| 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 | 53.3 | Low | 51.3 | Low | 254 Ų | 254 | 133.9 Ų | 133.9 | 100% | 1.251 | 88% | 0.884 | S | S | * | * | 0 | 109 | 0 | -78.8 | 179.6 | 176.3 | 0 | 0 | 106.7 | |||||
| 2 | A | 40.4 | Very low | 52.4 | Low | 96 Ų | 96 | 135.3 Ų | 135.3 | 79% | 0.793 | 88% | 0.877 | S | S | * | * | trans | -117.5 | 131.1 | -177.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 3 | T | 54 | Low | 53.5 | Low | 149 Ų | 149 | 136.1 Ų | 136.1 | 91% | 0.914 | 87% | 0.869 | S | S | * | * | trans | -140.3 | 102.3 | 167.1 | 44.4 | 0 | 0 | 0 | 0 | 108 | ||||
| 4 | L | 42.5 | Very low | 54.3 | Low | 169 Ų | 169 | 140 Ų | 140 | 89% | 0.885 | 87% | 0.867 | S | S | * | * | trans | -90.8 | 128.3 | 160.1 | -68.2 | 165.9 | 0 | 0 | 0 | 107.3 | ||||
| 5 | S | 51.7 | Low | 55 | Low | 134 Ų | 134 | 140.8 Ų | 140.8 | 94% | 0.937 | 86% | 0.864 | S | S | * | * | trans | 179.4 | 135.4 | 159.2 | -77.9 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 6 | G | 51.5 | Low | 55.2 | Low | 75 Ų | 75 | 140.6 Ų | 140.6 | 77% | 0.773 | 86% | 0.862 | S | S | * | * | cis | -167.9 | 148.3 | 3.7 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 7 | G | 42.5 | Very low | 55.6 | Low | 84 Ų | 84 | 141.1 Ų | 141.1 | 87% | 0.866 | 86% | 0.857 | S | S | * | * | trans | -76.2 | 146.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 8 | S | 59.2 | Low | 55.7 | Low | 122 Ų | 122 | 139.8 Ų | 139.8 | 85% | 0.853 | 85% | 0.852 | S | S | * | * | trans | -137.5 | 114.9 | 161.2 | -128.5 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 9 | C | 45.9 | Very low | 55.4 | Low | 137 Ų | 137 | 141.7 Ų | 141.7 | 93% | 0.926 | 85% | 0.85 | S | S | * | * | trans | -93.8 | 127.6 | 165.9 | -66.5 | 0 | 0 | 0 | 0 | 107 | ||||
| 10 | S | 64.3 | Low | 55 | Low | 102 Ų | 102 | 142.6 Ų | 142.6 | 71% | 0.713 | 85% | 0.85 | S | S | * | * | trans | -130.8 | 107.5 | 168.4 | 52.3 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 11 | D | 58.9 | Low | 54.9 | Low | 151 Ų | 151 | 144.7 Ų | 144.7 | 81% | 0.807 | 85% | 0.851 | S | S | * | * | 68.3 | 83.1 | 111.2 | -91.4 | -16.4 | 0 | 0 | 0 | 111.8 | D13 | D11-D13 PolarHBondContact O-N 3.37Š| |||
| 12 | D | 64.2 | Low | 54.6 | Low | 150 Ų | 150 | 139.8 Ų | 139.8 | 80% | 0.802 | 83% | 0.83 | S | S | * | * | trans | -82.4 | 95.1 | 161.3 | -76.3 | -44.4 | 0 | 0 | 0 | 107.7 | F14 | D12-F14 PolarHBondContact O-N 3.13Š| ||
| 13 | D | 67.5 | Low | 54.6 | Low | 146 Ų | 146 | 142 Ų | 142 | 78% | 0.781 | 83% | 0.828 | S | S | * | * | trans | -63.4 | 109.1 | 165.1 | -81.5 | -40.6 | 0 | 0 | 0 | 109 | D11 D15 | D11-D13 PolarHBondContact O-N 3.37Å; D13-D15 PolarHBondContact O-N 3.18Å | ||
| 14 | F | 64.4 | Low | 54.2 | Low | 191 Ų | 191 | 140.2 Ų | 140.2 | 84% | 0.838 | 82% | 0.821 | S | S | * | * | trans | -80.6 | 103 | 163.7 | -82.8 | -92 | 0 | 0 | 0 | 108.4 | D12 V16 | D12-F14 PolarHBondContact O-N 3.13Å; F14-V16 PolarHBondContact O-N 2.83Å; F14-V16 VanDerWaalsContact O-N 3.1Å | ||
| 15 | D | 64.4 | Low | 54.6 | Low | 152 Ų | 152 | 138.1 Ų | 138.1 | 81% | 0.813 | 82% | 0.815 | S | S | * | * | trans | -62.1 | 108.2 | 167.1 | -83.9 | -41 | 0 | 0 | 0 | 109.9 | D13 L17 | D13-D15 PolarHBondContact O-N 3.18Å; D15-L17 PolarHBondContact O-N 3.2Å | ||
| 16 | V | 58.4 | Low | 54.3 | Low | 138 Ų | 138 | 137.6 Ų | 137.6 | 84% | 0.836 | 80% | 0.801 | S | S | * | * | trans | -76.4 | 103.1 | 166.7 | 176.5 | 0 | 0 | 0 | 0 | 107.3 | F14 | F14-V16 PolarHBondContact O-N 2.83Å; F14-V16 VanDerWaalsContact O-N 3.1Å | ||
| 17 | L | 61.6 | Low | 54.3 | Low | 148 Ų | 148 | 142.2 Ų | 142.2 | 78% | 0.775 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 143.8 | 168.2 | -71.2 | 176.8 | 0 | 0 | 0 | 110.4 | D15 | D15-L17 PolarHBondContact O-N 3.2Š|
| 18 | P | 58.1 | Low | 54.5 | Low | 119 Ų | 119 | 147 Ų | 147 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -71 | 142.6 | -170.3 | 28.4 | -33.6 | 0 | 0 | 0 | 112.6 | ||
| 19 | E | 49.2 | Very low | 53.9 | Low | 176 Ų | 176 | 148.2 Ų | 148.2 | 82% | 0.822 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 148.8 | 164.8 | -59.2 | -179.1 | 160.3 | 0 | 0 | 109.5 | ||
| 20 | D | 48.3 | Very low | 53.9 | Low | 158 Ų | 158 | 146.2 Ų | 146.2 | 85% | 0.845 | 78% | 0.779 | S | S | * | * | trans | 90.3 | 96.6 | 173.2 | -51.7 | -32.7 | 0 | 0 | 0 | 117.4 | ||||
| 21 | E | 53.4 | Low | 53.1 | Low | 187 Ų | 187 | 149.6 Ų | 149.6 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | -168.9 | 105.3 | 129.2 | -104.8 | 175.5 | 178.8 | 0 | 0 | 111.3 | |||||
| 22 | D | 45.5 | Very low | 52.4 | Low | 152 Ų | 152 | 151.4 Ų | 151.4 | 81% | 0.813 | 79% | 0.787 | S | S | * | * | trans | 36 | 85.4 | 149.7 | -64.6 | -26.6 | 0 | 0 | 0 | 120.3 | S24 | D22-S24 PolarHBondContact O-N 2.97Š| ||
| 23 | I | 41.7 | Very low | 51.5 | Low | 143 Ų | 143 | 151.7 Ų | 151.7 | 73% | 0.733 | 79% | 0.787 | S | S | * | * | trans | -86.7 | 89.8 | 162 | -40.7 | 167.3 | 0 | 0 | 0 | 108.5 | L26 | I23-L26 HydrophobicContact CG2-CB 3.98Š| ||
| 24 | S | 45.8 | Very low | 50.5 | Low | 110 Ų | 110 | 150.8 Ų | 150.8 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | trans | -115.1 | 19.3 | 174.3 | -80.2 | 0 | 0 | 0 | 0 | 114.6 | D22 | D22-S24 PolarHBondContact O-N 2.97Š| ||
| 25 | T | 51.2 | Low | 49.3 | Very low | 126 Ų | 126 | 144.8 Ų | 144.8 | 77% | 0.773 | 78% | 0.779 | S | S | * | * | trans | -135.4 | 13.9 | -177.7 | 54.1 | 0 | 0 | 0 | 0 | 115.7 | E27 | T25-E27 PolarHBondContact O-N 3.36Š| ||
| 26 | L | 45.5 | Very low | 48.2 | Very low | 122 Ų | 122 | 141.9 Ų | 141.9 | 64% | 0.639 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.2 | 20.9 | -177.3 | -151.7 | 75.8 | 0 | 0 | 0 | 114.8 | I23 | I23-L26 HydrophobicContact CG2-CB 3.98Š|
