarHBondContact ND1-CB 3.42Å; H300-H320 AromaticContact ND1-CG 3.77Å; H300-H320 AromaticContact NE2-ND1 3.77Å |
| 301 | K | 91.8 | Very high | 83.8 | Confident | 198 Ų | 198 | 96.1 Ų | 96.1 | 86% | 0.861 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.3 | 122.2 | -178.5 | -174.5 | -177.1 | 177.3 | -174.3 | 0 | 110.3 | P299 C303 | P299-K301 PolarHBondContact O-N 3.5Å; K301-C303 VanDerWaalsContact C-N 3.33Å |
| 302 | G | 90.9 | Very high | 85.8 | Confident | 79 Ų | 79 | 92.8 Ų | 92.8 | 81% | 0.814 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 87.2 | -3.2 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | H300 | H300-G302 PolarHBondContact O-N 2.99Š|
| 303 | C | 93.2 | Very high | 87.6 | Confident | 24 Ų | 24 | 90.4 Ų | 90.4 | 16% | 0.162 | 49% | 0.486 | C | S | . | . | trans | -87.7 | 122.1 | 170.1 | -169.3 | 0 | 0 | 0 | 0 | 110.8 | C298 H300 K301 H316 H320 | C298-C303 HydrophobicContact CB-CB 3.91Å; H300-C303 HydrophobicContact CB-CB 3.99Å; H300-C303 WeakPolarHBondContact O-CB 3.34Å; H300-C303 PolarHBondContact O-N 3.33Å; K301-C303 VanDerWaalsContact C-N 3.33Å; C303-H316 PolarHBondContact SG-NE2 3.41Å; C303-H320 PolarHBondContact SG-NE2 3.39Å; C303-H320 VanDerWaalsContact SG-NE2 3.4Å | ||
| 304 | T | 93 | Very high | 89.1 | Confident | 135 Ų | 135 | 93 Ų | 93 | 83% | 0.828 | 48% | 0.482 | S | S | * | . | trans | -96.9 | 7.6 | 178.8 | 57 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 305 | K | 92.7 | Very high | 90.2 | Very high | 118 Ų | 118 | 89.4 Ų | 89.4 | 51% | 0.513 | 47% | 0.473 | S | S | . | . | trans | -72.3 | 141.9 | -176 | -64.4 | -161.3 | -174.4 | -165.9 | 0 | 111.7 | C298 F307 | C298-K305 PolarHBondContact N-O 2.58Å; K305-F307 HydrophobicContact CB-CE2 3.7Å; K305-F307 HydrophobicContact CB-CZ 3.7Å; K305-F307 HydrophobicContact CD-CZ 4.22Å | ||
| 306 | M | 92.9 | Very high | 90.6 | Very high | 116 Ų | 116 | 87.2 Ų | 87.2 | 57% | 0.571 | 46% | 0.458 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -124.6 | 146 | 178.1 | -65.4 | 174.7 | 53.5 | 0 | 0 | 110.1 | T295 I296 A297 | T295-M306 VanDerWaalsContact CB-CE 3.48Å; T295-M306 HydrophobicContact CG2-CE 4.32Å; T295-M306 WeakPolarHBondContact OG1-CE 3.41Å; I296-M306 CarbonylContact O-C 3.25Å; I296-M306 WeakPolarHBondContact O-CA 3.37Å; A297-M306 HydrophobicContact CB-CG 4.48Å |
| 307 | F | 90.4 | Very high | 90.6 | Very high | 34 Ų | 34 | 87.7 Ų | 87.7 | 15% | 0.149 | 46% | 0.461 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.1 | 152.8 | -171.6 | -61 | -85.3 | 0 | 0 | 0 | 111.1 | T295 I296 C298 K305 D309 A312 M313 H316 | T295-F307 CarbonylContact C-O 3.46Å; T295-F307 WeakPolarHBondContact CA-O 3.41Å; I296-F307 PolarHBondContact N-O 3.47Å; I296-F307 WeakPolarHBondContact O-CD2 3.44Å; I296-F307 PolarHBondContact O-N 3.2Å; C298-F307 HydrophobicContact CB-CE2 4.25Å; K305-F307 HydrophobicContact CB-CE2 3.7Å; K305-F307 HydrophobicContact CB-CZ 3.7Å; K305-F307 HydrophobicContact CD-CZ 4.22Å; F307-D309 VanDerWaalsContact C-N 3.34Å; F307-D309 WeakPolarHBondContact CB-O 3.4Å; F307-A312 HydrophobicContact CB-CB 4.3Å; F307-A312 HydrophobicContact CD1-CB 3.93Å; F307-A312 HydrophobicContact CG-CB 4.48Å; F307-M313 HydrophobicContact CB-CB 3.87Å; F307-M313 HydrophobicContact CD2-CB 3.57Å; F307-M313 HydrophobicContact CD2-CG 3.69Å; F307-M313 HydrophobicContact CE2-CB 4.39Å; F307-M313 HydrophobicContact CE2-CG 4.24Å; F307-M313 HydrophobicContact CG-CB 3.73Å; F307-M313 HydrophobicContact CG-CG 4.37Å; F307-H316 HydrophobicContact CD1-CB 4.48Å; F307-H316 HydrophobicContact CE1-CB 3.52Å; F307-H316 AromaticContact CE1-CG 3.91Å; F307-H316 HydrophobicContact CE2-CB 4Å; F307-H316 AromaticContact CE2-CD2 3.41Å; F307-H316 VanDerWaalsContact CE2-CD2 3.41Å; F307-H316 WeakPolarHBondContact CE2-CD2 3.44Å; F307-H316 AromaticContact CE2-CG 3.87Å; F307-H316 HydrophobicContact CZ-CB 3.26Å; F307-H316 AromaticContact CZ-CD2 3.17Å; F307-H316 WeakPolarHBondContact CZ-CD2 3.44Å; F307-H316 AromaticContact CZ-CG 3.17Å |
| 308 | R | 88.9 | Confident | 90.3 | Very high | 218 Ų | 218 | 89.1 Ų | 89.1 | 82% | 0.823 | 46% | 0.456 | S | S | * | . | S | Bend | trans | -73.4 | -30.5 | 177.5 | -63.8 | -178.6 | -178.2 | 130.2 | -0.9 | 112.2 | ||
| 309 | D | 87.4 | Confident | 90.1 | Very high | 77 Ų | 77 | 91.7 Ų | 91.7 | 41% | 0.412 | 47% | 0.472 | S | S | . | . | S | Bend | trans | -144.1 | 167.1 | -178.1 | 65 | 65.1 | 0 | 0 | 0 | 111.6 | I296 F307 S311 A312 M313 | I296-D309 VanDerWaalsContact CD1-C 3.45Å; F307-D309 VanDerWaalsContact C-N 3.34Å; F307-D309 WeakPolarHBondContact CB-O 3.4Å; D309-S311 VanDerWaalsContact C-N 3.33Å; D309-S311 WeakPolarHBondContact OD1-CA 3.4Å; D309-S311 VanDerWaalsContact OD1-CB 3.31Å; D309-S311 WeakPolarHBondContact OD1-CB 3.27Å; D309-S311 PolarHBondContact OD1-N 2.94Å; D309-A312 WeakPolarHBondContact OD1-CB 3.42Å; D309-A312 PolarHBondContact OD1-N 3.22Å; D309-M313 PolarHBondContact O-N 3.44Å |
| 310 | N | 86.8 | Confident | 90.1 | Very high | 71 Ų | 71 | 90.2 Ų | 90.2 | 38% | 0.38 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -73.1 | -27.9 | -175.9 | -160.7 | -16.2 | 0 | 0 | 0 | 111.5 | I296 M313 R314 | I296-N310 HydrophobicContact CD1-CB 3.82Å; I296-N310 VanDerWaalsContact CD1-N 3.25Å; N310-M313 PolarHBondContact O-N 3.07Å; N310-M313 WeakPolarHBondContact OD1-CE 3.36Å; N310-R314 WeakPolarHBondContact O-CB 3.26Å; N310-R314 WeakPolarHBondContact O-CG 3.38Å; N310-R314 PolarHBondContact O-N 2.88Å |
| 311 | S | 88.8 | Confident | 89.9 | Confident | 69 Ų | 69 | 87.6 Ų | 87.6 | 48% | 0.483 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -65.8 | -48.6 | 178.2 | -174.5 | 0 | 0 | 0 | 0 | 110.7 | D309 M313 R314 K315 | D309-S311 VanDerWaalsContact C-N 3.33Å; D309-S311 WeakPolarHBondContact OD1-CA 3.4Å; D309-S311 VanDerWaalsContact OD1-CB 3.31Å; D309-S311 WeakPolarHBondContact OD1-CB 3.27Å; D309-S311 PolarHBondContact OD1-N 2.94Å; S311-M313 VanDerWaalsContact C-N 3.32Å; S311-M313 PolarHBondContact O-N 2.83Å; S311-R314 PolarHBondContact O-N 3.21Å; S311-K315 WeakPolarHBondContact O-CG 3.49Å; S311-K315 PolarHBondContact O-N 3.13Å |
| 312 | A | 90.4 | Very high | 89.7 | Confident | 36 Ų | 36 | 83 Ų | 83 | 30% | 0.298 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -61.7 | -40 | 175 | 0 | 0 | 0 | 0 | 0 | 111.7 | F307 D309 H316 | F307-A312 HydrophobicContact CB-CB 4.3Å; F307-A312 HydrophobicContact CD1-CB 3.93Å; F307-A312 HydrophobicContact CG-CB 4.48Å; D309-A312 WeakPolarHBondContact OD1-CB 3.42Å; D309-A312 PolarHBondContact OD1-N 3.22Å; A312-H316 WeakPolarHBondContact O-CB 3.45Å; A312-H316 PolarHBondContact O-N 3.18Å |
| 313 | M | 92.4 | Very high | 89.8 | Confident | 15 Ų | 15 | 86.1 Ų | 86.1 | 7% | 0.074 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -64.5 | -45.4 | 174.6 | -176 | -78.7 | -59.2 | 0 | 0 | 111.9 | I296 P299 F307 D309 N310 S311 H316 L317 | I296-M313 HydrophobicContact CG2-CB 4.13Å; I296-M313 HydrophobicContact CG2-CE 4.23Å; I296-M313 HydrophobicContact CG2-CG 3.95Å; P299-M313 WeakPolarHBondContact CD-SD 3.25Å; P299-M313 HydrophobicContact CG-CE 4.5Å; P299-M313 HydrophobicContact CG-SD 4.01Å; F307-M313 HydrophobicContact CB-CB 3.87Å; F307-M313 HydrophobicContact CD2-CB 3.57Å; F307-M313 HydrophobicContact CD2-CG 3.69Å; F307-M313 HydrophobicContact CE2-CB 4.39Å; F307-M313 HydrophobicContact CE2-CG 4.24Å; F307-M313 HydrophobicContact CG-CB 3.73Å; F307-M313 HydrophobicContact CG-CG 4.37Å; D309-M313 PolarHBondContact O-N 3.44Å; N310-M313 PolarHBondContact O-N 3.07Å; N310-M313 WeakPolarHBondContact OD1-CE 3.36Å; S311-M313 VanDerWaalsContact C-N 3.32Å; S311-M313 PolarHBondContact O-N 2.83Å; M313-H316 CarbonylContact O-C 3.6Å; M313-H316 WeakPolarHBondContact O-CB 3.46Å; M313-H316 PolarHBondContact O-N 2.79Å; M313-H316 VanDerWaalsContact O-N 3.17Å; M313-L317 PolarHBondContact O-N 3.17Å; M313-L317 HydrophobicContact SD-CB 4.5Å |
| 314 | R | 88.4 | Confident | 89.7 | Confident | 160 Ų | 160 | 89.4 Ų | 89.4 | 60% | 0.604 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -62.3 | -44.5 | 177.2 | -80.6 | -177.9 | 179.1 | 157.1 | -1.9 | 112.1 | N310 S311 H316 L317 H318 | N310-R314 WeakPolarHBondContact O-CB 3.26Å; N310-R314 WeakPolarHBondContact O-CG 3.38Å; N310-R314 PolarHBondContact O-N 2.88Å; S311-R314 PolarHBondContact O-N 3.21Å; R314-H316 VanDerWaalsContact C-N 3.26Å; R314-H316 PolarHBondContact O-N 2.88Å; R314-L317 WeakPolarHBondContact O-CB 3.34Å; R314-L317 PolarHBondContact O-N 3.04Å; R314-L317 VanDerWaalsContact O-N 3.08Å; R314-H318 PolarHBondContact O-N 3.36Å |
| 315 | K | 88.1 | Confident | 89.8 | Confident | 156 Ų | 156 | 85.8 Ų | 85.8 | 68% | 0.678 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -58.2 | -41.5 | 173.3 | -72.2 | -178.6 | -178.3 | -170.3 | 0 | 111 | S311 H318 | S311-K315 WeakPolarHBondContact O-CG 3.49Å; S311-K315 PolarHBondContact O-N 3.13Å; K315-H318 WeakPolarHBondContact O-CB 3.36Å; K315-H318 PolarHBondContact O-N 3.24Å |