| 27 | E | 51.3 | Low | 47.8 | Very low | 173 Ų | 173 | 144.1 Ų | 144.1 | 81% | 0.808 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | -12.1 | 175 | -82.7 | -174.9 | 149.1 | 0 | 0 | 114.1 | T25 | T25-E27 PolarHBondContact O-N 3.36Š|
| 28 | E | 46 | Very low | 47.3 | Very low | 183 Ų | 183 | 143.2 Ų | 143.2 | 86% | 0.855 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -101.8 | -3.5 | -176.7 | -90 | -179.7 | 152.6 | 0 | 0 | 115.8 | ||
| 29 | L | 46.3 | Very low | 47 | Very low | 148 Ų | 148 | 140.2 Ų | 140.2 | 78% | 0.775 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -107.6 | 3.4 | 176.3 | -77.2 | 166.5 | 0 | 0 | 0 | 114.2 | ||
| 30 | N | 47.3 | Very low | 47.4 | Very low | 96 Ų | 96 | 136.5 Ų | 136.5 | 51% | 0.513 | 74% | 0.743 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -95.8 | 6.8 | -172.9 | -135.9 | -3.5 | 0 | 0 | 0 | 114.6 | V34 | N30-V34 WeakPolarHBondContact O-CG2 3.45Š|
| 31 | H | 46.1 | Very low | 47.6 | Very low | 172 Ų | 172 | 131.6 Ų | 131.6 | 80% | 0.796 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.8 | 1 | 178.8 | -68.6 | -45.7 | 0 | 0 | 0 | 114.9 | ||
| 32 | Q | 44.9 | Very low | 47.7 | Very low | 190 Ų | 190 | 128 Ų | 128 | 89% | 0.888 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -115.8 | -0.8 | 178.9 | -141.8 | 150.6 | 34.6 | 0 | 0 | 113.9 | ||
| 33 | L | 45.7 | Very low | 48.1 | Very low | 155 Ų | 155 | 125.7 Ų | 125.7 | 81% | 0.812 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -119.3 | 21.2 | 177.8 | -139.9 | 85.4 | 0 | 0 | 0 | 113.3 | ||
| 34 | V | 45.1 | Very low | 48.8 | Very low | 127 Ų | 127 | 122.1 Ų | 122.1 | 77% | 0.77 | 68% | 0.677 | S | S | * | * | trans | -107.7 | 41.9 | 171.8 | -172.4 | 0 | 0 | 0 | 0 | 109.5 | N30 | N30-V34 WeakPolarHBondContact O-CG2 3.45Š| ||
| 35 | G | 39.1 | Very low | 49 | Very low | 66 Ų | 66 | 121.4 Ų | 121.4 | 68% | 0.68 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -119.7 | 110 | 176.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||
| 36 | S | 42.5 | Very low | 49.1 | Very low | 90 Ų | 90 | 121.6 Ų | 121.6 | 63% | 0.629 | 66% | 0.659 | S | S | * | * | trans | 80.1 | 62.2 | 167.8 | -160.6 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 37 | M | 48.9 | Very low | 49.4 | Very low | 186 Ų | 186 | 118.9 Ų | 118.9 | 92% | 0.916 | 66% | 0.66 | S | S | * | * | trans | -79.6 | 2.9 | 148.6 | -79 | -153.4 | 95.4 | 0 | 0 | 112.8 | S39 | M37-S39 PolarHBondContact O-N 3.49Å; M37-S39 VanDerWaalsContact O-N 3.17Å | ||
| 38 | D | 51 | Low | 49.3 | Very low | 129 Ų | 129 | 117.8 Ų | 117.8 | 69% | 0.69 | 66% | 0.659 | S | S | * | * | trans | -87.3 | 46.3 | 174.6 | -68.9 | -42 | 0 | 0 | 0 | 112.3 | P40 | D38-P40 WeakPolarHBondContact O-CD 3.34Š| ||
| 39 | S | 52.7 | Low | 49.4 | Very low | 55 Ų | 55 | 117.4 Ų | 117.4 | 39% | 0.385 | 65% | 0.654 | S | S | . | * | trans | -69.8 | 114 | 169.7 | -68.1 | 0 | 0 | 0 | 0 | 108.6 | M37 L41 M42 | M37-S39 PolarHBondContact O-N 3.49Å; M37-S39 VanDerWaalsContact O-N 3.17Å; S39-L41 PolarHBondContact O-N 2.85Å; S39-M42 PolarHBondContact O-N 3.18Å | ||
| 40 | P | 56.7 | Low | 49 | Very low | 99 Ų | 99 | 116.3 Ų | 116.3 | 64% | 0.643 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -58 | -16.9 | -177.7 | 20.6 | -31.9 | 0 | 0 | 0 | 113.5 | D38 S44 | D38-P40 WeakPolarHBondContact O-CD 3.34Å; P40-S44 WeakPolarHBondContact O-CB 3.49Å; P40-S44 PolarHBondContact O-N 3.39Å; P40-S44 PolarHBondContact O-OG 3.39Å |
| 41 | L | 53 | Low | 48.4 | Very low | 54 Ų | 54 | 117.1 Ų | 117.1 | 28% | 0.283 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -69.6 | -40.3 | 174.2 | -157.7 | 117.1 | 0 | 0 | 0 | 113 | S39 N43 S44 I45 Q165 | S39-L41 PolarHBondContact O-N 2.85Å; L41-N43 VanDerWaalsContact C-N 3.35Å; L41-S44 PolarHBondContact O-N 3.31Å; L41-I45 HydrophobicContact CD2-CD1 3.67Å; L41-I45 HydrophobicContact CG-CD1 4.16Å; L41-I45 VanDerWaalsContact O-CG1 3.29Å; L41-I45 WeakPolarHBondContact O-CG1 3.33Å; L41-I45 PolarHBondContact O-N 3.06Å; L41-Q165 HydrophobicContact CD1-CB 4.28Å; L41-Q165 HydrophobicContact CD1-CG 3.73Å; L41-Q165 VanDerWaalsContact CD1-OE1 3.32Å |
| 42 | M | 56.2 | Low | 48 | Very low | 113 Ų | 113 | 115.1 Ų | 115.1 | 56% | 0.557 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -70.1 | -34.6 | 177.4 | -76.1 | -64.2 | -69.9 | 0 | 0 | 111.7 | S39 L46 | S39-M42 PolarHBondContact O-N 3.18Å; M42-L46 WeakPolarHBondContact O-CG 3.38Å; M42-L46 PolarHBondContact O-N 3.27Å |
| 43 | N | 53.4 | Low | 48 | Very low | 103 Ų | 103 | 111.8 Ų | 111.8 | 55% | 0.551 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -70.8 | -33.3 | 172.4 | -70.8 | -27.2 | 0 | 0 | 0 | 112.1 | L41 G47 | L41-N43 VanDerWaalsContact C-N 3.35Å; N43-G47 PolarHBondContact O-N 2.84Å |
| 44 | S | 57 | Low | 47.5 | Very low | 68 Ų | 68 | 111.8 Ų | 111.8 | 48% | 0.476 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -72.8 | -37.1 | 175.9 | -62.6 | 0 | 0 | 0 | 0 | 113.1 | P40 L41 G47 L48 | P40-S44 WeakPolarHBondContact O-CB 3.49Å; P40-S44 PolarHBondContact O-N 3.39Å; P40-S44 PolarHBondContact O-OG 3.39Å; L41-S44 PolarHBondContact O-N 3.31Å; S44-G47 PolarHBondContact O-N 2.81Å; S44-L48 WeakPolarHBondContact O-CD1 3.49Å; S44-L48 WeakPolarHBondContact O-CG 3.49Å; S44-L48 PolarHBondContact O-N 3.14Å |
| 45 | I | 50.1 | Low | 47.1 | Very low | 95 Ų | 95 | 111.7 Ų | 111.7 | 49% | 0.487 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -73.5 | -32.4 | 179.3 | -67.5 | 167.6 | 0 | 0 | 0 | 111.5 | L41 | L41-I45 HydrophobicContact CD2-CD1 3.67Å; L41-I45 HydrophobicContact CG-CD1 4.16Å; L41-I45 VanDerWaalsContact O-CG1 3.29Å; L41-I45 WeakPolarHBondContact O-CG1 3.33Å; L41-I45 PolarHBondContact O-N 3.06Å |
| 46 | L | 53 | Low | 47.2 | Very low | 130 Ų | 130 | 114.2 Ų | 114.2 | 68% | 0.681 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -74.9 | -24.4 | 173.1 | -70.9 | 170.7 | 0 | 0 | 0 | 112.9 | M42 | M42-L46 WeakPolarHBondContact O-CG 3.38Å; M42-L46 PolarHBondContact O-N 3.27Å |
| 47 | G | 51.2 | Low | 47.2 | Very low | 64 Ų | 64 | 114.1 Ų | 114.1 | 66% | 0.66 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -11 | 176.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | N43 S44 | N43-G47 PolarHBondContact O-N 2.84Å; S44-G47 PolarHBondContact O-N 2.81Å |
| 48 | L | 48.7 | Very low | 47.2 | Very low | 150 Ų | 150 | 115.2 Ų | 115.2 | 79% | 0.785 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.5 | 9.4 | -174.1 | -72.2 | 168.5 | 0 | 0 | 0 | 114.6 | S44 | S44-L48 WeakPolarHBondContact O-CD1 3.49Å; S44-L48 WeakPolarHBondContact O-CG 3.49Å; S44-L48 PolarHBondContact O-N 3.14Å |
| 49 | K | 48.5 | Very low | 46.7 | Very low | 176 Ų | 176 | 116.9 Ų | 116.9 | 77% | 0.765 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -99.4 | 115.6 | 174.1 | -99.2 | 170.8 | 172.5 | 170.3 | 0 | 111.2 | ||
| 50 | C | 37.7 | Very low | 46.2 | Very low | 124 Ų | 124 | 117.7 Ų | 117.7 | 84% | 0.838 | 71% | 0.707 | S | S | * | * | trans | 79.6 | 99.7 | 160.9 | -57.9 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 51 | S | 35.5 | Very low | 45.4 | Very low | 113 Ų | 113 | 124 Ų | 124 | 79% | 0.79 | 72% | 0.718 | S | S | * | * | -169.4 | 83.2 | 122.1 | 40.9 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 52 | T | 37.6 | Very low | 45.1 | Very low | 131 Ų | 131 | 128.8 Ų | 128.8 | 80% | 0.804 | 74% | 0.742 | S | S | * | * | trans | -68.4 | 131 | 138.5 | 43.4 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 53 | T | 43.7 | Very low | 44.3 | Very low | 120 Ų | 120 | 128.8 Ų | 128.8 | 74% | 0.736 | 75% | 0.751 | S | S | * | * | S | Bend | trans | 92.9 | 126.5 | 174.2 | 70.4 | 0 | 0 | 0 | 0 | 117.4 | ||
| 54 | D | 35.8 | Very low | 44 | Very low | 155 Ų | 155 | 129.6 Ų | 129.6 | 83% | 0.829 | 76% | 0.764 | S | S | * | * | trans | 70.1 | 103.7 | 158.2 | -67.7 | -19.4 | 0 | 0 | 0 | 120.9 | S56 | D54-S56 PolarHBondContact O-N 3.27Š| ||
| 55 | S | 37.9 | Very low | 43.3 | Very low | 125 Ų | 125 | 133.2 Ų | 133.2 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | trans | -36.2 | 115.3 | 146.4 | -38.4 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 56 | S | 40.9 | Very low | 42.9 | Very low | 118 Ų | 118 | 134.1 Ų | 134.1 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | trans | -164.9 | 125.6 | 145.5 | -161.5 | 0 | 0 | 0 | 0 | 111.2 | D54 | D54-S56 PolarHBondContact O-N 3.27Š| ||
| 57 | A | 42 | Very low | 43.1 | Very low | 89 Ų | 89 | 133.5 Ų | 133.5 | 74% | 0.736 | 80% | 0.802 | S | S | * | * | trans | -54.1 | 144.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 58 | K | 48.7 | Very low | 42.8 | Very low | 208 Ų | 208 | 136.6 Ų | 136.6 | 90% | 0.904 | 81% | 0.811 | S | S | * | * | -160.2 | 123.8 | 124.6 | -109.4 | 174 | -174.1 | -175.2 | 0 | 112.9 | |||||
| 59 | D | 40.5 | Very low | 42.6 | Very low | 165 Ų | 165 | 137.1 Ų | 137.1 | 88% | 0.882 | 81% | 0.813 | S | S | * | * | trans | -44.8 | 135.7 | 166.9 | -152.6 | -8.2 | 0 | 0 | 0 | 112.7 | ||||
| 60 | G | 41.4 | Very low | 42.2 | Very low | 72 Ų | 72 | 136.2 Ų | 136.2 | 74% | 0.742 | 82% | 0.816 | S | S | * | * | trans | -158 | 57.3 | -171.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | I62 | G60-I62 PolarHBondContact O-N 2.88Š| ||
| 61 | R | 40.6 | Very low | 42.5 | Very low | 230 Ų | 230 | 136.1 Ų | 136.1 | 87% | 0.868 | 82% | 0.816 | S | S | * | * | trans | -55.6 | 121 | 171.2 | 171.9 | -174 | -99.3 | 176.3 | -6.8 | 112.1 | ||||
| 62 | I | 46.1 | Very low | 42.7 | Very low | 156 Ų | 156 | 138.2 Ų | 138.2 | 80% | 0.8 | 82% | 0.818 | S | S | * | * | trans | -137.3 | 127.2 | 150 | -55.4 | -179.7 | 0 | 0 | 0 | 107.8 | G60 | G60-I62 PolarHBondContact O-N 2.88Š| ||
| 63 | P | 40.7 | Very low | 43.2 | Very low | 113 Ų | 113 | 140.7 Ų | 140.7 | 73% | 0.734 | 83% | 0.825 | S | S | * | * | trans | -89 | 135.1 | -172.6 | 33.6 | -30.1 | 0 | 0 | 0 | 111.8 | ||||
| 64 | S | 46.3 | Very low | 43.1 | Very low | 119 Ų | 119 | 142 Ų | 142 | 83% | 0.832 | 83% | 0.828 | S | S | * | * | trans | -106.5 | 115.9 | 168.5 | -60.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 65 | T | 42.1 | Very low | 43.7 | Very low | 144 Ų | 144 | 142 Ų | 142 | 88% | 0.883 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 131.8 | 170 | 34.3 | 0 | 0 | 0 | 0 | 113.4 | ||
| 66 | S | 42.7 | Very low | 43.8 | Very low | 115 Ų | 115 | 141 Ų | 141 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -96.4 | 145.1 | 168.1 | 37 | 0 | 0 | 0 | 0 | 111.7 | ||
| 67 | P | 56.3 | Low | 43.5 | Very low | 117 Ų | 117 | 141.3 Ų | 141.3 | 76% | 0.76 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -90 | 164 | 159.9 | 35.4 | -27.3 | 0 | 0 | 0 | 111 | ||
| 68 | P | 46 | Very low | 43.4 | Very low | 129 Ų | 129 | 145.3 Ų | 145.3 | 84% | 0.838 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 155.9 | -150 | 34.3 | -34.5 | 0 | 0 | 0 | 115.4 | ||
| 69 | I | 43.6 | Very low | 43 | Very low | 160 Ų | 160 | 143.1 Ų | 143.1 | 82% | 0.821 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 142.9 | 179.9 | -64.7 | 155.3 | 0 | 0 | 0 | 111.1 | ||
| 70 | D | 40.8 | Very low | 43.2 | Very low | 157 Ų | 157 | 141 Ų | 141 | 84% | 0.84 | 81% | 0.811 | S | S | * | * | trans | -154.7 | 131.2 | 148.2 | -115.8 | -22 | 0 | 0 | 0 | 110.3 | ||||
| 71 | C | 43.5 | Very low | 43.1 | Very low | 123 Ų | 123 | 144 Ų | 144 | 83% | 0.831 | 82% | 0.815 | S | S | * | * | trans | 129.8 | 102.9 | 167.9 | -66.6 | 0 | 0 | 0 | 0 | 113 | ||||
| 72 | D | 39 | Very low | 43.3 | Very low | 156 Ų | 156 | 140.1 Ų | 140.1 | 83% | 0.834 | 81% | 0.81 | S | S | * | * | trans | -48.4 | 131.4 | 175.9 | -60.4 | -67.1 | 0 | 0 | 0 | 115.3 | ||||
| 73 | L | 47.9 | Very low | 43.1 | Very low | 183 Ų | 183 | 138.5 Ų | 138.5 | 96% | 0.958 | 81% | 0.81 | S | S | * | * | trans | -156.9 | 124.8 | 147.2 | -109 | 136.1 | 0 | 0 | 0 | 110.8 | ||||