| 316 | H | 91 | Very high | 90 | Very high | 18 Ų | 18 | 84 Ų | 84 | 8% | 0.083 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -66.3 | -38.4 | 173.9 | 171.2 | 56 | 0 | 0 | 0 | 113.1 | C303 F307 A312 M313 R314 H318 T319 H320 | C303-H316 PolarHBondContact SG-NE2 3.41Å; F307-H316 HydrophobicContact CD1-CB 4.48Å; F307-H316 HydrophobicContact CE1-CB 3.52Å; F307-H316 AromaticContact CE1-CG 3.91Å; F307-H316 HydrophobicContact CE2-CB 4Å; F307-H316 AromaticContact CE2-CD2 3.41Å; F307-H316 VanDerWaalsContact CE2-CD2 3.41Å; F307-H316 WeakPolarHBondContact CE2-CD2 3.44Å; F307-H316 AromaticContact CE2-CG 3.87Å; F307-H316 HydrophobicContact CZ-CB 3.26Å; F307-H316 AromaticContact CZ-CD2 3.17Å; F307-H316 WeakPolarHBondContact CZ-CD2 3.44Å; F307-H316 AromaticContact CZ-CG 3.17Å; A312-H316 WeakPolarHBondContact O-CB 3.45Å; A312-H316 PolarHBondContact O-N 3.18Å; M313-H316 CarbonylContact O-C 3.6Å; M313-H316 WeakPolarHBondContact O-CB 3.46Å; M313-H316 PolarHBondContact O-N 2.79Å; M313-H316 VanDerWaalsContact O-N 3.17Å; R314-H316 VanDerWaalsContact C-N 3.26Å; R314-H316 PolarHBondContact O-N 2.88Å; H316-H318 PolarHBondContact O-N 3.43Å; H316-H318 VanDerWaalsContact O-N 3.15Å; H316-T319 PolarHBondContact CE1-OG1 3.3Å; H316-T319 PolarHBondContact ND1-OG1 3.25Å; H316-T319 VanDerWaalsContact ND1-OG1 3.11Å; H316-T319 VanDerWaalsContact O-CB 3.32Å; H316-T319 WeakPolarHBondContact O-CB 3.46Å; H316-T319 WeakPolarHBondContact O-CG2 3.46Å; H316-T319 PolarHBondContact O-N 3.47Å; H316-T319 PolarHBondContact O-OG1 3.46Å; H316-H320 AromaticContact CD2-NE2 3.88Å; H316-H320 AromaticContact CE1-CE1 3.94Å; H316-H320 AromaticContact CE1-NE2 3.28Å; H316-H320 PolarHBondContact CE1-NE2 3.27Å; H316-H320 VanDerWaalsContact CE1-NE2 3.28Å; H316-H320 AromaticContact NE2-CD2 3.73Å; H316-H320 AromaticContact NE2-CE1 3.89Å; H316-H320 AromaticContact NE2-NE2 2.93Å; H316-H320 PolarHBondContact NE2-NE2 3.35Å |
| 317 | L | 88.8 | Confident | 90.2 | Very high | 68 Ų | 68 | 78.6 Ų | 78.6 | 36% | 0.356 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -57.8 | -31.9 | -179.1 | -173 | 61.9 | 0 | 0 | 0 | 111.7 | H300 M313 R314 T319 H320 G321 | H300-L317 HydrophobicContact CB-CD1 4.23Å; M313-L317 PolarHBondContact O-N 3.17Å; M313-L317 HydrophobicContact SD-CB 4.5Å; R314-L317 WeakPolarHBondContact O-CB 3.34Å; R314-L317 PolarHBondContact O-N 3.04Å; R314-L317 VanDerWaalsContact O-N 3.08Å; L317-T319 PolarHBondContact O-N 3.43Å; L317-H320 PolarHBondContact O-N 3.18Å; L317-G321 PolarHBondContact O-N 3.14Å |
| 318 | H | 85.5 | Confident | 90.4 | Very high | 93 Ų | 93 | 82 Ų | 82 | 43% | 0.431 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -54.4 | -35.6 | 172.9 | -170.8 | 61.8 | 0 | 0 | 0 | 112.2 | R314 K315 H316 H320 G321 V335 | R314-H318 PolarHBondContact O-N 3.36Å; K315-H318 WeakPolarHBondContact O-CB 3.36Å; K315-H318 PolarHBondContact O-N 3.24Å; H316-H318 PolarHBondContact O-N 3.43Å; H316-H318 VanDerWaalsContact O-N 3.15Å; H318-H320 PolarHBondContact O-N 3.16Å; H318-H320 VanDerWaalsContact O-N 3.11Å; H318-G321 WeakPolarHBondContact O-CA 3.41Å; H318-G321 PolarHBondContact O-N 3.14Å; H318-V335 PolarHBondContact NE2-O 2.99Å; H318-V335 WeakPolarHBondContact O-CG1 3.43Å |
| 319 | T | 90.1 | Very high | 90.7 | Very high | 66 Ų | 66 | 77.5 Ų | 77.5 | 41% | 0.405 | 42% | 0.417 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.1 | -18.6 | 177.6 | 70 | 0 | 0 | 0 | 0 | 114.6 | H316 L317 | H316-T319 PolarHBondContact CE1-OG1 3.3Å; H316-T319 PolarHBondContact ND1-OG1 3.25Å; H316-T319 VanDerWaalsContact ND1-OG1 3.11Å; H316-T319 VanDerWaalsContact O-CB 3.32Å; H316-T319 WeakPolarHBondContact O-CB 3.46Å; H316-T319 WeakPolarHBondContact O-CG2 3.46Å; H316-T319 PolarHBondContact O-N 3.47Å; H316-T319 PolarHBondContact O-OG1 3.46Å; L317-T319 PolarHBondContact O-N 3.43Å |
| 320 | H | 89.3 | Confident | 91.1 | Very high | 63 Ų | 63 | 76.5 Ų | 76.5 | 29% | 0.292 | 42% | 0.415 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.1 | -1.4 | 172.3 | -57 | -64.5 | 0 | 0 | 0 | 113 | H300 C303 H316 L317 H318 | H300-H320 HydrophobicContact CB-CB 4.27Å; H300-H320 VanDerWaalsContact CB-CD2 3.48Å; H300-H320 WeakPolarHBondContact CB-CD2 3.49Å; H300-H320 AromaticContact CD2-CE1 3.74Å; H300-H320 AromaticContact CD2-CG 3.66Å; H300-H320 AromaticContact CD2-ND1 3.42Å; H300-H320 PolarHBondContact CD2-ND1 3.2Å; H300-H320 AromaticContact CG-CD2 3.71Å; H300-H320 AromaticContact CG-CG 3.45Å; H300-H320 VanDerWaalsContact CG-CG 3.45Å; H300-H320 AromaticContact CG-ND1 3.73Å; H300-H320 WeakPolarHBondContact ND1-CB 3.42Å; H300-H320 AromaticContact ND1-CG 3.77Å; H300-H320 AromaticContact NE2-ND1 3.77Å; C303-H320 PolarHBondContact SG-NE2 3.39Å; C303-H320 VanDerWaalsContact SG-NE2 3.4Å; H316-H320 AromaticContact CD2-NE2 3.88Å; H316-H320 AromaticContact CE1-CE1 3.94Å; H316-H320 AromaticContact CE1-NE2 3.28Å; H316-H320 PolarHBondContact CE1-NE2 3.27Å; H316-H320 VanDerWaalsContact CE1-NE2 3.28Å; H316-H320 AromaticContact NE2-CD2 3.73Å; H316-H320 AromaticContact NE2-CE1 3.89Å; H316-H320 AromaticContact NE2-NE2 2.93Å; H316-H320 PolarHBondContact NE2-NE2 3.35Å; L317-H320 PolarHBondContact O-N 3.18Å; H318-H320 PolarHBondContact O-N 3.16Å; H318-H320 VanDerWaalsContact O-N 3.11Å |
| 321 | G | 86.9 | Confident | 91.4 | Very high | 25 Ų | 25 | 75.5 Ų | 75.5 | 26% | 0.258 | 42% | 0.422 | S | S | . | . | S | Bend | trans | -69 | 170.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | L317 H318 | L317-G321 PolarHBondContact O-N 3.14Å; H318-G321 WeakPolarHBondContact O-CA 3.41Å; H318-G321 PolarHBondContact O-N 3.14Å |
| 322 | P | 88.3 | Confident | 91.8 | Very high | 102 Ų | 102 | 77.2 Ų | 77.2 | 66% | 0.662 | 42% | 0.421 | S | S | * | . | trans | -61.7 | 140.7 | 177.1 | 27.6 | -34.1 | 0 | 0 | 0 | 110.5 | V324 | P322-V324 VanDerWaalsContact C-N 3.28Å; P322-V324 HydrophobicContact CB-CG1 3.87Å; P322-V324 HydrophobicContact CG-CG1 3.88Å; P322-V324 PolarHBondContact O-N 3.31Å | ||
| 323 | R | 92.6 | Very high | 91.9 | Very high | 145 Ų | 145 | 76.9 Ų | 76.9 | 55% | 0.547 | 42% | 0.417 | S | S | . | . | trans | -83 | 75.5 | 176 | -61.4 | 176.7 | 78.2 | 110.1 | -3.1 | 109 | A333 F334 V335 | R323-A333 HydrophobicContact CB-CB 3.71Å; R323-A333 PolarHBondContact NE-O 2.81Å; R323-A333 PolarHBondContact NH2-O 3.23Å; R323-F334 CarbonylContact C-O 3.47Å; R323-F334 VanDerWaalsContact C-O 3.25Å; R323-F334 VanDerWaalsContact CA-O 3.25Å; R323-F334 WeakPolarHBondContact CA-O 3.35Å; R323-V335 HydrophobicContact CG-CG2 3.7Å | ||
| 324 | V | 91.9 | Very high | 92 | Very high | 92 Ų | 92 | 77.8 Ų | 77.8 | 56% | 0.558 | 42% | 0.421 | S | S | * | . | trans | -79.8 | -18.9 | -173.2 | -61.3 | 0 | 0 | 0 | 0 | 113.6 | P322 V326 F334 | P322-V324 VanDerWaalsContact C-N 3.28Å; P322-V324 HydrophobicContact CB-CG1 3.87Å; P322-V324 HydrophobicContact CG-CG1 3.88Å; P322-V324 PolarHBondContact O-N 3.31Å; V324-V326 PolarHBondContact O-N 3.13Å; V324-F334 PolarHBondContact N-O 3.38Å | ||
| 325 | H | 95.1 | Very high | 92.2 | Very high | 59 Ų | 59 | 71 Ų | 71 | 27% | 0.273 | 40% | 0.397 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.1 | 96.1 | -177.3 | -60.2 | -68 | 0 | 0 | 0 | 110.4 | A333 F334 V335 S337 L340 | H325-A333 CarbonylContact O-C 3.54Å; H325-A333 WeakPolarHBondContact O-CA 3.42Å; H325-F334 HydrophobicContact CB-CB 4.35Å; H325-F334 WeakPolarHBondContact CB-O 2.93Å; H325-F334 PolarHBondContact N-O 3.42Å; H325-F334 PolarHBondContact O-N 2.89Å; H325-V335 PolarHBondContact CD2-O 3.28Å; H325-V335 VanDerWaalsContact CD2-O 3.27Å; H325-S337 PolarHBondContact CD2-N 2.88Å; H325-S337 PolarHBondContact NE2-N 3.32Å; H325-L340 HydrophobicContact CB-CB 4.01Å; H325-L340 HydrophobicContact CB-CD2 3.86Å |
| 326 | V | 96.3 | Very high | 92.3 | Very high | 81 Ų | 81 | 66.4 Ų | 66.4 | 49% | 0.491 | 38% | 0.378 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.1 | 132.1 | -176.6 | -172.9 | 0 | 0 | 0 | 0 | 110.7 | V324 A328 A333 | V324-V326 PolarHBondContact O-N 3.13Å; V326-A328 PolarHBondContact O-N 2.78Å; V326-A333 HydrophobicContact CG2-CB 4.03Å |
| 327 | C | 96.4 | Very high | 92.4 | Very high | 2 Ų | 2 | 68.4 Ų | 68.4 | 1% | 0.014 | 39% | 0.394 | C | S | . | . | trans | -70.2 | 122.5 | 170.1 | -179.9 | 0 | 0 | 0 | 0 | 109.9 | E329 G331 K332 L340 H347 | C327-E329 PolarHBondContact O-N 3.01Å; C327-E329 PolarHBondContact SG-N 2.69Å; C327-G331 WeakPolarHBondContact O-CA 3.44Å; C327-G331 PolarHBondContact O-N 2.83Å; C327-K332 HydrophobicContact CB-CB 4.45Å; C327-K332 WeakPolarHBondContact CB-O 3.33Å; C327-K332 PolarHBondContact N-O 3.42Å; C327-L340 HydrophobicContact CB-CD1 3.64Å; C327-H347 PolarHBondContact SG-NE2 3.42Å | ||
| 328 | A | 95.6 | Very high | 92.6 | Very high | 107 Ų | 107 | 68.3 Ų | 68.3 | 88% | 0.884 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.8 | -27.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | V326 | V326-A328 PolarHBondContact O-N 2.78Š|
| 329 | E | 94.9 | Very high | 92.9 | Very high | 123 Ų | 123 | 67.6 Ų | 67.6 | 58% | 0.575 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | -38.7 | -173.9 | -60.6 | -177 | -140.3 | 0 | 0 | 113.1 | C327 H347 | C327-E329 PolarHBondContact O-N 3.01Å; C327-E329 PolarHBondContact SG-N 2.69Å; E329-H347 WeakPolarHBondContact OE2-CB 3.4Å; E329-H347 IonicContact OE2-CD2 3.23Å; E329-H347 IonicContact OE2-CE1 3.48Å; E329-H347 IonicContact OE2-CG 2.83Å; E329-H347 IonicContact OE2-ND1 3.01Å; E329-H347 PolarHBondContact OE2-ND1 2.74Å |