| 74 | D | 43.3 | Very low | 43.1 | Very low | 148 Ų | 148 | 141.4 Ų | 141.4 | 79% | 0.791 | 82% | 0.819 | S | S | * | * | trans | -67.8 | 147.3 | -170 | -84.9 | -51 | 0 | 0 | 0 | 116.1 | ||||
| 75 | L | 47.1 | Very low | 42.7 | Very low | 154 Ų | 154 | 138.8 Ų | 138.8 | 81% | 0.806 | 81% | 0.811 | S | S | * | * | trans | 85.4 | 151.5 | 147 | -100.8 | 91.5 | 0 | 0 | 0 | 120.4 | ||||
| 76 | P | 40 | Very low | 43 | Very low | 106 Ų | 106 | 137.1 Ų | 137.1 | 69% | 0.688 | 81% | 0.812 | S | S | * | * | -120.8 | 153.6 | -92.6 | 36.1 | -21.5 | 0 | 0 | 0 | 115.4 | |||||
| 77 | T | 33.9 | Very low | 43.3 | Very low | 124 Ų | 124 | 140 Ų | 140 | 76% | 0.761 | 81% | 0.812 | S | S | * | * | trans | 10.5 | 122.4 | 143.4 | -40.9 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 78 | L | 40.8 | Very low | 42.7 | Very low | 172 Ų | 172 | 139.5 Ų | 139.5 | 90% | 0.901 | 81% | 0.812 | S | S | * | * | trans | -159.2 | 109.6 | 136.5 | -104.8 | 150.2 | 0 | 0 | 0 | 109.9 | ||||
| 79 | E | 41.4 | Very low | 43 | Very low | 163 Ų | 163 | 139.2 Ų | 139.2 | 76% | 0.762 | 81% | 0.807 | S | S | * | * | trans | -66.1 | 140.6 | 165.3 | -72.7 | 176.8 | 136.8 | 0 | 0 | 110.2 | T81 | E79-T81 PolarHBondContact O-N 2.85Š| ||
| 80 | P | 44.5 | Very low | 42.8 | Very low | 121 Ų | 121 | 138.2 Ų | 138.2 | 79% | 0.786 | 80% | 0.804 | S | S | * | * | trans | -85.8 | 103.8 | 162.7 | 23.6 | -11.9 | 0 | 0 | 0 | 109.3 | I82 | P80-I82 PolarHBondContact O-N 3.37Š| ||
| 81 | T | 39 | Very low | 43 | Very low | 133 Ų | 133 | 135.7 Ų | 135.7 | 82% | 0.816 | 80% | 0.799 | S | S | * | * | trans | -68.8 | 115.2 | 163.2 | -52.9 | 0 | 0 | 0 | 0 | 109 | E79 | E79-T81 PolarHBondContact O-N 2.85Š| ||
| 82 | I | 44.6 | Very low | 43.5 | Very low | 150 Ų | 150 | 134.3 Ų | 134.3 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | trans | -69.6 | 144.7 | 174.2 | -68.2 | 175.4 | 0 | 0 | 0 | 109.5 | P80 | P80-I82 PolarHBondContact O-N 3.37Š| ||
| 83 | P | 40.8 | Very low | 43.5 | Very low | 121 Ų | 121 | 135.6 Ų | 135.6 | 79% | 0.786 | 79% | 0.789 | S | S | * | * | trans | -89.4 | 149.4 | -160.3 | 35.6 | -31.6 | 0 | 0 | 0 | 112.4 | ||||
| 84 | D | 41.5 | Very low | 43.5 | Very low | 174 Ų | 174 | 132.3 Ų | 132.3 | 93% | 0.93 | 78% | 0.781 | S | S | * | * | trans | -120.4 | 131.9 | 174.4 | -136 | -12.4 | 0 | 0 | 0 | 108.9 | ||||
| 85 | G | 37.1 | Very low | 44.1 | Very low | 65 Ų | 65 | 132.4 Ų | 132.4 | 67% | 0.67 | 78% | 0.778 | S | S | * | * | trans | 113.8 | 59.9 | 167.8 | 0 | 0 | 0 | 0 | 0 | 116.8 | E87 | G85-E87 PolarHBondContact O-N 3.03Š| ||
| 86 | A | 49.6 | Very low | 44.4 | Very low | 108 Ų | 108 | 131 Ų | 131 | 89% | 0.893 | 78% | 0.779 | S | S | * | * | trans | -88 | 89.1 | 150.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | S88 | A86-S88 PolarHBondContact O-N 3.39Š| ||
| 87 | E | 49.3 | Very low | 44.7 | Very low | 175 Ų | 175 | 131 Ų | 131 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | trans | -64.4 | 122 | 169.8 | -67.3 | -170.8 | 155 | 0 | 0 | 109.6 | G85 V89 | G85-E87 PolarHBondContact O-N 3.03Å; E87-V89 PolarHBondContact O-N 3.32Å; E87-V89 VanDerWaalsContact O-N 3.14Å | ||
| 88 | S | 44.1 | Very low | 45.1 | Very low | 108 Ų | 108 | 130 Ų | 130 | 76% | 0.755 | 78% | 0.779 | S | S | * | * | trans | -45.9 | 108.8 | 162.4 | 171.4 | 0 | 0 | 0 | 0 | 110.9 | A86 | A86-S88 PolarHBondContact O-N 3.39Š| ||
| 89 | V | 51.6 | Low | 45.3 | Very low | 122 Ų | 122 | 129 Ų | 129 | 74% | 0.739 | 78% | 0.775 | S | S | * | * | trans | -100.9 | 80.1 | 163.9 | -73.1 | 0 | 0 | 0 | 0 | 109.3 | E87 S91 | E87-V89 PolarHBondContact O-N 3.32Å; E87-V89 VanDerWaalsContact O-N 3.14Å; V89-S91 PolarHBondContact O-N 3.1Å; V89-S91 PolarHBondContact O-OG 3.02Å | ||
| 90 | D | 39 | Very low | 45.3 | Very low | 140 Ų | 140 | 127.5 Ų | 127.5 | 75% | 0.749 | 78% | 0.777 | S | S | * | * | trans | -63.5 | 79.9 | 162.9 | -152.5 | 1.7 | 0 | 0 | 0 | 108.8 | S92 | D90-S92 VanDerWaalsContact C-N 3.26Å; D90-S92 PolarHBondContact O-N 3.13Å | ||
| 91 | S | 45.3 | Very low | 45.4 | Very low | 104 Ų | 104 | 127.5 Ų | 127.5 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | trans | -85.1 | 74.9 | -179.4 | -56.2 | 0 | 0 | 0 | 0 | 109.2 | V89 F93 | V89-S91 PolarHBondContact O-N 3.1Å; V89-S91 PolarHBondContact O-OG 3.02Å; S91-F93 PolarHBondContact O-N 3.46Å | ||
| 92 | S | 52.9 | Low | 45.4 | Very low | 93 Ų | 93 | 126.2 Ų | 126.2 | 65% | 0.65 | 78% | 0.775 | S | S | * | * | trans | -53.2 | 129.6 | 170.9 | -71.4 | 0 | 0 | 0 | 0 | 111.1 | D90 S94 | D90-S92 VanDerWaalsContact C-N 3.26Å; D90-S92 PolarHBondContact O-N 3.13Å; S92-S94 PolarHBondContact O-N 3.46Å | ||
| 93 | F | 40.7 | Very low | 45.1 | Very low | 184 Ų | 184 | 124.4 Ų | 124.4 | 81% | 0.807 | 78% | 0.776 | S | S | * | * | trans | -40.9 | 121.3 | 167.5 | -87 | -107.2 | 0 | 0 | 0 | 111.9 | S91 M95 | S91-F93 PolarHBondContact O-N 3.46Å; F93-M95 HydrophobicContact CD1-CE 4.36Å; F93-M95 HydrophobicContact CE1-CE 4.4Å | ||
| 94 | S | 47.1 | Very low | 45.2 | Very low | 114 Ų | 114 | 125 Ų | 125 | 80% | 0.797 | 78% | 0.778 | S | S | * | * | trans | -132.3 | 91.9 | 160 | -78.7 | 0 | 0 | 0 | 0 | 108.3 | S92 | S92-S94 PolarHBondContact O-N 3.46Š| ||
| 95 | M | 56.2 | Low | 45 | Very low | 149 Ų | 149 | 121 Ų | 121 | 73% | 0.734 | 77% | 0.768 | S | S | * | * | trans | -61.6 | 128.6 | 163.6 | -72.7 | -76.2 | 159.4 | 0 | 0 | 108.1 | F93 S97 | F93-M95 HydrophobicContact CD1-CE 4.36Å; F93-M95 HydrophobicContact CE1-CE 4.4Å; M95-S97 PolarHBondContact O-N 2.91Å | ||
| 96 | P | 53.2 | Low | 45.3 | Very low | 125 Ų | 125 | 125.5 Ų | 125.5 | 81% | 0.812 | 78% | 0.777 | S | S | * | * | trans | -69.9 | 103 | 169 | 25.8 | -28 | 0 | 0 | 0 | 108.6 | S98 | P96-S98 PolarHBondContact O-N 3.03Š| ||