| 330 | C | 95.4 | Very high | 93.2 | Very high | 56 Ų | 56 | 65.6 Ų | 65.6 | 38% | 0.378 | 38% | 0.382 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -125.3 | 2.6 | -177 | 70.2 | 0 | 0 | 0 | 0 | 115 | K332 H343 H347 | C330-K332 PolarHBondContact O-N 2.99Å; C330-K332 VanDerWaalsContact O-N 3.1Å; C330-K332 VanDerWaalsContact SG-CG 3.59Å; C330-H343 PolarHBondContact SG-NE2 3.34Å; C330-H347 PolarHBondContact SG-NE2 3.18Å; C330-H347 VanDerWaalsContact SG-NE2 3.4Å |
| 331 | G | 94.1 | Very high | 93.4 | Very high | 50 Ų | 50 | 69.6 Ų | 69.6 | 52% | 0.515 | 40% | 0.398 | S | S | . | . | trans | 69.6 | 2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 115 | C327 A333 | C327-G331 WeakPolarHBondContact O-CA 3.44Å; C327-G331 PolarHBondContact O-N 2.83Å; G331-A333 PolarHBondContact O-N 3.25Å | ||
| 332 | K | 95.4 | Very high | 93.7 | Very high | 105 Ų | 105 | 73.5 Ų | 73.5 | 46% | 0.457 | 41% | 0.405 | S | S | . | . | trans | -64.3 | 123.2 | 177.4 | -75.3 | 178.6 | -177.5 | 175.3 | 0 | 110.2 | C327 C330 F334 | C327-K332 HydrophobicContact CB-CB 4.45Å; C327-K332 WeakPolarHBondContact CB-O 3.33Å; C327-K332 PolarHBondContact N-O 3.42Å; C330-K332 PolarHBondContact O-N 2.99Å; C330-K332 VanDerWaalsContact O-N 3.1Å; C330-K332 VanDerWaalsContact SG-CG 3.59Å; K332-F334 HydrophobicContact CB-CE2 3.84Å; K332-F334 HydrophobicContact CB-CZ 4.05Å; K332-F334 WeakPolarHBondContact O-CD2 3.23Å; K332-F334 VanDerWaalsContact O-CE2 3.31Å; K332-F334 WeakPolarHBondContact O-CE2 3.38Å | ||
| 333 | A | 93.6 | Very high | 94.1 | Very high | 28 Ų | 28 | 69.5 Ų | 69.5 | 23% | 0.231 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95 | 146.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | R323 H325 V326 G331 | R323-A333 HydrophobicContact CB-CB 3.71Å; R323-A333 PolarHBondContact NE-O 2.81Å; R323-A333 PolarHBondContact NH2-O 3.23Å; H325-A333 CarbonylContact O-C 3.54Å; H325-A333 WeakPolarHBondContact O-CA 3.42Å; V326-A333 HydrophobicContact CG2-CB 4.03Å; G331-A333 PolarHBondContact O-N 3.25Å |
| 334 | F | 93.6 | Very high | 94.1 | Very high | 34 Ų | 34 | 66.4 Ų | 66.4 | 15% | 0.149 | 37% | 0.369 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.9 | 150.5 | 179.4 | -59.1 | -91.2 | 0 | 0 | 0 | 110.8 | R323 V324 H325 K332 K339 L340 H343 | R323-F334 CarbonylContact C-O 3.47Å; R323-F334 VanDerWaalsContact C-O 3.25Å; R323-F334 VanDerWaalsContact CA-O 3.25Å; R323-F334 WeakPolarHBondContact CA-O 3.35Å; V324-F334 PolarHBondContact N-O 3.38Å; H325-F334 HydrophobicContact CB-CB 4.35Å; H325-F334 WeakPolarHBondContact CB-O 2.93Å; H325-F334 PolarHBondContact N-O 3.42Å; H325-F334 PolarHBondContact O-N 2.89Å; K332-F334 HydrophobicContact CB-CE2 3.84Å; K332-F334 HydrophobicContact CB-CZ 4.05Å; K332-F334 WeakPolarHBondContact O-CD2 3.23Å; K332-F334 VanDerWaalsContact O-CE2 3.31Å; K332-F334 WeakPolarHBondContact O-CE2 3.38Å; F334-K339 HydrophobicContact CB-CB 4.13Å; F334-K339 HydrophobicContact CD1-CB 3.84Å; F334-K339 HydrophobicContact CG-CB 4.2Å; F334-L340 HydrophobicContact CB-CB 4.44Å; F334-L340 HydrophobicContact CD2-CB 3.95Å; F334-L340 HydrophobicContact CD2-CD1 3.91Å; F334-L340 HydrophobicContact CE2-CD1 4.03Å; F334-L340 HydrophobicContact CG-CB 4.4Å; F334-H343 HydrophobicContact CE1-CB 4.14Å; F334-H343 HydrophobicContact CE2-CB 3.89Å; F334-H343 AromaticContact CE2-CD2 3.33Å; F334-H343 WeakPolarHBondContact CE2-CD2 3.43Å; F334-H343 AromaticContact CE2-CG 3.68Å; F334-H343 HydrophobicContact CZ-CB 3.51Å; F334-H343 AromaticContact CZ-CD2 3.45Å; F334-H343 VanDerWaalsContact CZ-CD2 3.45Å; F334-H343 WeakPolarHBondContact CZ-CD2 3.39Å; F334-H343 AromaticContact CZ-CG 3.33Å; F334-H343 AromaticContact CZ-ND1 3.98Å |
| 335 | V | 92.7 | Very high | 94.3 | Very high | 18 Ų | 18 | 63.4 Ų | 63.4 | 11% | 0.109 | 35% | 0.35 | C | S | . | . | S | Bend | trans | -72 | -39.2 | 175.8 | 175.2 | 0 | 0 | 0 | 0 | 111.4 | H318 R323 H325 | H318-V335 PolarHBondContact NE2-O 2.99Å; H318-V335 WeakPolarHBondContact O-CG1 3.43Å; R323-V335 HydrophobicContact CG-CG2 3.7Å; H325-V335 PolarHBondContact CD2-O 3.28Å; H325-V335 VanDerWaalsContact CD2-O 3.27Å |
| 336 | E | 90.6 | Very high | 94.2 | Very high | 59 Ų | 59 | 63.6 Ų | 63.6 | 28% | 0.276 | 36% | 0.355 | S | S | . | . | S | Bend | trans | -113.4 | 138 | -174.8 | -68.3 | 164.2 | -158.1 | 0 | 0 | 110.2 | S338 K339 L340 | E336-S338 VanDerWaalsContact C-N 3.29Å; E336-S338 PolarHBondContact O-N 2.94Å; E336-K339 HydrophobicContact CB-CB 4.41Å; E336-K339 HydrophobicContact CB-CG 3.81Å; E336-K339 WeakPolarHBondContact O-CB 3.33Å; E336-K339 PolarHBondContact O-N 3.3Å; E336-K339 VanDerWaalsContact O-N 3.14Å; E336-K339 WeakPolarHBondContact OE2-CE 3.46Å; E336-L340 PolarHBondContact O-N 2.86Å |
| 337 | S | 92.8 | Very high | 94.1 | Very high | 60 Ų | 60 | 62.9 Ų | 62.9 | 42% | 0.42 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -61.8 | -36.3 | 177.8 | 63.1 | 0 | 0 | 0 | 0 | 112.5 | H325 K339 L340 K341 | H325-S337 PolarHBondContact CD2-N 2.88Å; H325-S337 PolarHBondContact NE2-N 3.32Å; S337-K339 PolarHBondContact O-N 3.13Å; S337-L340 WeakPolarHBondContact O-CB 3.39Å; S337-L340 PolarHBondContact O-N 3.41Å; S337-L340 VanDerWaalsContact O-N 3.11Å; S337-K341 PolarHBondContact O-N 3.35Å |
| 338 | S | 92.7 | Very high | 94 | Very high | 66 Ų | 66 | 66.5 Ų | 66.5 | 46% | 0.462 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60.9 | -33.6 | 176.6 | 65.1 | 0 | 0 | 0 | 0 | 112.2 | E336 R342 | E336-S338 VanDerWaalsContact C-N 3.29Å; E336-S338 PolarHBondContact O-N 2.94Å; S338-R342 VanDerWaalsContact O-CB 3.27Å; S338-R342 WeakPolarHBondContact O-CB 3.46Å; S338-R342 PolarHBondContact O-N 3.12Å |
| 339 | K | 93.7 | Very high | 93.8 | Very high | 78 Ų | 78 | 63.2 Ų | 63.2 | 34% | 0.339 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -71.7 | -37.4 | 175.7 | -58.9 | -68.3 | 178.7 | -172.2 | 0 | 111.3 | F334 E336 S337 H343 | F334-K339 HydrophobicContact CB-CB 4.13Å; F334-K339 HydrophobicContact CD1-CB 3.84Å; F334-K339 HydrophobicContact CG-CB 4.2Å; E336-K339 HydrophobicContact CB-CB 4.41Å; E336-K339 HydrophobicContact CB-CG 3.81Å; E336-K339 WeakPolarHBondContact O-CB 3.33Å; E336-K339 PolarHBondContact O-N 3.3Å; E336-K339 VanDerWaalsContact O-N 3.14Å; E336-K339 WeakPolarHBondContact OE2-CE 3.46Å; S337-K339 PolarHBondContact O-N 3.13Å; K339-H343 VanDerWaalsContact O-CB 3.27Å; K339-H343 WeakPolarHBondContact O-CB 3.34Å; K339-H343 PolarHBondContact O-N 2.78Å |
| 340 | L | 95.4 | Very high | 93.8 | Very high | 25 Ų | 25 | 62.8 Ų | 62.8 | 13% | 0.131 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -64.3 | -50.7 | 172.7 | 173.3 | 61.4 | 0 | 0 | 0 | 111.1 | H325 C327 F334 E336 S337 R342 H343 Q344 | H325-L340 HydrophobicContact CB-CB 4.01Å; H325-L340 HydrophobicContact CB-CD2 3.86Å; C327-L340 HydrophobicContact CB-CD1 3.64Å; F334-L340 HydrophobicContact CB-CB 4.44Å; F334-L340 HydrophobicContact CD2-CB 3.95Å; F334-L340 HydrophobicContact CD2-CD1 3.91Å; F334-L340 HydrophobicContact CE2-CD1 4.03Å; F334-L340 HydrophobicContact CG-CB 4.4Å; E336-L340 PolarHBondContact O-N 2.86Å; S337-L340 WeakPolarHBondContact O-CB 3.39Å; S337-L340 PolarHBondContact O-N 3.41Å; S337-L340 VanDerWaalsContact O-N 3.11Å; L340-R342 VanDerWaalsContact C-N 3.27Å; L340-R342 PolarHBondContact O-N 3.12Å; L340-H343 CarbonylContact O-C 3.26Å; L340-H343 WeakPolarHBondContact O-CA 3.36Å; L340-H343 WeakPolarHBondContact O-CB 3.44Å; L340-H343 PolarHBondContact O-N 3.01Å; L340-Q344 HydrophobicContact CD1-CG 4.47Å; L340-Q344 WeakPolarHBondContact O-CG 3.33Å; L340-Q344 PolarHBondContact O-N 3.33Å |
| 341 | K | 93.9 | Very high | 93.7 | Very high | 147 Ų | 147 | 63.2 Ų | 63.2 | 64% | 0.639 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -54 | -45.8 | 176.7 | -73.6 | -177.3 | 179 | 178.8 | 0 | 111.9 | S337 H343 Q344 | S337-K341 PolarHBondContact O-N 3.35Å; K341-H343 VanDerWaalsContact C-N 3.3Å; K341-H343 PolarHBondContact O-N 2.95Å; K341-Q344 WeakPolarHBondContact O-CB 3.38Å; K341-Q344 PolarHBondContact O-N 3.49Å |
| 342 | R | 93.6 | Very high | 93.6 | Very high | 106 Ų | 106 | 64 Ų | 64 | 40% | 0.4 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63.5 | -36.8 | 176 | -172.2 | 175.2 | 65.2 | 162.7 | 8.6 | 112.8 | S338 L340 Q344 L345 L366 | S338-R342 VanDerWaalsContact O-CB 3.27Å; S338-R342 WeakPolarHBondContact O-CB 3.46Å; S338-R342 PolarHBondContact O-N 3.12Å; L340-R342 VanDerWaalsContact C-N 3.27Å; L340-R342 PolarHBondContact O-N 3.12Å; R342-Q344 VanDerWaalsContact C-N 3.33Å; R342-L345 HydrophobicContact CG-CD1 4.5Å; R342-L345 WeakPolarHBondContact O-CB 3.46Å; R342-L345 PolarHBondContact O-N 2.97Å; R342-L366 VanDerWaalsContact CD-CD2 3.41Å; R342-L366 HydrophobicContact CG-CD1 4.42Å; R342-L366 HydrophobicContact CG-CD2 3.3Å; R342-L366 HydrophobicContact CG-CG 4.5Å |
| 343 | H | 94.8 | Very high | 93.6 | Very high | 18 Ų | 18 | 62.6 Ų | 62.6 | 8% | 0.083 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -68.6 | -32.4 | 177 | 168.2 | 57 | 0 | 0 | 0 | 112.2 | C330 F334 K339 L340 K341 L345 V346 H347 | C330-H343 PolarHBondContact SG-NE2 3.34Å; F334-H343 HydrophobicContact CE1-CB 4.14Å; F334-H343 HydrophobicContact CE2-CB 3.89Å; F334-H343 AromaticContact CE2-CD2 3.33Å; F334-H343 WeakPolarHBondContact CE2-CD2 3.43Å; F334-H343 AromaticContact CE2-CG 3.68Å; F334-H343 HydrophobicContact CZ-CB 3.51Å; F334-H343 AromaticContact CZ-CD2 3.45Å; F334-H343 VanDerWaalsContact CZ-CD2 3.45Å; F334-H343 WeakPolarHBondContact CZ-CD2 3.39Å; F334-H343 AromaticContact CZ-CG 3.33Å; F334-H343 AromaticContact CZ-ND1 3.98Å; K339-H343 VanDerWaalsContact O-CB 3.27Å; K339-H343 WeakPolarHBondContact O-CB 3.34Å; K339-H343 PolarHBondContact O-N 2.78Å; L340-H343 CarbonylContact O-C 3.26Å; L340-H343 WeakPolarHBondContact O-CA 3.36Å; L340-H343 WeakPolarHBondContact O-CB 3.44Å; L340-H343 PolarHBondContact O-N 3.01Å; K341-H343 VanDerWaalsContact C-N 3.3Å; K341-H343 PolarHBondContact O-N 2.95Å; H343-L345 PolarHBondContact O-N 3.15Å; H343-L345 VanDerWaalsContact O-N 3.14Å; H343-V346 VanDerWaalsContact O-CB 3.27Å; H343-V346 WeakPolarHBondContact O-CB 3.42Å; H343-V346 WeakPolarHBondContact O-CG2 3.48Å; H343-V346 PolarHBondContact O-N 3Å; H343-H347 AromaticContact CE1-NE2 3.89Å; H343-H347 AromaticContact NE2-NE2 3.6Å |
| 344 | Q | 94.4 | Very high | 93.8 | Very high | 80 Ų | 80 | 65.8 Ų | 65.8 | 37% | 0.374 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -59.6 | -24.2 | 176.1 | -69.4 | 175.6 | -58.3 | 0 | 0 | 113.2 | L340 K341 R342 V346 H347 T348 | L340-Q344 HydrophobicContact CD1-CG 4.47Å; L340-Q344 WeakPolarHBondContact O-CG 3.33Å; L340-Q344 PolarHBondContact O-N 3.33Å; K341-Q344 WeakPolarHBondContact O-CB 3.38Å; K341-Q344 PolarHBondContact O-N 3.49Å; R342-Q344 VanDerWaalsContact C-N 3.33Å; Q344-V346 PolarHBondContact O-N 2.59Å; Q344-V346 VanDerWaalsContact O-N 3.14Å; Q344-H347 WeakPolarHBondContact O-CB 3.37Å; Q344-H347 PolarHBondContact O-N 3.21Å; Q344-T348 PolarHBondContact O-N 2.81Å; Q344-T348 PolarHBondContact O-OG1 2.73Å |
| 345 | L | 94.7 | Very high | 93.9 | Very high | 29 Ų | 29 | 64.3 Ų | 64.3 | 15% | 0.152 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -60 | -23.1 | 173.3 | -59.4 | 172.7 | 0 | 0 | 0 | 113.3 | R342 H343 H347 G349 E350 S365 L366 | R342-L345 HydrophobicContact CG-CD1 4.5Å; R342-L345 WeakPolarHBondContact O-CB 3.46Å; R342-L345 PolarHBondContact O-N 2.97Å; H343-L345 PolarHBondContact O-N 3.15Å; H343-L345 VanDerWaalsContact O-N 3.14Å; L345-H347 VanDerWaalsContact C-N 3.28Å; L345-G349 WeakPolarHBondContact O-CA 3.36Å; L345-G349 PolarHBondContact O-N 3.28Å; L345-G349 VanDerWaalsContact O-N 3.12Å; L345-E350 HydrophobicContact CD2-CB 3.77Å; L345-S365 WeakPolarHBondContact CD1-O 3.29Å; L345-L366 HydrophobicContact CD1-CD2 4.12Å |
| 346 | V | 94.2 | Very high | 94.1 | Very high | 63 Ų | 63 | 69.7 Ų | 69.7 | 38% | 0.382 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -69.7 | -30.9 | 174.2 | -179.9 | 0 | 0 | 0 | 0 | 111.1 | H343 Q344 | H343-V346 VanDerWaalsContact O-CB 3.27Å; H343-V346 WeakPolarHBondContact O-CB 3.42Å; H343-V346 WeakPolarHBondContact O-CG2 3.48Å; H343-V346 PolarHBondContact O-N 3Å; Q344-V346 PolarHBondContact O-N 2.59Å; Q344-V346 VanDerWaalsContact O-N 3.14Å |
| 347 | H | 93.8 | Very high | 94.3 | Very high | 66 Ų | 66 | 72 Ų | 72 | 31% | 0.306 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -87 | -41.6 | -179.3 | -70.1 | -58.9 | 0 | 0 | 0 | 112.4 | C327 E329 C330 H343 Q344 L345 G349 | C327-H347 PolarHBondContact SG-NE2 3.42Å; E329-H347 WeakPolarHBondContact OE2-CB 3.4Å; E329-H347 IonicContact OE2-CD2 3.23Å; E329-H347 IonicContact OE2-CE1 3.48Å; E329-H347 IonicContact OE2-CG 2.83Å; E329-H347 IonicContact OE2-ND1 3.01Å; E329-H347 PolarHBondContact OE2-ND1 2.74Å; C330-H347 PolarHBondContact SG-NE2 3.18Å; C330-H347 VanDerWaalsContact SG-NE2 3.4Å; H343-H347 AromaticContact CE1-NE2 3.89Å; H343-H347 AromaticContact NE2-NE2 3.6Å; Q344-H347 WeakPolarHBondContact O-CB 3.37Å; Q344-H347 PolarHBondContact O-N 3.21Å; L345-H347 VanDerWaalsContact C-N 3.28Å; H347-G349 PolarHBondContact O-N 3.38Å |
| 348 | T | 93.6 | Very high | 94.3 | Very high | 78 Ų | 78 | 77.3 Ų | 77.3 | 48% | 0.479 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -76.6 | -14.3 | 178.8 | 62.6 | 0 | 0 | 0 | 0 | 112.8 | Q344 E350 | Q344-T348 PolarHBondContact O-N 2.81Å; Q344-T348 PolarHBondContact O-OG1 2.73Å; T348-E350 PolarHBondContact O-N 3.47Å; T348-E350 VanDerWaalsContact O-N 3.09Å; T348-E350 WeakPolarHBondContact OG1-CB 2.95Å; T348-E350 WeakPolarHBondContact OG1-CG 3.32Å; T348-E350 PolarHBondContact OG1-N 3.4Å |
| 349 | G | 92.9 | Very high | 94.4 | Very high | 39 Ų | 39 | 78.5 Ų | 78.5 | 40% | 0.402 | 42% | 0.416 | S | S | . | . | trans | 64.4 | 8.8 | -172 | 0 | 0 | 0 | 0 | 0 | 113.3 | L345 H347 K351 | L345-G349 WeakPolarHBondContact O-CA 3.36Å; L345-G349 PolarHBondContact O-N 3.28Å; L345-G349 VanDerWaalsContact O-N 3.12Å; H347-G349 PolarHBondContact O-N 3.38Å; G349-K351 PolarHBondContact O-N 2.93Å | ||
| 350 | E | 93.5 | Very high | 94.4 | Very high | 113 Ų | 113 | 76.2 Ų | 76.2 | 53% | 0.528 | 41% | 0.409 | S | S | . | . | trans | -63.7 | 124.9 | -176.7 | -79.8 | -175.5 | -174.5 | 0 | 0 | 110.6 | L345 T348 P352 | L345-E350 HydrophobicContact CD2-CB 3.77Å; T348-E350 PolarHBondContact O-N 3.47Å; T348-E350 VanDerWaalsContact O-N 3.09Å; T348-E350 WeakPolarHBondContact OG1-CB 2.95Å; T348-E350 WeakPolarHBondContact OG1-CG 3.32Å; T348-E350 PolarHBondContact OG1-N 3.4Å; E350-P352 WeakPolarHBondContact O-CD 3.11Å | ||
| 351 | K | 94.3 | Very high | 94.3 | Very high | 66 Ų | 66 | 76.9 Ų | 76.9 | 29% | 0.287 | 42% | 0.422 | S | S | . | . | trans | -120.4 | 79.1 | 177.1 | -68.6 | 173.9 | -176.8 | 177.7 | 0 | 109.4 | D51 G349 F353 R363 F364 | D51-K351 WeakPolarHBondContact OD1-CE 3.16Å; D51-K351 IonicContact OD1-NZ 2.79Å; D51-K351 PolarHBondContact OD1-NZ 3.11Å; D51-K351 WeakPolarHBondContact OD2-CE 3.03Å; D51-K351 IonicContact OD2-NZ 3.08Å; D51-K351 PolarHBondContact OD2-NZ 3.42Å; G349-K351 PolarHBondContact O-N 2.93Å; K351-F353 VanDerWaalsContact C-N 3.25Å; K351-F353 PolarHBondContact O-N 3.19Å; K351-R363 HydrophobicContact CB-CB 3.56Å; K351-R363 PolarHBondContact O-NE 3.11Å; K351-R363 PolarHBondContact O-NH2 2.62Å; K351-R363 VanDerWaalsContact O-NH2 3.17Å; K351-F364 CarbonylContact C-O 3.57Å; K351-F364 VanDerWaalsContact C-O 3.26Å; K351-F364 WeakPolarHBondContact CA-O 3.49Å | ||
| 352 | P | 92.1 | Very high | 94.4 | Very high | 65 Ų | 65 | 75.8 Ų | 75.8 | 42% | 0.422 | 42% | 0.418 | S | S | . | . | trans | -66.2 | -27 | -172.6 | -21.5 | 34.2 | 0 | 0 | 0 | 113.4 | E350 | E350-P352 WeakPolarHBondContact O-CD 3.11Š| ||
| 353 | F | 95.6 | Very high | 94.5 | Very high | 76 Ų | 76 | 76.8 Ų | 76.8 | 33% | 0.333 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 110.4 | -169.2 | -56.2 | -79.5 | 0 | 0 | 0 | 111.1 | K351 R363 F364 S365 L366 D367 L370 | K351-F353 VanDerWaalsContact C-N 3.25Å; K351-F353 PolarHBondContact O-N 3.19Å; F353-R363 CarbonylContact O-C 3.28Å; F353-R363 VanDerWaalsContact O-CA 3.29Å; F353-R363 WeakPolarHBondContact O-CA 3.32Å; F353-F364 HydrophobicContact CB-CB 4.44Å; F353-F364 WeakPolarHBondContact CB-O 3.48Å; F353-F364 WeakPolarHBondContact CD2-O 3.39Å; F353-F364 PolarHBondContact N-O 2.92Å; F353-F364 PolarHBondContact O-N 3.46Å; F353-S365 WeakPolarHBondContact CD2-O 3.34Å; F353-S365 VanDerWaalsContact CE2-O 3.26Å; F353-S365 WeakPolarHBondContact CE2-O 3.45Å; F353-L366 VanDerWaalsContact CD2-C 3.43Å; F353-D367 HydrophobicContact CD1-CB 3.85Å; F353-D367 HydrophobicContact CD2-CB 4.46Å; F353-D367 VanDerWaalsContact CD2-N 3.31Å; F353-D367 HydrophobicContact CE1-CB 3.69Å; F353-D367 HydrophobicContact CE2-CB 4.32Å; F353-D367 HydrophobicContact CG-CB 4.24Å; F353-D367 HydrophobicContact CZ-CB 3.93Å; F353-L370 HydrophobicContact CB-CB 4.18Å; F353-L370 HydrophobicContact CB-CD2 3.89Å |
| 354 | Q | 96.3 | Very high | 94.5 | Very high | 95 Ų | 95 | 77.8 Ų | 77.8 | 44% | 0.444 | 43% | 0.426 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.2 | 141.1 | -179.6 | -172.7 | 172.5 | 21.5 | 0 | 0 | 112.5 | T356 G361 R363 L370 | Q354-T356 PolarHBondContact O-N 3.21Å; Q354-G361 PolarHBondContact NE2-O 3.41Å; Q354-R363 HydrophobicContact CB-CG 4.21Å; Q354-R363 HydrophobicContact CG-CG 4.08Å; Q354-L370 WeakPolarHBondContact O-CD2 3.42Å |
| 355 | C | 96.8 | Very high | 94.4 | Very high | 3 Ų | 3 | 75.1 Ų | 75.1 | 2% | 0.02 | 42% | 0.416 | C | S | . | . | trans | -72.8 | 120 | 169.8 | -170.9 | 0 | 0 | 0 | 0 | 110.6 | F357 C360 K362 L370 | C355-F357 VanDerWaalsContact C-N 3.27Å; C355-F357 PolarHBondContact O-N 2.98Å; C355-C360 HydrophobicContact CB-CB 4.42Å; C355-K362 WeakPolarHBondContact CB-O 3.39Å; C355-K362 PolarHBondContact N-O 2.98Å; C355-L370 HydrophobicContact CB-CD1 3.78Å | ||
| 356 | T | 95.7 | Very high | 94.3 | Very high | 132 Ų | 132 | 75.3 Ų | 75.3 | 81% | 0.81 | 42% | 0.417 | S | S | * | . | trans | -86 | 5.3 | 179.1 | 56.6 | 0 | 0 | 0 | 0 | 113.4 | Q354 E358 | Q354-T356 PolarHBondContact O-N 3.21Å; T356-E358 PolarHBondContact O-N 3.15Å | ||
| 357 | F | 94.9 | Very high | 94.3 | Very high | 107 Ų | 107 | 75.2 Ų | 75.2 | 47% | 0.469 | 41% | 0.414 | S | S | . | . | S | Bend | trans | -71.1 | 129.6 | 175.8 | -164.7 | -93.9 | 0 | 0 | 0 | 109.9 | C355 G359 C360 H377 | C355-F357 VanDerWaalsContact C-N 3.27Å; C355-F357 PolarHBondContact O-N 2.98Å; F357-G359 PolarHBondContact O-N 2.87Å; F357-C360 HydrophobicContact CB-CB 4.14Å; F357-C360 WeakPolarHBondContact O-CB 3.48Å; F357-C360 PolarHBondContact O-N 3.46Å; F357-H377 HydrophobicContact CD1-CB 4.19Å; F357-H377 AromaticContact CD1-CE1 3.78Å; F357-H377 AromaticContact CD1-CG 3.7Å; F357-H377 AromaticContact CD1-ND1 3.42Å; F357-H377 WeakPolarHBondContact CD1-ND1 3.39Å; F357-H377 HydrophobicContact CD2-CB 3.63Å; F357-H377 AromaticContact CD2-CG 3.89Å; F357-H377 HydrophobicContact CE1-CB 4.29Å; F357-H377 AromaticContact CE1-ND1 3.73Å; F357-H377 HydrophobicContact CE2-CB 3.76Å; F357-H377 HydrophobicContact CG-CB 3.86Å; F357-H377 AromaticContact CG-CD2 3.81Å; F357-H377 AromaticContact CG-CG 3.55Å; F357-H377 AromaticContact CG-ND1 3.79Å; F357-H377 HydrophobicContact CZ-CB 4.08Å |