| 97 | S | 46.5 | Very low | 44.9 | Very low | 107 Ų | 107 | 124.9 Ų | 124.9 | 75% | 0.748 | 77% | 0.772 | S | S | * | * | trans | -54 | 127.2 | 164.5 | -79.1 | 0 | 0 | 0 | 0 | 109.9 | M95 N99 | M95-S97 PolarHBondContact O-N 2.91Å; S97-N99 PolarHBondContact O-N 3.4Å | ||
| 98 | S | 41.8 | Very low | 44.7 | Very low | 102 Ų | 102 | 122.3 Ų | 122.3 | 71% | 0.713 | 77% | 0.771 | S | S | * | * | trans | -45.3 | 111.7 | 171.3 | 52.8 | 0 | 0 | 0 | 0 | 112.6 | P96 | P96-S98 PolarHBondContact O-N 3.03Š| ||
| 99 | N | 46 | Very low | 44.8 | Very low | 152 Ų | 152 | 121.9 Ų | 121.9 | 81% | 0.813 | 77% | 0.773 | S | S | * | * | trans | -111.5 | 98.5 | 157.1 | -81.3 | -16.6 | 0 | 0 | 0 | 109 | S97 S101 | S97-N99 PolarHBondContact O-N 3.4Å; N99-S101 PolarHBondContact O-N 3.14Å; N99-S101 VanDerWaalsContact O-N 3.13Å | ||
| 100 | V | 41.1 | Very low | 45.1 | Very low | 131 Ų | 131 | 122.8 Ų | 122.8 | 79% | 0.794 | 77% | 0.767 | S | S | * | * | trans | -57.2 | 104.6 | 166.7 | 178 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 101 | S | 46.6 | Very low | 46.5 | Very low | 120 Ų | 120 | 119 Ų | 119 | 84% | 0.839 | 75% | 0.752 | S | S | * | * | trans | -98.1 | 95.7 | 160.7 | -72.3 | 0 | 0 | 0 | 0 | 108.5 | N99 | N99-S101 PolarHBondContact O-N 3.14Å; N99-S101 VanDerWaalsContact O-N 3.13Å | ||
| 102 | S | 39.3 | Very low | 48.1 | Very low | 106 Ų | 106 | 118.5 Ų | 118.5 | 74% | 0.741 | 75% | 0.746 | S | S | * | * | trans | -62.2 | 123.3 | 161.9 | 49.3 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 103 | S | 38 | Very low | 49.6 | Very low | 112 Ų | 112 | 116.3 Ų | 116.3 | 78% | 0.783 | 73% | 0.733 | S | S | * | * | trans | 157.6 | 102.1 | 141.7 | -177.1 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 104 | V | 43 | Very low | 51.7 | Low | 135 Ų | 135 | 109.5 Ų | 109.5 | 82% | 0.818 | 71% | 0.711 | S | S | * | * | -162.7 | 102 | 124.5 | 174.4 | 0 | 0 | 0 | 0 | 105.3 | N106 | V104-N106 PolarHBondContact O-N 2.83Š| |||
| 105 | A | 37.5 | Very low | 53.5 | Low | 89 Ų | 89 | 108.3 Ų | 108.3 | 74% | 0.736 | 70% | 0.695 | S | S | * | * | trans | -73.3 | 108.7 | 161.4 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 106 | N | 43.1 | Very low | 55.1 | Low | 160 Ų | 160 | 107.4 Ų | 107.4 | 86% | 0.856 | 69% | 0.689 | S | S | * | * | trans | -176.3 | 124.7 | 143.5 | -94.2 | -18.6 | 0 | 0 | 0 | 109.8 | V104 | V104-N106 PolarHBondContact O-N 2.83Š| ||
| 107 | A | 40.2 | Very low | 56.9 | Low | 95 Ų | 95 | 106.5 Ų | 106.5 | 79% | 0.785 | 68% | 0.677 | S | S | * | * | trans | -65.7 | 164.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 108 | P | 44.6 | Very low | 58.9 | Low | 121 Ų | 121 | 107.4 Ų | 107.4 | 79% | 0.786 | 66% | 0.664 | S | S | * | * | -133 | 164.8 | 75.9 | 30.3 | -12.5 | 0 | 0 | 0 | 112.9 | K110 | P108-K110 PolarHBondContact O-N 3.16Š| |||
| 109 | A | 46.1 | Very low | 61.3 | Low | 98 Ų | 98 | 107.2 Ų | 107.2 | 81% | 0.81 | 65% | 0.652 | S | S | * | * | trans | -28.6 | 115.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | S111 | A109-S111 VanDerWaalsContact C-N 3.33Å; A109-S111 PolarHBondContact O-N 3.46Å | ||
| 110 | K | 59 | Low | 63.6 | Low | 141 Ų | 141 | 103.3 Ų | 103.3 | 61% | 0.613 | 63% | 0.633 | S | S | * | * | trans | -59.1 | 99.9 | 168.8 | -75.4 | 173.7 | -177.3 | 171.6 | 0 | 107.4 | P108 L115 | P108-K110 PolarHBondContact O-N 3.16Å; K110-L115 HydrophobicContact CB-CD1 4.5Å; K110-L115 HydrophobicContact CB-CG 4.4Å; K110-L115 HydrophobicContact CD-CD2 4.13Å | ||
| 111 | S | 68.2 | Low | 66.1 | Low | 60 Ų | 60 | 102.3 Ų | 102.3 | 42% | 0.42 | 62% | 0.62 | S | S | . | * | trans | -50.1 | 135.2 | 167.9 | 161.3 | 0 | 0 | 0 | 0 | 108.3 | A109 A113 A114 L115 | A109-S111 VanDerWaalsContact C-N 3.33Å; A109-S111 PolarHBondContact O-N 3.46Å; S111-A113 PolarHBondContact O-N 2.91Å; S111-A113 WeakPolarHBondContact OG-CB 3.43Å; S111-A113 PolarHBondContact OG-N 3.26Å; S111-A114 WeakPolarHBondContact O-CB 3.33Å; S111-A114 PolarHBondContact O-N 3Å; S111-L115 PolarHBondContact O-N 3.45Å | ||
| 112 | P | 78.6 | Confident | 68.3 | Low | 95 Ų | 95 | 104 Ų | 104 | 62% | 0.617 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -52.1 | -29.4 | 173.8 | 20.3 | -31.5 | 0 | 0 | 0 | 111.8 | A114 L115 Q116 | P112-A114 PolarHBondContact O-N 3.5Å; P112-L115 PolarHBondContact O-N 3.45Å; P112-Q116 WeakPolarHBondContact O-CG 3.35Å; P112-Q116 PolarHBondContact O-N 2.82Å |
| 113 | A | 84 | Confident | 71 | Confident | 46 Ų | 46 | 104 Ų | 104 | 38% | 0.38 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -64.3 | -36.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | S111 Q116 L117 | S111-A113 PolarHBondContact O-N 2.91Å; S111-A113 WeakPolarHBondContact OG-CB 3.43Å; S111-A113 PolarHBondContact OG-N 3.26Å; A113-Q116 PolarHBondContact O-N 3.43Å; A113-L117 WeakPolarHBondContact O-CB 3.46Å; A113-L117 WeakPolarHBondContact O-CG 3.36Å; A113-L117 PolarHBondContact O-N 3.43Å |
| 114 | A | 84.9 | Confident | 73.7 | Confident | 41 Ų | 41 | 103 Ų | 103 | 34% | 0.339 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -72.9 | -28.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | S111 P112 R118 | S111-A114 WeakPolarHBondContact O-CB 3.33Å; S111-A114 PolarHBondContact O-N 3Å; P112-A114 PolarHBondContact O-N 3.5Å; A114-R118 PolarHBondContact O-N 2.88Å |
| 115 | L | 85.9 | Confident | 76.2 | Confident | 89 Ų | 89 | 99.8 Ų | 99.8 | 47% | 0.466 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -73.8 | -40.3 | 170.8 | -74.3 | 172.6 | 0 | 0 | 0 | 111.4 | K110 S111 P112 R118 H119 | K110-L115 HydrophobicContact CB-CD1 4.5Å; K110-L115 HydrophobicContact CB-CG 4.4Å; K110-L115 HydrophobicContact CD-CD2 4.13Å; S111-L115 PolarHBondContact O-N 3.45Å; P112-L115 PolarHBondContact O-N 3.45Å; L115-R118 PolarHBondContact O-N 3.46Å; L115-H119 PolarHBondContact O-N 3.03Å |
| 116 | Q | 89.5 | Confident | 79 | Confident | 130 Ų | 130 | 99.7 Ų | 99.7 | 61% | 0.607 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -61.8 | -46.2 | 174.3 | -74.7 | 174.5 | -0.1 | 0 | 0 | 111.7 | P112 A113 R118 H119 V120 | P112-Q116 WeakPolarHBondContact O-CG 3.35Å; P112-Q116 PolarHBondContact O-N 2.82Å; A113-Q116 PolarHBondContact O-N 3.43Å; Q116-R118 PolarHBondContact O-N 3.31Å; Q116-H119 WeakPolarHBondContact O-CB 3.47Å; Q116-H119 PolarHBondContact O-N 3.39Å; Q116-H119 VanDerWaalsContact O-N 3.1Å; Q116-V120 WeakPolarHBondContact O-CG2 3.39Å; Q116-V120 PolarHBondContact O-N 2.94Å |
| 117 | L | 91.3 | Very high | 81.6 | Confident | 107 Ų | 107 | 97.9 Ų | 97.9 | 56% | 0.56 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -57.5 | -48.8 | 176 | -77.9 | 169.3 | 0 | 0 | 0 | 111.8 | A113 H119 V120 E121 | A113-L117 WeakPolarHBondContact O-CB 3.46Å; A113-L117 WeakPolarHBondContact O-CG 3.36Å; A113-L117 PolarHBondContact O-N 3.43Å; L117-H119 PolarHBondContact O-N 3.18Å; L117-V120 PolarHBondContact O-N 2.95Å; L117-V120 VanDerWaalsContact O-N 3.14Å; L117-E121 WeakPolarHBondContact O-CB 3.49Å; L117-E121 WeakPolarHBondContact O-CG 3.5Å; L117-E121 PolarHBondContact O-N 3.12Å |
| 118 | R | 89.2 | Confident | 84.3 | Confident | 126 Ų | 126 | 98.9 Ų | 98.9 | 48% | 0.475 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.1 | -32.2 | 175.5 | -86.9 | -163.7 | -78.3 | -164.7 | -16.6 | 113.9 | A114 L115 Q116 R122 | A114-R118 PolarHBondContact O-N 2.88Å; L115-R118 PolarHBondContact O-N 3.46Å; Q116-R118 PolarHBondContact O-N 3.31Å; R118-R122 WeakPolarHBondContact O-CB 3.29Å; R118-R122 PolarHBondContact O-N 3.45Å; R118-R122 VanDerWaalsContact O-N 3.13Å |
| 119 | H | 91.6 | Very high | 86.8 | Confident | 98 Ų | 98 | 98.4 Ų | 98.4 | 45% | 0.454 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -69.9 | -44.1 | 175.3 | -173.7 | 62.5 | 0 | 0 | 0 | 111.2 | L115 Q116 L117 R122 Q123 | L115-H119 PolarHBondContact O-N 3.03Å; Q116-H119 WeakPolarHBondContact O-CB 3.47Å; Q116-H119 PolarHBondContact O-N 3.39Å; Q116-H119 VanDerWaalsContact O-N 3.1Å; L117-H119 PolarHBondContact O-N 3.18Å; H119-R122 PolarHBondContact O-N 3.13Å; H119-Q123 PolarHBondContact NE2-NE2 2.84Å; H119-Q123 VanDerWaalsContact NE2-NE2 3.12Å; H119-Q123 WeakPolarHBondContact O-CG 3.48Å; H119-Q123 PolarHBondContact O-N 3.38Å |
| 120 | V | 93.9 | Very high | 89.2 | Confident | 70 Ų | 70 | 100.3 Ų | 100.3 | 42% | 0.424 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.4 | -43.6 | 175.2 | 173.6 | 0 | 0 | 0 | 0 | 111.2 | Q116 L117 R122 Q123 L124 | Q116-V120 WeakPolarHBondContact O-CG2 3.39Å; Q116-V120 PolarHBondContact O-N 2.94Å; L117-V120 PolarHBondContact O-N 2.95Å; L117-V120 VanDerWaalsContact O-N 3.14Å; V120-R122 VanDerWaalsContact C-N 3.31Å; V120-R122 PolarHBondContact O-N 3.44Å; V120-Q123 PolarHBondContact O-N 3.32Å; V120-L124 HydrophobicContact CG1-CD1 4.04Å; V120-L124 HydrophobicContact CG1-CG 4.36Å; V120-L124 WeakPolarHBondContact O-CB 3.44Å; V120-L124 WeakPolarHBondContact O-CG 3.33Å; V120-L124 PolarHBondContact O-N 2.93Å |
| 121 | E | 93.6 | Very high | 91 | Very high | 110 Ų | 110 | 97.1 Ų | 97.1 | 51% | 0.514 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.8 | -41.5 | 175.1 | -74 | 168.3 | 172.5 | 0 | 0 | 112 | L117 L124 S125 | L117-E121 WeakPolarHBondContact O-CB 3.49Å; L117-E121 WeakPolarHBondContact O-CG 3.5Å; L117-E121 PolarHBondContact O-N 3.12Å; E121-L124 PolarHBondContact O-N 2.87Å; E121-S125 WeakPolarHBondContact O-CB 3.49Å; E121-S125 PolarHBondContact O-N 2.91Å; E121-S125 PolarHBondContact O-OG 3.2Å |
| 122 | R | 93.3 | Very high | 92.4 | Very high | 156 Ų | 156 | 99.7 Ų | 99.7 | 59% | 0.589 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.9 | -43.9 | 174.8 | -171.9 | -179.8 | -63.6 | 136 | 1.8 | 111.6 | R118 H119 V120 L124 S125 D126 | R118-R122 WeakPolarHBondContact O-CB 3.29Å; R118-R122 PolarHBondContact O-N 3.45Å; R118-R122 VanDerWaalsContact O-N 3.13Å; H119-R122 PolarHBondContact O-N 3.13Å; V120-R122 VanDerWaalsContact C-N 3.31Å; V120-R122 PolarHBondContact O-N 3.44Å; R122-L124 VanDerWaalsContact C-N 3.31Å; R122-L124 PolarHBondContact O-N 3.36Å; R122-S125 PolarHBondContact O-N 3.43Å; R122-D126 WeakPolarHBondContact O-CB 3.48Å; R122-D126 VanDerWaalsContact O-CG 3.29Å; R122-D126 PolarHBondContact O-N 3.47Å |
| 123 | Q | 95.5 | Very high | 93.3 | Very high | 104 Ų | 104 | 97 Ų | 97 | 49% | 0.486 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.8 | -39.4 | 176 | -74.6 | -179.2 | -24.6 | 0 | 0 | 112.2 | H119 V120 D126 F127 | H119-Q123 PolarHBondContact NE2-NE2 2.84Å; H119-Q123 VanDerWaalsContact NE2-NE2 3.12Å; H119-Q123 WeakPolarHBondContact O-CG 3.48Å; H119-Q123 PolarHBondContact O-N 3.38Å; V120-Q123 PolarHBondContact O-N 3.32Å; Q123-D126 PolarHBondContact O-N 2.95Å; Q123-F127 VanDerWaalsContact O-CB 3.29Å; Q123-F127 WeakPolarHBondContact O-CB 3.4Å; Q123-F127 PolarHBondContact O-N 3.01Å |
| 124 | L | 95.5 | Very high | 94 | Very high | 93 Ų | 93 | 100 Ų | 100 | 49% | 0.487 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64 | -45.5 | 174.1 | -74.5 | 171 | 0 | 0 | 0 | 111 | V120 E121 R122 D126 F127 E128 | V120-L124 HydrophobicContact CG1-CD1 4.04Å; V120-L124 HydrophobicContact CG1-CG 4.36Å; V120-L124 WeakPolarHBondContact O-CB 3.44Å; V120-L124 WeakPolarHBondContact O-CG 3.33Å; V120-L124 PolarHBondContact O-N 2.93Å; E121-L124 PolarHBondContact O-N 2.87Å; R122-L124 VanDerWaalsContact C-N 3.31Å; R122-L124 PolarHBondContact O-N 3.36Å; L124-D126 PolarHBondContact O-N 3.1Å; L124-F127 WeakPolarHBondContact O-CB 3.37Å; L124-F127 PolarHBondContact O-N 3.25Å; L124-F127 VanDerWaalsContact O-N 3.16Å; L124-E128 WeakPolarHBondContact O-CG 3.38Å; L124-E128 PolarHBondContact O-N 3.02Å |