| 358 | E | 94.3 | Very high | 94.1 | Very high | 172 Ų | 172 | 76.5 Ų | 76.5 | 80% | 0.804 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.5 | 124.6 | -177.6 | -64.8 | -60.3 | 147.2 | 0 | 0 | 111.3 | T356 C360 | T356-E358 PolarHBondContact O-N 3.15Å; E358-C360 VanDerWaalsContact C-N 3.32Å; E358-C360 PolarHBondContact O-N 3.34Å |
| 359 | G | 93.2 | Very high | 94 | Very high | 91 Ų | 91 | 75.6 Ų | 75.6 | 94% | 0.938 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.2 | 1.4 | -179 | 0 | 0 | 0 | 0 | 0 | 116.2 | F357 | F357-G359 PolarHBondContact O-N 2.87Š|
| 360 | C | 95.4 | Very high | 94.2 | Very high | 29 Ų | 29 | 74.9 Ų | 74.9 | 20% | 0.196 | 40% | 0.398 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.7 | -57.9 | 176.1 | -174 | 0 | 0 | 0 | 0 | 112.5 | C355 F357 E358 K362 H373 H377 | C355-C360 HydrophobicContact CB-CB 4.42Å; F357-C360 HydrophobicContact CB-CB 4.14Å; F357-C360 WeakPolarHBondContact O-CB 3.48Å; F357-C360 PolarHBondContact O-N 3.46Å; E358-C360 VanDerWaalsContact C-N 3.32Å; E358-C360 PolarHBondContact O-N 3.34Å; C360-K362 PolarHBondContact O-N 3.27Å; C360-H373 PolarHBondContact SG-NE2 3.49Å; C360-H377 PolarHBondContact SG-NE2 3.47Å |
| 361 | G | 92.5 | Very high | 94.1 | Very high | 39 Ų | 39 | 76.9 Ų | 76.9 | 40% | 0.402 | 40% | 0.401 | S | S | . | . | trans | 62.4 | -4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | Q354 | Q354-G361 PolarHBondContact NE2-O 3.41Š| ||
| 362 | K | 95.4 | Very high | 94 | Very high | 124 Ų | 124 | 74.8 Ų | 74.8 | 54% | 0.539 | 39% | 0.394 | S | S | . | . | trans | -60.6 | 141.3 | -175.4 | -71.8 | -178.2 | 179.1 | -170.9 | 0 | 112.3 | C355 C360 F364 | C355-K362 WeakPolarHBondContact CB-O 3.39Å; C355-K362 PolarHBondContact N-O 2.98Å; C360-K362 PolarHBondContact O-N 3.27Å; K362-F364 HydrophobicContact CB-CE2 4.01Å; K362-F364 HydrophobicContact CB-CZ 4.13Å | ||
| 363 | R | 95.9 | Very high | 94.1 | Very high | 127 Ų | 127 | 72.6 Ų | 72.6 | 48% | 0.479 | 38% | 0.378 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 150.5 | -179.2 | -53.2 | -174.9 | 70.3 | 116 | 1.6 | 111.5 | K351 F353 Q354 | K351-R363 HydrophobicContact CB-CB 3.56Å; K351-R363 PolarHBondContact O-NE 3.11Å; K351-R363 PolarHBondContact O-NH2 2.62Å; K351-R363 VanDerWaalsContact O-NH2 3.17Å; F353-R363 CarbonylContact O-C 3.28Å; F353-R363 VanDerWaalsContact O-CA 3.29Å; F353-R363 WeakPolarHBondContact O-CA 3.32Å; Q354-R363 HydrophobicContact CB-CG 4.21Å; Q354-R363 HydrophobicContact CG-CG 4.08Å |
| 364 | F | 94.9 | Very high | 94 | Very high | 40 Ų | 40 | 71.4 Ų | 71.4 | 18% | 0.175 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.7 | 144.9 | -178 | -58.7 | -87.2 | 0 | 0 | 0 | 110 | K351 F353 K362 L366 N369 L370 H373 | K351-F364 CarbonylContact C-O 3.57Å; K351-F364 VanDerWaalsContact C-O 3.26Å; K351-F364 WeakPolarHBondContact CA-O 3.49Å; F353-F364 HydrophobicContact CB-CB 4.44Å; F353-F364 WeakPolarHBondContact CB-O 3.48Å; F353-F364 WeakPolarHBondContact CD2-O 3.39Å; F353-F364 PolarHBondContact N-O 2.92Å; F353-F364 PolarHBondContact O-N 3.46Å; K362-F364 HydrophobicContact CB-CE2 4.01Å; K362-F364 HydrophobicContact CB-CZ 4.13Å; F364-L366 VanDerWaalsContact C-N 3.27Å; F364-L366 PolarHBondContact O-N 2.81Å; F364-N369 HydrophobicContact CB-CB 4.25Å; F364-N369 HydrophobicContact CD1-CB 4.02Å; F364-N369 HydrophobicContact CG-CB 4.38Å; F364-L370 HydrophobicContact CB-CB 4.25Å; F364-L370 HydrophobicContact CD2-CB 3.77Å; F364-L370 HydrophobicContact CD2-CD1 3.72Å; F364-L370 HydrophobicContact CD2-CG 4.34Å; F364-L370 HydrophobicContact CE2-CD1 3.86Å; F364-L370 HydrophobicContact CG-CB 4.16Å; F364-H373 HydrophobicContact CE1-CB 3.85Å; F364-H373 HydrophobicContact CE2-CB 3.86Å; F364-H373 AromaticContact CE2-CD2 3.44Å; F364-H373 VanDerWaalsContact CE2-CD2 3.44Å; F364-H373 WeakPolarHBondContact CE2-CD2 3.1Å; F364-H373 AromaticContact CE2-CG 3.64Å; F364-H373 HydrophobicContact CZ-CB 3.38Å; F364-H373 AromaticContact CZ-CD2 3.41Å; F364-H373 VanDerWaalsContact CZ-CD2 3.41Å; F364-H373 WeakPolarHBondContact CZ-CD2 3.43Å; F364-H373 AromaticContact CZ-CG 3.15Å; F364-H373 AromaticContact CZ-ND1 3.62Å; F364-H373 AromaticContact CZ-NE2 3.98Å |
| 365 | S | 92.8 | Very high | 93.9 | Very high | 24 Ų | 24 | 69.3 Ų | 69.3 | 17% | 0.168 | 37% | 0.365 | C | S | . | . | S | Bend | trans | -69.7 | -26.5 | 174 | 51 | 0 | 0 | 0 | 0 | 112.2 | L345 F353 | L345-S365 WeakPolarHBondContact CD1-O 3.29Å; F353-S365 WeakPolarHBondContact CD2-O 3.34Å; F353-S365 VanDerWaalsContact CE2-O 3.26Å; F353-S365 WeakPolarHBondContact CE2-O 3.45Å |
| 366 | L | 93 | Very high | 93.8 | Very high | 32 Ų | 32 | 73.8 Ų | 73.8 | 17% | 0.168 | 39% | 0.387 | C | S | . | . | S | Bend | trans | -128.5 | 136.5 | -174.9 | -52.5 | 176.7 | 0 | 0 | 0 | 112.2 | R342 L345 F353 F364 F368 N369 L370 | R342-L366 VanDerWaalsContact CD-CD2 3.41Å; R342-L366 HydrophobicContact CG-CD1 4.42Å; R342-L366 HydrophobicContact CG-CD2 3.3Å; R342-L366 HydrophobicContact CG-CG 4.5Å; L345-L366 HydrophobicContact CD1-CD2 4.12Å; F353-L366 VanDerWaalsContact CD2-C 3.43Å; F364-L366 VanDerWaalsContact C-N 3.27Å; F364-L366 PolarHBondContact O-N 2.81Å; L366-F368 VanDerWaalsContact C-N 3.35Å; L366-F368 HydrophobicContact CB-CD1 3.9Å; L366-F368 HydrophobicContact CB-CE1 3.73Å; L366-F368 HydrophobicContact CB-CZ 4.42Å; L366-F368 HydrophobicContact CD1-CD1 4.38Å; L366-F368 HydrophobicContact CD1-CE1 3.38Å; L366-F368 HydrophobicContact CD1-CZ 3.74Å; L366-F368 HydrophobicContact CG-CE1 4.12Å; L366-F368 PolarHBondContact O-N 2.85Å; L366-N369 HydrophobicContact CB-CB 4.37Å; L366-N369 WeakPolarHBondContact O-CB 3.4Å; L366-N369 PolarHBondContact O-N 2.89Å; L366-N369 VanDerWaalsContact O-N 3.08Å; L366-L370 PolarHBondContact O-N 2.96Å |
| 367 | D | 92.9 | Very high | 93.7 | Very high | 61 Ų | 61 | 70.2 Ų | 70.2 | 33% | 0.326 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -56.6 | -42.9 | 178.3 | 168.5 | 71.6 | 0 | 0 | 0 | 113.3 | F353 N369 L370 R371 | F353-D367 HydrophobicContact CD1-CB 3.85Å; F353-D367 HydrophobicContact CD2-CB 4.46Å; F353-D367 VanDerWaalsContact CD2-N 3.31Å; F353-D367 HydrophobicContact CE1-CB 3.69Å; F353-D367 HydrophobicContact CE2-CB 4.32Å; F353-D367 HydrophobicContact CG-CB 4.24Å; F353-D367 HydrophobicContact CZ-CB 3.93Å; D367-N369 PolarHBondContact O-N 3.24Å; D367-L370 WeakPolarHBondContact O-CB 3.41Å; D367-L370 PolarHBondContact O-N 2.82Å; D367-L370 VanDerWaalsContact O-N 3.13Å; D367-R371 PolarHBondContact O-N 2.96Å; D367-R371 IonicContact OD1-NE 2.73Å; D367-R371 IonicContact OD2-CZ 2.69Å; D367-R371 IonicContact OD2-NE 3.98Å; D367-R371 PolarHBondContact OD2-NE 3.32Å; D367-R371 IonicContact OD2-NH2 2.74Å; D367-R371 PolarHBondContact OD2-NH2 3.46Å |
| 368 | F | 89.4 | Confident | 93.6 | Very high | 94 Ų | 94 | 69.5 Ų | 69.5 | 41% | 0.412 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -66.7 | -27.3 | -179.8 | 78.2 | -96 | 0 | 0 | 0 | 112.6 | L366 T372 | L366-F368 VanDerWaalsContact C-N 3.35Å; L366-F368 HydrophobicContact CB-CD1 3.9Å; L366-F368 HydrophobicContact CB-CE1 3.73Å; L366-F368 HydrophobicContact CB-CZ 4.42Å; L366-F368 HydrophobicContact CD1-CD1 4.38Å; L366-F368 HydrophobicContact CD1-CE1 3.38Å; L366-F368 HydrophobicContact CD1-CZ 3.74Å; L366-F368 HydrophobicContact CG-CE1 4.12Å; L366-F368 PolarHBondContact O-N 2.85Å; F368-T372 WeakPolarHBondContact O-CB 3.37Å; F368-T372 PolarHBondContact O-N 3.25Å; F368-T372 PolarHBondContact O-OG1 3.48Å |
| 369 | N | 92.8 | Very high | 93.5 | Very high | 58 Ų | 58 | 63.7 Ų | 63.7 | 31% | 0.31 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -68.9 | -44.2 | 173.4 | -75 | -19 | 0 | 0 | 0 | 109.8 | F364 L366 D367 T372 H373 | F364-N369 HydrophobicContact CB-CB 4.25Å; F364-N369 HydrophobicContact CD1-CB 4.02Å; F364-N369 HydrophobicContact CG-CB 4.38Å; L366-N369 HydrophobicContact CB-CB 4.37Å; L366-N369 WeakPolarHBondContact O-CB 3.4Å; L366-N369 PolarHBondContact O-N 2.89Å; L366-N369 VanDerWaalsContact O-N 3.08Å; D367-N369 PolarHBondContact O-N 3.24Å; N369-T372 PolarHBondContact O-N 3.08Å; N369-H373 WeakPolarHBondContact O-CB 3.39Å; N369-H373 PolarHBondContact O-N 2.86Å |
| 370 | L | 95.5 | Very high | 93.6 | Very high | 24 Ų | 24 | 63.1 Ų | 63.1 | 13% | 0.126 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -57.6 | -50.4 | 172.3 | 171.1 | 61.5 | 0 | 0 | 0 | 111.4 | F353 Q354 C355 F364 L366 D367 T372 H373 V374 | F353-L370 HydrophobicContact CB-CB 4.18Å; F353-L370 HydrophobicContact CB-CD2 3.89Å; Q354-L370 WeakPolarHBondContact O-CD2 3.42Å; C355-L370 HydrophobicContact CB-CD1 3.78Å; F364-L370 HydrophobicContact CB-CB 4.25Å; F364-L370 HydrophobicContact CD2-CB 3.77Å; F364-L370 HydrophobicContact CD2-CD1 3.72Å; F364-L370 HydrophobicContact CD2-CG 4.34Å; F364-L370 HydrophobicContact CE2-CD1 3.86Å; F364-L370 HydrophobicContact CG-CB 4.16Å; L366-L370 PolarHBondContact O-N 2.96Å; D367-L370 WeakPolarHBondContact O-CB 3.41Å; D367-L370 PolarHBondContact O-N 2.82Å; D367-L370 VanDerWaalsContact O-N 3.13Å; L370-T372 PolarHBondContact O-N 3.38Å; L370-H373 WeakPolarHBondContact O-CB 3.02Å; L370-H373 PolarHBondContact O-N 3.42Å; L370-H373 VanDerWaalsContact O-N 3.07Å; L370-V374 HydrophobicContact CD1-CG2 3.94Å; L370-V374 HydrophobicContact CG-CG2 4.42Å; L370-V374 WeakPolarHBondContact O-CG2 3.17Å; L370-V374 PolarHBondContact O-N 3.17Å |
| 371 | R | 92.8 | Very high | 93.5 | Very high | 155 Ų | 155 | 68.3 Ų | 68.3 | 59% | 0.585 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -58.1 | -34.1 | 177.3 | -75.4 | -171.9 | -82.8 | 165.1 | -7.2 | 112.8 | D367 | D367-R371 PolarHBondContact O-N 2.96Å; D367-R371 IonicContact OD1-NE 2.73Å; D367-R371 IonicContact OD2-CZ 2.69Å; D367-R371 IonicContact OD2-NE 3.98Å; D367-R371 PolarHBondContact OD2-NE 3.32Å; D367-R371 IonicContact OD2-NH2 2.74Å; D367-R371 PolarHBondContact OD2-NH2 3.46Å |
| 372 | T | 92.1 | Very high | 93.5 | Very high | 23 Ų | 23 | 69.5 Ų | 69.5 | 14% | 0.141 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -73.9 | -40.3 | 176.2 | -57.9 | 0 | 0 | 0 | 0 | 111.6 | F368 N369 L370 R375 Q396 | F368-T372 WeakPolarHBondContact O-CB 3.37Å; F368-T372 PolarHBondContact O-N 3.25Å; F368-T372 PolarHBondContact O-OG1 3.48Å; N369-T372 PolarHBondContact O-N 3.08Å; L370-T372 PolarHBondContact O-N 3.38Å; T372-R375 WeakPolarHBondContact O-CB 3.44Å; T372-R375 PolarHBondContact O-N 2.89Å; T372-R375 PolarHBondContact OG1-NH2 2.84Å; T372-Q396 HydrophobicContact CG2-CG 3.53Å |
| 373 | H | 94.3 | Very high | 93.4 | Very high | 19 Ų | 19 | 67.3 Ų | 67.3 | 9% | 0.088 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -62.7 | -42.1 | 175.3 | 169.9 | 71.1 | 0 | 0 | 0 | 112.7 | C360 F364 N369 L370 R375 I376 H377 | C360-H373 PolarHBondContact SG-NE2 3.49Å; F364-H373 HydrophobicContact CE1-CB 3.85Å; F364-H373 HydrophobicContact CE2-CB 3.86Å; F364-H373 AromaticContact CE2-CD2 3.44Å; F364-H373 VanDerWaalsContact CE2-CD2 3.44Å; F364-H373 WeakPolarHBondContact CE2-CD2 3.1Å; F364-H373 AromaticContact CE2-CG 3.64Å; F364-H373 HydrophobicContact CZ-CB 3.38Å; F364-H373 AromaticContact CZ-CD2 3.41Å; F364-H373 VanDerWaalsContact CZ-CD2 3.41Å; F364-H373 WeakPolarHBondContact CZ-CD2 3.43Å; F364-H373 AromaticContact CZ-CG 3.15Å; F364-H373 AromaticContact CZ-ND1 3.62Å; F364-H373 AromaticContact CZ-NE2 3.98Å; N369-H373 WeakPolarHBondContact O-CB 3.39Å; N369-H373 PolarHBondContact O-N 2.86Å; L370-H373 WeakPolarHBondContact O-CB 3.02Å; L370-H373 PolarHBondContact O-N 3.42Å; L370-H373 VanDerWaalsContact O-N 3.07Å; H373-R375 PolarHBondContact O-N 2.89Å; H373-I376 VanDerWaalsContact O-CB 3.23Å; H373-I376 WeakPolarHBondContact O-CB 3.4Å; H373-I376 WeakPolarHBondContact O-CG1 3.36Å; H373-I376 PolarHBondContact O-N 3.43Å; H373-H377 AromaticContact CE1-NE2 3.85Å; H373-H377 AromaticContact NE2-CD2 3.95Å; H373-H377 AromaticContact NE2-NE2 3.24Å; H373-H377 PolarHBondContact NE2-NE2 2.82Å |
| 374 | V | 93.8 | Very high | 93.4 | Very high | 51 Ų | 51 | 64.8 Ų | 64.8 | 31% | 0.309 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -56.8 | -26.9 | 179.8 | 168.9 | 0 | 0 | 0 | 0 | 112.4 | L370 I376 H377 T378 | L370-V374 HydrophobicContact CD1-CG2 3.94Å; L370-V374 HydrophobicContact CG-CG2 4.42Å; L370-V374 WeakPolarHBondContact O-CG2 3.17Å; L370-V374 PolarHBondContact O-N 3.17Å; V374-I376 PolarHBondContact O-N 3.4Å; V374-H377 WeakPolarHBondContact O-CB 3.49Å; V374-H377 PolarHBondContact O-N 2.81Å; V374-T378 HydrophobicContact CG1-CG2 4.18Å; V374-T378 PolarHBondContact O-N 3.25Å; V374-T378 VanDerWaalsContact O-N 3.12Å |
| 375 | R | 94.3 | Very high | 93.4 | Very high | 50 Ų | 50 | 63.3 Ų | 63.3 | 19% | 0.189 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -61.4 | -23.4 | 174.9 | -62.9 | -179.3 | -130.8 | 179.1 | -0.5 | 113.6 | T372 H373 H377 T378 G379 D380 Y383 A395 | T372-R375 WeakPolarHBondContact O-CB 3.44Å; T372-R375 PolarHBondContact O-N 2.89Å; T372-R375 PolarHBondContact OG1-NH2 2.84Å; H373-R375 PolarHBondContact O-N 2.89Å; R375-H377 VanDerWaalsContact C-N 3.34Å; R375-T378 WeakPolarHBondContact CA-OG1 3.39Å; R375-T378 PolarHBondContact O-OG1 2.73Å; R375-G379 CarbonylContact O-C 3.56Å; R375-G379 WeakPolarHBondContact O-CA 3.18Å; R375-G379 PolarHBondContact O-N 2.72Å; R375-D380 HydrophobicContact CB-CB 4.31Å; R375-D380 HydrophobicContact CG-CB 4.27Å; R375-D380 PolarHBondContact O-N 3.4Å; R375-D380 VanDerWaalsContact O-N 3.12Å; R375-Y383 VanDerWaalsContact NH1-CE2 3.3Å; R375-A395 HydrophobicContact CB-CB 4.22Å; R375-A395 PolarHBondContact NH1-O 2.92Å |
| 376 | I | 93 | Very high | 93.4 | Very high | 98 Ų | 98 | 66.9 Ų | 66.9 | 50% | 0.503 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -67.2 | -39.5 | 174.6 | -59 | 172.3 | 0 | 0 | 0 | 110 | H373 V374 | H373-I376 VanDerWaalsContact O-CB 3.23Å; H373-I376 WeakPolarHBondContact O-CB 3.4Å; H373-I376 WeakPolarHBondContact O-CG1 3.36Å; H373-I376 PolarHBondContact O-N 3.43Å; V374-I376 PolarHBondContact O-N 3.4Å |
| 377 | H | 94.1 | Very high | 93.4 | Very high | 56 Ų | 56 | 68.2 Ų | 68.2 | 26% | 0.259 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -73.9 | -42.5 | 178.1 | -62.9 | -57.7 | 0 | 0 | 0 | 112.5 | F357 C360 H373 V374 R375 G379 | F357-H377 HydrophobicContact CD1-CB 4.19Å; F357-H377 AromaticContact CD1-CE1 3.78Å; F357-H377 AromaticContact CD1-CG 3.7Å; F357-H377 AromaticContact CD1-ND1 3.42Å; F357-H377 WeakPolarHBondContact CD1-ND1 3.39Å; F357-H377 HydrophobicContact CD2-CB 3.63Å; F357-H377 AromaticContact CD2-CG 3.89Å; F357-H377 HydrophobicContact CE1-CB 4.29Å; F357-H377 AromaticContact CE1-ND1 3.73Å; F357-H377 HydrophobicContact CE2-CB 3.76Å; F357-H377 HydrophobicContact CG-CB 3.86Å; F357-H377 AromaticContact CG-CD2 3.81Å; F357-H377 AromaticContact CG-CG 3.55Å; F357-H377 AromaticContact CG-ND1 3.79Å; F357-H377 HydrophobicContact CZ-CB 4.08Å; C360-H377 PolarHBondContact SG-NE2 3.47Å; H373-H377 AromaticContact CE1-NE2 3.85Å; H373-H377 AromaticContact NE2-CD2 3.95Å; H373-H377 AromaticContact NE2-NE2 3.24Å; H373-H377 PolarHBondContact NE2-NE2 2.82Å; V374-H377 WeakPolarHBondContact O-CB 3.49Å; V374-H377 PolarHBondContact O-N 2.81Å; R375-H377 VanDerWaalsContact C-N 3.34Å; H377-G379 PolarHBondContact O-N 3.24Å |
| 378 | T | 93.2 | Very high | 93.3 | Very high | 93 Ų | 93 | 73.7 Ų | 73.7 | 57% | 0.571 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -77.2 | -14.4 | -179.7 | 62.6 | 0 | 0 | 0 | 0 | 112.8 | V374 R375 D380 | V374-T378 HydrophobicContact CG1-CG2 4.18Å; V374-T378 PolarHBondContact O-N 3.25Å; V374-T378 VanDerWaalsContact O-N 3.12Å; R375-T378 WeakPolarHBondContact CA-OG1 3.39Å; R375-T378 PolarHBondContact O-OG1 2.73Å; T378-D380 PolarHBondContact O-N 3.04Å; T378-D380 WeakPolarHBondContact OG1-CB 3.42Å; T378-D380 PolarHBondContact OG1-N 3.04Å |
| 379 | G | 92.8 | Very high | 93.3 | Very high | 50 Ų | 50 | 72.6 Ų | 72.6 | 52% | 0.515 | 40% | 0.397 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 69.1 | 13.5 | -171.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | R375 H377 R381 | R375-G379 CarbonylContact O-C 3.56Å; R375-G379 WeakPolarHBondContact O-CA 3.18Å; R375-G379 PolarHBondContact O-N 2.72Å; H377-G379 PolarHBondContact O-N 3.24Å; G379-R381 PolarHBondContact O-N 3.03Å |
| 380 | D | 94.6 | Very high | 93.2 | Very high | 78 Ų | 78 | 70.6 Ų | 70.6 | 42% | 0.417 | 39% | 0.388 | S | S | . | . | trans | -68.5 | 125.8 | -178.7 | -177.9 | 29.9 | 0 | 0 | 0 | 111.3 | R375 T378 | R375-D380 HydrophobicContact CB-CB 4.31Å; R375-D380 HydrophobicContact CG-CB 4.27Å; R375-D380 PolarHBondContact O-N 3.4Å; R375-D380 VanDerWaalsContact O-N 3.12Å; T378-D380 PolarHBondContact O-N 3.04Å; T378-D380 WeakPolarHBondContact OG1-CB 3.42Å; T378-D380 PolarHBondContact OG1-N 3.04Å | ||
| 381 | R | 93.6 | Very high | 93.1 | Very high | 138 Ų | 138 | 76.5 Ų | 76.5 | 52% | 0.521 | 42% | 0.42 | S | S | . | . | trans | -133.4 | 72.7 | -176.4 | -64.6 | 173.4 | 84.6 | 150.3 | 7 | 109 | G379 Y383 K393 F394 | G379-R381 PolarHBondContact O-N 3.03Å; R381-Y383 PolarHBondContact O-N 2.78Å; R381-K393 HydrophobicContact CB-CB 3.72Å; R381-K393 PolarHBondContact NE-O 3.2Å; R381-K393 PolarHBondContact NH2-O 2.84Å; R381-F394 CarbonylContact C-O 3.46Å; R381-F394 VanDerWaalsContact C-O 3.28Å; R381-F394 VanDerWaalsContact CA-O 3.29Å; R381-F394 WeakPolarHBondContact CA-O 3.19Å | ||
| 382 | P | 91.7 | Very high | 93.2 | Very high | 65 Ų | 65 | 75 Ų | 75 | 42% | 0.422 | 42% | 0.417 | S | S | . | . | trans | -70.6 | -19.4 | -171.2 | 27.9 | -34.6 | 0 | 0 | 0 | 112.7 | V384 | P382-V384 PolarHBondContact O-N 3.46Š| ||
| 383 | Y | 94.1 | Very high | 93.3 | Very high | 78 Ų | 78 | 79.1 Ų | 79.1 | 31% | 0.306 | 43% | 0.433 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.7 | 101.6 | -175.8 | -56.3 | -68.6 | 0 | 0 | 0 | 111 | R375 R381 K393 F394 A395 Q396 S397 | R375-Y383 VanDerWaalsContact NH1-CE2 3.3Å; R381-Y383 PolarHBondContact O-N 2.78Å; Y383-K393 CarbonylContact O-C 3.58Å; Y383-K393 WeakPolarHBondContact O-CA 3.48Å; Y383-F394 WeakPolarHBondContact CB-O 3.06Å; Y383-F394 WeakPolarHBondContact CD2-O 3.45Å; Y383-F394 PolarHBondContact N-O 3.12Å; Y383-F394 VanDerWaalsContact N-O 3.13Å; Y383-F394 PolarHBondContact O-N 3.46Å; Y383-A395 WeakPolarHBondContact CE2-O 3.31Å; Y383-Q396 VanDerWaalsContact CE2-C 3.48Å; Y383-S397 VanDerWaalsContact CE2-N 3.27Å |