| 125 | S | 94.8 | Very high | 94.6 | Very high | 66 Ų | 66 | 104.6 Ų | 104.6 | 46% | 0.462 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.4 | -43.1 | 176.6 | -55.2 | 0 | 0 | 0 | 0 | 111.9 | E121 R122 F127 E128 L129 | E121-S125 WeakPolarHBondContact O-CB 3.49Å; E121-S125 PolarHBondContact O-N 2.91Å; E121-S125 PolarHBondContact O-OG 3.2Å; R122-S125 PolarHBondContact O-N 3.43Å; S125-F127 VanDerWaalsContact C-N 3.3Å; S125-F127 PolarHBondContact O-N 3.01Å; S125-E128 PolarHBondContact O-N 3.46Å; S125-L129 WeakPolarHBondContact O-CB 3.31Å; S125-L129 PolarHBondContact O-N 3.34Å |
| 126 | D | 96.3 | Very high | 95.2 | Very high | 87 Ų | 87 | 107.5 Ų | 107.5 | 47% | 0.465 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.5 | -36.3 | 176 | -70.6 | -18.3 | 0 | 0 | 0 | 111.6 | R122 Q123 L124 K130 | R122-D126 WeakPolarHBondContact O-CB 3.48Å; R122-D126 VanDerWaalsContact O-CG 3.29Å; R122-D126 PolarHBondContact O-N 3.47Å; Q123-D126 PolarHBondContact O-N 2.95Å; L124-D126 PolarHBondContact O-N 3.1Å; D126-K130 WeakPolarHBondContact O-CG 3.47Å; D126-K130 PolarHBondContact O-N 3.44Å; D126-K130 VanDerWaalsContact O-N 3.1Å |
| 127 | F | 97.1 | Very high | 95.6 | Very high | 123 Ų | 123 | 106.6 Ų | 106.6 | 54% | 0.539 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -70 | -41.7 | 176.3 | -179.7 | -102.6 | 0 | 0 | 0 | 112 | Q123 L124 S125 K130 M131 | Q123-F127 VanDerWaalsContact O-CB 3.29Å; Q123-F127 WeakPolarHBondContact O-CB 3.4Å; Q123-F127 PolarHBondContact O-N 3.01Å; L124-F127 WeakPolarHBondContact O-CB 3.37Å; L124-F127 PolarHBondContact O-N 3.25Å; L124-F127 VanDerWaalsContact O-N 3.16Å; S125-F127 VanDerWaalsContact C-N 3.3Å; S125-F127 PolarHBondContact O-N 3.01Å; F127-K130 PolarHBondContact O-N 3.44Å; F127-M131 HydrophobicContact CD1-CE 4.02Å; F127-M131 HydrophobicContact CE1-CE 3.24Å; F127-M131 HydrophobicContact CZ-CE 3.75Å; F127-M131 WeakPolarHBondContact O-CB 3.39Å; F127-M131 PolarHBondContact O-N 3.07Å |
| 128 | E | 96.9 | Very high | 95.9 | Very high | 115 Ų | 115 | 106 Ų | 106 | 54% | 0.537 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.5 | -45.8 | 174.2 | -74.7 | 172.1 | 173.7 | 0 | 0 | 111.1 | L124 S125 K130 M131 E132 | L124-E128 WeakPolarHBondContact O-CG 3.38Å; L124-E128 PolarHBondContact O-N 3.02Å; S125-E128 PolarHBondContact O-N 3.46Å; E128-K130 PolarHBondContact O-N 2.86Å; E128-M131 WeakPolarHBondContact O-CB 3.4Å; E128-M131 PolarHBondContact O-N 3.31Å; E128-M131 VanDerWaalsContact O-N 3.13Å; E128-E132 WeakPolarHBondContact O-CG 3.4Å; E128-E132 PolarHBondContact O-N 3.4Å |
| 129 | L | 96.5 | Very high | 96.3 | Very high | 112 Ų | 112 | 102.8 Ų | 102.8 | 59% | 0.586 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.5 | -41.7 | 177.3 | -168.4 | 150.3 | 0 | 0 | 0 | 112.2 | S125 E132 A133 | S125-L129 WeakPolarHBondContact O-CB 3.31Å; S125-L129 PolarHBondContact O-N 3.34Å; L129-E132 PolarHBondContact O-N 3.41Å; L129-A133 PolarHBondContact O-N 3.17Å |
| 130 | K | 97.5 | Very high | 96.6 | Very high | 137 Ų | 137 | 101 Ų | 101 | 60% | 0.596 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.6 | -39.6 | 173 | -75.3 | 173.8 | -175.8 | 174.3 | 0 | 112 | D126 F127 E128 A133 L134 | D126-K130 WeakPolarHBondContact O-CG 3.47Å; D126-K130 PolarHBondContact O-N 3.44Å; D126-K130 VanDerWaalsContact O-N 3.1Å; F127-K130 PolarHBondContact O-N 3.44Å; E128-K130 PolarHBondContact O-N 2.86Å; K130-A133 PolarHBondContact O-N 3.5Å; K130-L134 WeakPolarHBondContact O-CG 3.28Å; K130-L134 PolarHBondContact O-N 3.24Å |
| 131 | M | 97.6 | Very high | 96.8 | Very high | 75 Ų | 75 | 101.3 Ų | 101.3 | 37% | 0.369 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.3 | -41.7 | 177.3 | -173 | -174.3 | -61.1 | 0 | 0 | 111.3 | F127 E128 L134 K135 | F127-M131 HydrophobicContact CD1-CE 4.02Å; F127-M131 HydrophobicContact CE1-CE 3.24Å; F127-M131 HydrophobicContact CZ-CE 3.75Å; F127-M131 WeakPolarHBondContact O-CB 3.39Å; F127-M131 PolarHBondContact O-N 3.07Å; E128-M131 WeakPolarHBondContact O-CB 3.4Å; E128-M131 PolarHBondContact O-N 3.31Å; E128-M131 VanDerWaalsContact O-N 3.13Å; M131-L134 PolarHBondContact O-N 3.08Å; M131-K135 HydrophobicContact CG-CD 4.45Å; M131-K135 WeakPolarHBondContact O-CB 3.47Å; M131-K135 VanDerWaalsContact O-CG 3.31Å; M131-K135 WeakPolarHBondContact O-CG 3.33Å; M131-K135 PolarHBondContact O-N 2.85Å |
| 132 | E | 97.2 | Very high | 97 | Very high | 113 Ų | 113 | 100.5 Ų | 100.5 | 53% | 0.528 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.4 | -39.8 | 174.3 | -72.7 | -177.6 | 177.6 | 0 | 0 | 112.4 | E128 L129 K135 R136 | E128-E132 WeakPolarHBondContact O-CG 3.4Å; E128-E132 PolarHBondContact O-N 3.4Å; L129-E132 PolarHBondContact O-N 3.41Å; E132-K135 PolarHBondContact O-N 3.32Å; E132-R136 PolarHBondContact O-N 2.92Å |
| 133 | A | 97.4 | Very high | 97.2 | Very high | 39 Ų | 39 | 98.3 Ų | 98.3 | 32% | 0.322 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.6 | -47 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L129 K130 K135 R136 E137 | L129-A133 PolarHBondContact O-N 3.17Å; K130-A133 PolarHBondContact O-N 3.5Å; A133-K135 PolarHBondContact O-N 3.45Å; A133-R136 PolarHBondContact O-N 3.45Å; A133-E137 PolarHBondContact O-N 2.87Å |
| 134 | L | 98 | Very high | 97.4 | Very high | 109 Ų | 109 | 98 Ų | 98 | 57% | 0.571 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64.5 | -36.3 | 176.7 | -72.9 | 171.1 | 0 | 0 | 0 | 112.6 | K130 M131 E137 N138 | K130-L134 WeakPolarHBondContact O-CG 3.28Å; K130-L134 PolarHBondContact O-N 3.24Å; M131-L134 PolarHBondContact O-N 3.08Å; L134-E137 PolarHBondContact O-N 3.49Å; L134-N138 VanDerWaalsContact O-CB 3.28Å; L134-N138 WeakPolarHBondContact O-CB 3.46Å; L134-N138 PolarHBondContact O-N 2.99Å |