| 384 | V | 94.8 | Very high | 93.3 | Very high | 73 Ų | 73 | 79.7 Ų | 79.7 | 44% | 0.442 | 44% | 0.435 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 140.4 | 179 | -171.4 | 0 | 0 | 0 | 0 | 110.3 | P382 K393 | P382-V384 PolarHBondContact O-N 3.46Å; V384-K393 HydrophobicContact CG1-CG 4.34Å; V384-K393 HydrophobicContact CG2-CD 4.13Å; V384-K393 HydrophobicContact CG2-CG 4.05Å |
| 385 | C | 95.3 | Very high | 93.1 | Very high | 9 Ų | 9 | 78.4 Ų | 78.4 | 6% | 0.061 | 43% | 0.43 | C | S | . | . | trans | -60.3 | 129.3 | 172.4 | -170.3 | 0 | 0 | 0 | 0 | 111.1 | F387 C390 K392 L400 H403 | C385-F387 VanDerWaalsContact C-N 3.31Å; C385-F387 PolarHBondContact O-N 2.75Å; C385-C390 HydrophobicContact CB-CB 4.22Å; C385-C390 VanDerWaalsContact SG-SG 3.69Å; C385-K392 WeakPolarHBondContact CB-O 3.49Å; C385-K392 PolarHBondContact N-O 3.15Å; C385-L400 HydrophobicContact CB-CD1 4.32Å; C385-H403 PolarHBondContact SG-NE2 2.8Å; C385-H403 VanDerWaalsContact SG-NE2 3.42Å | ||
| 386 | P | 93.5 | Very high | 92.9 | Very high | 100 Ų | 100 | 79.3 Ų | 79.3 | 65% | 0.649 | 44% | 0.436 | S | S | * | . | trans | -81.5 | -7.5 | -179.4 | 32.8 | -36.4 | 0 | 0 | 0 | 113.6 | I404 | P386-I404 HydrophobicContact CG-CD1 3.9Å; P386-I404 HydrophobicContact CG-CG1 4.31Å | ||
| 387 | F | 92.3 | Very high | 92.8 | Very high | 59 Ų | 59 | 76.7 Ų | 76.7 | 26% | 0.259 | 43% | 0.427 | S | S | . | . | S | Bend | trans | -77.8 | 129.1 | -178.9 | -71.9 | -87.8 | 0 | 0 | 0 | 111.4 | C385 G389 C390 I404 H407 | C385-F387 VanDerWaalsContact C-N 3.31Å; C385-F387 PolarHBondContact O-N 2.75Å; F387-G389 PolarHBondContact O-N 2.95Å; F387-C390 HydrophobicContact CB-CB 4.17Å; F387-C390 WeakPolarHBondContact O-CB 2.89Å; F387-C390 PolarHBondContact O-N 3.27Å; F387-I404 HydrophobicContact CD2-CG1 4.43Å; F387-I404 HydrophobicContact CE2-CB 4.18Å; F387-I404 HydrophobicContact CE2-CG1 4.04Å; F387-I404 HydrophobicContact CE2-CG2 3.85Å; F387-I404 HydrophobicContact CZ-CG2 4.41Å; F387-H407 HydrophobicContact CD1-CB 4.21Å; F387-H407 HydrophobicContact CD2-CB 3.99Å; F387-H407 AromaticContact CD2-CD2 3.5Å; F387-H407 AromaticContact CD2-CG 3.76Å; F387-H407 HydrophobicContact CE1-CB 4.04Å; F387-H407 HydrophobicContact CE2-CB 3.79Å; F387-H407 AromaticContact CE2-CD2 3.93Å; F387-H407 HydrophobicContact CG-CB 4.19Å; F387-H407 AromaticContact CG-CG 3.93Å; F387-H407 HydrophobicContact CZ-CB 3.82Å |
| 388 | D | 90.8 | Very high | 92.7 | Very high | 177 Ų | 177 | 77.8 Ų | 77.8 | 95% | 0.947 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.1 | 134.9 | 176.7 | -167.7 | 44.2 | 0 | 0 | 0 | 111.3 | C390 | D388-C390 VanDerWaalsContact C-N 3.28Å; D388-C390 PolarHBondContact O-N 2.81Å |
| 389 | G | 89 | Confident | 92.6 | Very high | 70 Ų | 70 | 75.6 Ų | 75.6 | 72% | 0.722 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.9 | -3.2 | -172.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | F387 | F387-G389 PolarHBondContact O-N 2.95Š|
| 390 | C | 92.5 | Very high | 92.7 | Very high | 16 Ų | 16 | 74.3 Ų | 74.3 | 11% | 0.108 | 40% | 0.403 | C | S | . | . | trans | -105.7 | 102 | 174.7 | -166.4 | 0 | 0 | 0 | 0 | 112.4 | C385 F387 D388 K392 H403 H407 | C385-C390 HydrophobicContact CB-CB 4.22Å; C385-C390 VanDerWaalsContact SG-SG 3.69Å; F387-C390 HydrophobicContact CB-CB 4.17Å; F387-C390 WeakPolarHBondContact O-CB 2.89Å; F387-C390 PolarHBondContact O-N 3.27Å; D388-C390 VanDerWaalsContact C-N 3.28Å; D388-C390 PolarHBondContact O-N 2.81Å; C390-K392 VanDerWaalsContact C-N 3.28Å; C390-K392 PolarHBondContact O-N 3.45Å; C390-H403 PolarHBondContact SG-NE2 3.03Å; C390-H407 VanDerWaalsContact SG-CE1 3.57Å; C390-H407 PolarHBondContact SG-NE2 2.99Å | ||
| 391 | N | 92.4 | Very high | 92.6 | Very high | 149 Ų | 149 | 77 Ų | 77 | 80% | 0.797 | 41% | 0.412 | S | S | * | . | trans | -88 | 18.1 | -178.5 | -65 | -44.7 | 0 | 0 | 0 | 114.5 | ||||
| 392 | K | 94.7 | Very high | 92.5 | Very high | 122 Ų | 122 | 74.2 Ų | 74.2 | 53% | 0.53 | 41% | 0.413 | S | S | . | . | trans | -74.9 | 133.2 | -176.8 | -66 | -175.1 | -172.7 | -178.2 | 0 | 110.7 | C385 C390 F394 | C385-K392 WeakPolarHBondContact CB-O 3.49Å; C385-K392 PolarHBondContact N-O 3.15Å; C390-K392 VanDerWaalsContact C-N 3.28Å; C390-K392 PolarHBondContact O-N 3.45Å; K392-F394 HydrophobicContact CB-CE2 3.86Å; K392-F394 HydrophobicContact CB-CZ 3.93Å | ||
| 393 | K | 95.1 | Very high | 92.6 | Very high | 110 Ų | 110 | 71.9 Ų | 71.9 | 48% | 0.478 | 40% | 0.397 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 152.2 | 177.7 | -52.7 | -171.9 | 179.5 | -179.7 | 0 | 110.9 | R381 Y383 V384 | R381-K393 HydrophobicContact CB-CB 3.72Å; R381-K393 PolarHBondContact NE-O 3.2Å; R381-K393 PolarHBondContact NH2-O 2.84Å; Y383-K393 CarbonylContact O-C 3.58Å; Y383-K393 WeakPolarHBondContact O-CA 3.48Å; V384-K393 HydrophobicContact CG1-CG 4.34Å; V384-K393 HydrophobicContact CG2-CD 4.13Å; V384-K393 HydrophobicContact CG2-CG 4.05Å |
| 394 | F | 93.3 | Very high | 92.5 | Very high | 32 Ų | 32 | 70.5 Ų | 70.5 | 14% | 0.14 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.1 | 146.4 | -175.7 | -57.2 | -89.1 | 0 | 0 | 0 | 111 | R381 Y383 K392 Q396 N399 L400 H403 | R381-F394 CarbonylContact C-O 3.46Å; R381-F394 VanDerWaalsContact C-O 3.28Å; R381-F394 VanDerWaalsContact CA-O 3.29Å; R381-F394 WeakPolarHBondContact CA-O 3.19Å; Y383-F394 WeakPolarHBondContact CB-O 3.06Å; Y383-F394 WeakPolarHBondContact CD2-O 3.45Å; Y383-F394 PolarHBondContact N-O 3.12Å; Y383-F394 VanDerWaalsContact N-O 3.13Å; Y383-F394 PolarHBondContact O-N 3.46Å; K392-F394 HydrophobicContact CB-CE2 3.86Å; K392-F394 HydrophobicContact CB-CZ 3.93Å; F394-Q396 VanDerWaalsContact C-N 3.33Å; F394-N399 HydrophobicContact CB-CB 4.25Å; F394-N399 HydrophobicContact CD1-CB 3.8Å; F394-N399 HydrophobicContact CG-CB 4.28Å; F394-L400 HydrophobicContact CB-CB 4.3Å; F394-L400 HydrophobicContact CD2-CB 3.88Å; F394-L400 HydrophobicContact CD2-CD1 3.86Å; F394-L400 HydrophobicContact CD2-CG 4.49Å; F394-L400 HydrophobicContact CE2-CD1 4.05Å; F394-L400 HydrophobicContact CG-CB 4.25Å; F394-H403 HydrophobicContact CE1-CB 4.02Å; F394-H403 HydrophobicContact CE2-CB 3.82Å; F394-H403 AromaticContact CE2-CD2 3.44Å; F394-H403 VanDerWaalsContact CE2-CD2 3.44Å; F394-H403 WeakPolarHBondContact CE2-CD2 3.41Å; F394-H403 AromaticContact CE2-CG 3.71Å; F394-H403 HydrophobicContact CZ-CB 3.37Å; F394-H403 AromaticContact CZ-CD2 3.53Å; F394-H403 AromaticContact CZ-CG 3.33Å |
| 395 | A | 90.9 | Very high | 92.3 | Very high | 24 Ų | 24 | 72 Ų | 72 | 20% | 0.198 | 40% | 0.399 | C | S | . | . | S | Bend | trans | -76.9 | -22 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | R375 Y383 | R375-A395 HydrophobicContact CB-CB 4.22Å; R375-A395 PolarHBondContact NH1-O 2.92Å; Y383-A395 WeakPolarHBondContact CE2-O 3.31Å |
| 396 | Q | 89.6 | Confident | 92.2 | Very high | 68 Ų | 68 | 74.9 Ų | 74.9 | 32% | 0.318 | 42% | 0.417 | S | S | . | . | S | Bend | trans | -126.4 | 146 | -178.2 | -58.4 | -168.6 | 2.1 | 0 | 0 | 112.8 | T372 Y383 F394 T398 N399 L400 | T372-Q396 HydrophobicContact CG2-CG 3.53Å; Y383-Q396 VanDerWaalsContact CE2-C 3.48Å; F394-Q396 VanDerWaalsContact C-N 3.33Å; Q396-T398 PolarHBondContact OE1-OG1 3.36Å; Q396-N399 HydrophobicContact CB-CB 4.46Å; Q396-N399 PolarHBondContact O-N 3.19Å; Q396-L400 PolarHBondContact O-N 3.35Å |
| 397 | S | 90.9 | Very high | 91.9 | Very high | 44 Ų | 44 | 72.2 Ų | 72.2 | 31% | 0.308 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -71.9 | -32.4 | -178.2 | 75.4 | 0 | 0 | 0 | 0 | 112.7 | Y383 L400 K401 | Y383-S397 VanDerWaalsContact CE2-N 3.27Å; S397-L400 PolarHBondContact O-N 3.24Å; S397-K401 WeakPolarHBondContact O-CG 3.28Å; S397-K401 PolarHBondContact O-N 3.29Å |
| 398 | T | 91.1 | Very high | 91.5 | Very high | 78 Ų | 78 | 71.7 Ų | 71.7 | 48% | 0.479 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -59.6 | -46.1 | 173.7 | 43.5 | 0 | 0 | 0 | 0 | 111 | Q396 L400 K401 S402 | Q396-T398 PolarHBondContact OE1-OG1 3.36Å; T398-L400 VanDerWaalsContact C-N 3.35Å; T398-L400 PolarHBondContact O-N 3.28Å; T398-K401 PolarHBondContact O-N 3.24Å; T398-S402 PolarHBondContact O-N 2.83Å |
| 399 | N | 92.2 | Very high | 90.7 | Very high | 47 Ų | 47 | 70.5 Ų | 70.5 | 25% | 0.251 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -64.3 | -40.7 | 177.4 | -64.3 | 16.1 | 0 | 0 | 0 | 111.2 | F394 Q396 H403 | F394-N399 HydrophobicContact CB-CB 4.25Å; F394-N399 HydrophobicContact CD1-CB 3.8Å; F394-N399 HydrophobicContact CG-CB 4.28Å; Q396-N399 HydrophobicContact CB-CB 4.46Å; Q396-N399 PolarHBondContact O-N 3.19Å; N399-H403 WeakPolarHBondContact O-CB 3.46Å; N399-H403 PolarHBondContact O-N 3.28Å |
| 400 | L | 94.2 | Very high | 89.7 | Confident | 23 Ų | 23 | 70.2 Ų | 70.2 | 12% | 0.12 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -60.6 | -47.1 | 172.3 | 170.9 | 63.1 | 0 | 0 | 0 | 111.5 | C385 F394 Q396 S397 T398 S402 H403 I404 | C385-L400 HydrophobicContact CB-CD1 4.32Å; F394-L400 HydrophobicContact CB-CB 4.3Å; F394-L400 HydrophobicContact CD2-CB 3.88Å; F394-L400 HydrophobicContact CD2-CD1 3.86Å; F394-L400 HydrophobicContact CD2-CG 4.49Å; F394-L400 HydrophobicContact CE2-CD1 4.05Å; F394-L400 HydrophobicContact CG-CB 4.25Å; Q396-L400 PolarHBondContact O-N 3.35Å; S397-L400 PolarHBondContact O-N 3.24Å; T398-L400 VanDerWaalsContact C-N 3.35Å; T398-L400 PolarHBondContact O-N 3.28Å; L400-S402 PolarHBondContact O-N 3.31Å; L400-H403 WeakPolarHBondContact O-CB 3.15Å; L400-H403 PolarHBondContact O-N 3.26Å; L400-I404 HydrophobicContact CD1-CD1 3.85Å; L400-I404 HydrophobicContact CD1-CG1 4Å; L400-I404 HydrophobicContact CD2-CD1 4.36Å; L400-I404 HydrophobicContact CG-CD1 3.81Å; L400-I404 HydrophobicContact CG-CG1 4.39Å; L400-I404 WeakPolarHBondContact O-CG1 3.34Å; L400-I404 PolarHBondContact O-N 2.82Å |
| 401 | K | 92.4 | Very high | 88.1 | Confident | 135 Ų | 135 | 76 Ų | 76 | 59% | 0.587 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -59.9 | -46.6 | 179.3 | -73.7 | 172.4 | -175.7 | 177.2 | 0 | 111.6 | S397 T398 H403 I404 L405 | S397-K401 WeakPolarHBondContact O-CG 3.28Å; S397-K401 PolarHBondContact O-N 3.29Å; T398-K401 PolarHBondContact O-N 3.24Å; K401-H403 VanDerWaalsContact C-N 3.32Å; K401-H403 PolarHBondContact O-N 3.5Å; K401-I404 WeakPolarHBondContact O-CB 3.37Å; K401-I404 PolarHBondContact O-N 2.85Å; K401-L405 WeakPolarHBondContact O-CG 3.35Å; K401-L405 PolarHBondContact O-N 3.08Å |
| 402 | S | 92.1 | Very high | 86.5 | Confident | 79 Ų | 79 | 75.7 Ų | 75.7 | 55% | 0.552 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -60.4 | -43.1 | 175.7 | -176.5 | 0 | 0 | 0 | 0 | 111.5 | T398 L400 I404 L405 | T398-S402 PolarHBondContact O-N 2.83Å; L400-S402 PolarHBondContact O-N 3.31Å; S402-I404 PolarHBondContact O-N 3.13Å; S402-L405 WeakPolarHBondContact O-CB 3.49Å; S402-L405 PolarHBondContact O-N 2.91Å |
| 403 | H | 92.9 | Very high | 84.3 | Confident | 17 Ų | 17 | 77.4 Ų | 77.4 | 8% | 0.079 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -61.4 | -43.7 | 174.4 | 172.9 | 53.2 | 0 | 0 | 0 | 112.8 | C385 C390 F394 N399 L400 K401 L405 T406 H407 | C385-H403 PolarHBondContact SG-NE2 2.8Å; C385-H403 VanDerWaalsContact SG-NE2 3.42Å; C390-H403 PolarHBondContact SG-NE2 3.03Å; F394-H403 HydrophobicContact CE1-CB 4.02Å; F394-H403 HydrophobicContact CE2-CB 3.82Å; F394-H403 AromaticContact CE2-CD2 3.44Å; F394-H403 VanDerWaalsContact CE2-CD2 3.44Å; F394-H403 WeakPolarHBondContact CE2-CD2 3.41Å; F394-H403 AromaticContact CE2-CG 3.71Å; F394-H403 HydrophobicContact CZ-CB 3.37Å; F394-H403 AromaticContact CZ-CD2 3.53Å; F394-H403 AromaticContact CZ-CG 3.33Å; N399-H403 WeakPolarHBondContact O-CB 3.46Å; N399-H403 PolarHBondContact O-N 3.28Å; L400-H403 WeakPolarHBondContact O-CB 3.15Å; L400-H403 PolarHBondContact O-N 3.26Å; K401-H403 VanDerWaalsContact C-N 3.32Å; K401-H403 PolarHBondContact O-N 3.5Å; H403-L405 PolarHBondContact O-N 3.25Å; H403-T406 PolarHBondContact ND1-OG1 2.73Å; H403-T406 WeakPolarHBondContact O-CB 3.38Å; H403-T406 PolarHBondContact O-N 3.23Å; H403-T406 PolarHBondContact O-OG1 3.24Å; H403-H407 AromaticContact CE1-CD2 3.75Å; H403-H407 AromaticContact CE1-NE2 3.18Å; H403-H407 PolarHBondContact CE1-NE2 2.99Å; H403-H407 AromaticContact NE2-CD2 3.63Å; H403-H407 AromaticContact NE2-NE2 2.99Å; H403-H407 PolarHBondContact NE2-NE2 3.11Å |
| 404 | I | 91.9 | Very high | 81.9 | Confident | 49 Ų | 49 | 83 Ų | 83 | 25% | 0.251 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -55.3 | -38.9 | 176.4 | -78.5 | 168.6 | 0 | 0 | 0 | 111.2 | P386 F387 L400 K401 S402 T406 H407 A408 | P386-I404 HydrophobicContact CG-CD1 3.9Å; P386-I404 HydrophobicContact CG-CG1 4.31Å; F387-I404 HydrophobicContact CD2-CG1 4.43Å; F387-I404 HydrophobicContact CE2-CB 4.18Å; F387-I404 HydrophobicContact CE2-CG1 4.04Å; F387-I404 HydrophobicContact CE2-CG2 3.85Å; F387-I404 HydrophobicContact CZ-CG2 4.41Å; L400-I404 HydrophobicContact CD1-CD1 3.85Å; L400-I404 HydrophobicContact CD1-CG1 4Å; L400-I404 HydrophobicContact CD2-CD1 4.36Å; L400-I404 HydrophobicContact CG-CD1 3.81Å; L400-I404 HydrophobicContact CG-CG1 4.39Å; L400-I404 WeakPolarHBondContact O-CG1 3.34Å; L400-I404 PolarHBondContact O-N 2.82Å; K401-I404 WeakPolarHBondContact O-CB 3.37Å; K401-I404 PolarHBondContact O-N 2.85Å; S402-I404 PolarHBondContact O-N 3.13Å; I404-T406 PolarHBondContact O-N 2.91Å; I404-H407 WeakPolarHBondContact O-CB 3.12Å; I404-H407 PolarHBondContact O-N 2.97Å; I404-H407 VanDerWaalsContact O-N 3.13Å; I404-A408 PolarHBondContact O-N 3.08Å |
| 405 | L | 91.9 | Very high | 81.3 | Confident | 104 Ų | 104 | 85.6 Ų | 85.6 | 55% | 0.545 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.2 | -26.3 | 176.6 | -64.5 | 173.5 | 0 | 0 | 0 | 113 | K401 S402 H403 H407 A408 K409 | K401-L405 WeakPolarHBondContact O-CG 3.35Å; K401-L405 PolarHBondContact O-N 3.08Å; S402-L405 WeakPolarHBondContact O-CB 3.49Å; S402-L405 PolarHBondContact O-N 2.91Å; H403-L405 PolarHBondContact O-N 3.25Å; L405-H407 VanDerWaalsContact C-N 3.31Å; L405-H407 PolarHBondContact O-N 3.43Å; L405-A408 PolarHBondContact O-N 3.1Å; L405-K409 WeakPolarHBondContact O-CG 3.33Å; L405-K409 PolarHBondContact O-N 2.9Å |
| 406 | T | 92.6 | Very high | 80.8 | Confident | 70 Ų | 70 | 88.8 Ų | 88.8 | 43% | 0.429 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -66.9 | -33.3 | 175.7 | 70.6 | 0 | 0 | 0 | 0 | 112.3 | H403 I404 K409 A410 | H403-T406 PolarHBondContact ND1-OG1 2.73Å; H403-T406 WeakPolarHBondContact O-CB 3.38Å; H403-T406 PolarHBondContact O-N 3.23Å; H403-T406 PolarHBondContact O-OG1 3.24Å; I404-T406 PolarHBondContact O-N 2.91Å; T406-K409 PolarHBondContact O-N 3.07Å; T406-A410 WeakPolarHBondContact O-CB 3.35Å; T406-A410 PolarHBondContact O-N 3.32Å |
| 407 | H | 87.9 | Confident | 80.3 | Confident | 43 Ų | 43 | 90 Ų | 90 | 20% | 0.199 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -68.8 | -38.4 | 173.9 | -69.6 | -73.9 | 0 | 0 | 0 | 111.9 | F387 C390 H403 I404 L405 A410 K411 | F387-H407 HydrophobicContact CD1-CB 4.21Å; F387-H407 HydrophobicContact CD2-CB 3.99Å; F387-H407 AromaticContact CD2-CD2 3.5Å; F387-H407 AromaticContact CD2-CG 3.76Å; F387-H407 HydrophobicContact CE1-CB 4.04Å; F387-H407 HydrophobicContact CE2-CB 3.79Å; F387-H407 AromaticContact CE2-CD2 3.93Å; F387-H407 HydrophobicContact CG-CB 4.19Å; F387-H407 AromaticContact CG-CG 3.93Å; F387-H407 HydrophobicContact CZ-CB 3.82Å; C390-H407 VanDerWaalsContact SG-CE1 3.57Å; C390-H407 PolarHBondContact SG-NE2 2.99Å; H403-H407 AromaticContact CE1-CD2 3.75Å; H403-H407 AromaticContact CE1-NE2 3.18Å; H403-H407 PolarHBondContact CE1-NE2 2.99Å; H403-H407 AromaticContact NE2-CD2 3.63Å; H403-H407 AromaticContact NE2-NE2 2.99Å; H403-H407 PolarHBondContact NE2-NE2 3.11Å; I404-H407 WeakPolarHBondContact O-CB 3.12Å; I404-H407 PolarHBondContact O-N 2.97Å; I404-H407 VanDerWaalsContact O-N 3.13Å; L405-H407 VanDerWaalsContact C-N 3.31Å; L405-H407 PolarHBondContact O-N 3.43Å; H407-A410 PolarHBondContact O-N 3.31Å; H407-K411 WeakPolarHBondContact O-CG 3.18Å; H407-K411 PolarHBondContact O-N 2.89Å |
| 408 | A | 82.5 | Confident | 79.7 | Confident | 49 Ų | 49 | 92.7 Ų | 92.7 | 41% | 0.405 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.4 | -40.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | I404 L405 K411 N412 | I404-A408 PolarHBondContact O-N 3.08Å; L405-A408 PolarHBondContact O-N 3.1Å; A408-K411 PolarHBondContact O-N 3.03Å; A408-N412 PolarHBondContact O-N 2.87Å |
| 409 | K | 75.2 | Confident | 79 | Confident | 152 Ų | 152 | 93.6 Ų | 93.6 | 66% | 0.661 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -67 | -37.4 | 176 | -70 | 177.4 | -177.8 | -177.5 | 0 | 112.5 | L405 T406 K411 N412 | L405-K409 WeakPolarHBondContact O-CG 3.33Å; L405-K409 PolarHBondContact O-N 2.9Å; T406-K409 PolarHBondContact O-N 3.07Å; K409-K411 VanDerWaalsContact C-N 3.32Å; K409-K411 PolarHBondContact O-N 3.14Å; K409-N412 PolarHBondContact O-N 3.09Å |
| 410 | A | 66.5 | Low | 78.1 | Confident | 64 Ų | 64 | 96.7 Ų | 96.7 | 53% | 0.529 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.6 | -33.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | T406 H407 | T406-A410 WeakPolarHBondContact O-CB 3.35Å; T406-A410 PolarHBondContact O-N 3.32Å; H407-A410 PolarHBondContact O-N 3.31Å |
| 411 | K | 60.5 | Low | 77 | Confident | 138 Ų | 138 | 102 Ų | 102 | 60% | 0.6 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -75.7 | -23 | 178.2 | -72.7 | -177.2 | 179.8 | -172.9 | 0 | 114.7 | H407 A408 K409 | H407-K411 WeakPolarHBondContact O-CG 3.18Å; H407-K411 PolarHBondContact O-N 2.89Å; A408-K411 PolarHBondContact O-N 3.03Å; K409-K411 VanDerWaalsContact C-N 3.32Å; K409-K411 PolarHBondContact O-N 3.14Å |
| 412 | N | 57.3 | Low | 75.8 | Confident | 141 Ų | 141 | 99.5 Ų | 99.5 | 75% | 0.754 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -88.4 | -9.4 | 179.3 | -80.9 | -6.6 | 0 | 0 | 0 | 113.7 | A408 K409 | A408-N412 PolarHBondContact O-N 2.87Å; K409-N412 PolarHBondContact O-N 3.09Å |
| 413 | N | 50.1 | Low | 74.4 | Confident | 158 Ų | 158 | 101.2 Ų | 101.2 | 85% | 0.845 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.2 | 13.8 | 179 | -96.6 | -0.3 | 0 | 0 | 0 | 112.9 | ||
| 414 | Q | 43.9 | Very low | 72.8 | Confident | 229 Ų | 229 | 108.8 Ų | 108.8 | 100% | 1.07 | 57% | 0.572 | S | S | * | * | trans | -124.9 | 0 | 177.2 | -170.4 | 160.1 | 30.2 | 0 | 0 | 108.7 |
Retrieved 414 of 414 residues in 152.5 ms
(Link to these results)