| 135 | K | 98.1 | Very high | 97.5 | Very high | 137 Ų | 137 | 97.3 Ų | 97.3 | 60% | 0.596 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.8 | -42 | 174.2 | -78 | 174 | 179.7 | 174.4 | 0 | 111.8 | M131 E132 A133 A139 | M131-K135 HydrophobicContact CG-CD 4.45Å; M131-K135 WeakPolarHBondContact O-CB 3.47Å; M131-K135 VanDerWaalsContact O-CG 3.31Å; M131-K135 WeakPolarHBondContact O-CG 3.33Å; M131-K135 PolarHBondContact O-N 2.85Å; E132-K135 PolarHBondContact O-N 3.32Å; A133-K135 PolarHBondContact O-N 3.45Å; K135-A139 WeakPolarHBondContact O-CB 3.3Å; K135-A139 PolarHBondContact O-N 2.89Å |
| 136 | R | 97.3 | Very high | 97.7 | Very high | 150 Ų | 150 | 98 Ų | 98 | 57% | 0.566 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.7 | -45 | 175.6 | -78.6 | -176.1 | -99.6 | 104.6 | -1.9 | 111.8 | E132 A133 A139 A140 | E132-R136 PolarHBondContact O-N 2.92Å; A133-R136 PolarHBondContact O-N 3.45Å; R136-A139 PolarHBondContact O-N 2.89Å; R136-A140 PolarHBondContact O-N 3.32Å |
| 137 | E | 98 | Very high | 97.8 | Very high | 112 Ų | 112 | 98.5 Ų | 98.5 | 52% | 0.523 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.3 | -43.8 | 175.7 | -175.3 | 178.5 | -170.5 | 0 | 0 | 111.9 | A133 L134 A139 A140 L141 | A133-E137 PolarHBondContact O-N 2.87Å; L134-E137 PolarHBondContact O-N 3.49Å; E137-A139 VanDerWaalsContact C-N 3.33Å; E137-A139 PolarHBondContact O-N 2.95Å; E137-A140 PolarHBondContact O-N 3.01Å; E137-L141 HydrophobicContact CG-CD1 4.12Å; E137-L141 HydrophobicContact CG-CG 4.49Å; E137-L141 WeakPolarHBondContact O-CG 3.4Å; E137-L141 PolarHBondContact O-N 2.9Å |
| 138 | N | 98 | Very high | 97.8 | Very high | 94 Ų | 94 | 97.6 Ų | 97.6 | 50% | 0.503 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.9 | -40.5 | 176.6 | -167.7 | -85.2 | 0 | 0 | 0 | 111.9 | L134 L141 N142 | L134-N138 VanDerWaalsContact O-CB 3.28Å; L134-N138 WeakPolarHBondContact O-CB 3.46Å; L134-N138 PolarHBondContact O-N 2.99Å; N138-L141 PolarHBondContact O-N 3.19Å; N138-N142 WeakPolarHBondContact O-CB 3.33Å; N138-N142 PolarHBondContact O-N 3.32Å; N138-N142 PolarHBondContact O-ND2 2.91Å; N138-N142 VanDerWaalsContact O-ND2 3.08Å; N138-N142 PolarHBondContact OD1-ND2 3.19Å |
| 139 | A | 98 | Very high | 97.9 | Very high | 58 Ų | 58 | 99.6 Ų | 99.6 | 48% | 0.479 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.9 | -42.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | K135 R136 E137 N142 L143 | K135-A139 WeakPolarHBondContact O-CB 3.3Å; K135-A139 PolarHBondContact O-N 2.89Å; R136-A139 PolarHBondContact O-N 2.89Å; E137-A139 VanDerWaalsContact C-N 3.33Å; E137-A139 PolarHBondContact O-N 2.95Å; A139-N142 PolarHBondContact O-N 3.08Å; A139-L143 PolarHBondContact O-N 2.89Å |
| 140 | A | 98 | Very high | 97.9 | Very high | 60 Ų | 60 | 98.3 Ų | 98.3 | 50% | 0.496 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64 | -45.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | R136 E137 N142 L143 E144 | R136-A140 PolarHBondContact O-N 3.32Å; E137-A140 PolarHBondContact O-N 3.01Å; A140-N142 VanDerWaalsContact C-N 3.33Å; A140-N142 PolarHBondContact O-N 2.94Å; A140-L143 PolarHBondContact O-N 2.97Å; A140-E144 PolarHBondContact O-N 3.46Å |
| 141 | L | 98.4 | Very high | 98 | Very high | 78 Ų | 78 | 93.8 Ų | 93.8 | 41% | 0.408 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.9 | -35.2 | 176.4 | -71.8 | 172.6 | 0 | 0 | 0 | 112.4 | E137 N138 N145 | E137-L141 HydrophobicContact CG-CD1 4.12Å; E137-L141 HydrophobicContact CG-CG 4.49Å; E137-L141 WeakPolarHBondContact O-CG 3.4Å; E137-L141 PolarHBondContact O-N 2.9Å; N138-L141 PolarHBondContact O-N 3.19Å; L141-N145 VanDerWaalsContact O-CB 3.3Å; L141-N145 WeakPolarHBondContact O-CB 3.38Å; L141-N145 VanDerWaalsContact O-CG 3.29Å; L141-N145 PolarHBondContact O-N 3.33Å; L141-N145 PolarHBondContact O-ND2 2.91Å |
| 142 | N | 98.1 | Very high | 98 | Very high | 92 Ų | 92 | 95.8 Ų | 95.8 | 49% | 0.492 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66.4 | -40.1 | 174.7 | -73.9 | -31.5 | 0 | 0 | 0 | 111.6 | N138 A139 A140 Q146 | N138-N142 WeakPolarHBondContact O-CB 3.33Å; N138-N142 PolarHBondContact O-N 3.32Å; N138-N142 PolarHBondContact O-ND2 2.91Å; N138-N142 VanDerWaalsContact O-ND2 3.08Å; N138-N142 PolarHBondContact OD1-ND2 3.19Å; A139-N142 PolarHBondContact O-N 3.08Å; A140-N142 VanDerWaalsContact C-N 3.33Å; A140-N142 PolarHBondContact O-N 2.94Å; N142-Q146 PolarHBondContact O-N 3.06Å |
| 143 | L | 98 | Very high | 98 | Very high | 111 Ų | 111 | 93 Ų | 93 | 58% | 0.581 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.8 | -45.5 | 174.9 | -178.9 | 64.3 | 0 | 0 | 0 | 111.4 | A139 A140 N145 Q146 N147 | A139-L143 PolarHBondContact O-N 2.89Å; A140-L143 PolarHBondContact O-N 2.97Å; L143-N145 PolarHBondContact O-N 3.42Å; L143-Q146 WeakPolarHBondContact O-CB 3.35Å; L143-Q146 PolarHBondContact O-N 2.94Å; L143-Q146 VanDerWaalsContact O-N 3.17Å; L143-N147 PolarHBondContact O-N 3.49Å |
| 144 | E | 98.3 | Very high | 98 | Very high | 97 Ų | 97 | 94.3 Ų | 94.3 | 45% | 0.453 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.8 | -46.3 | 176.7 | -170.4 | -170.1 | 164.7 | 0 | 0 | 111.6 | A140 Q146 N147 H148 | A140-E144 PolarHBondContact O-N 3.46Å; E144-Q146 PolarHBondContact O-N 2.93Å; E144-N147 PolarHBondContact O-N 2.77Å; E144-H148 WeakPolarHBondContact CG-NE2 3.45Å; E144-H148 PolarHBondContact O-CD2 2.99Å; E144-H148 PolarHBondContact O-N 3.29Å; E144-H148 IonicContact OE1-CD2 3.88Å; E144-H148 IonicContact OE1-CE1 3.95Å; E144-H148 IonicContact OE1-NE2 2.97Å; E144-H148 PolarHBondContact OE1-NE2 3.29Å |
| 145 | N | 98.3 | Very high | 98 | Very high | 79 Ų | 79 | 95.5 Ų | 95.5 | 42% | 0.422 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.4 | -34.9 | 175.3 | -80.4 | -49.6 | 0 | 0 | 0 | 112.5 | L141 L143 R149 | L141-N145 VanDerWaalsContact O-CB 3.3Å; L141-N145 WeakPolarHBondContact O-CB 3.38Å; L141-N145 VanDerWaalsContact O-CG 3.29Å; L141-N145 PolarHBondContact O-N 3.33Å; L141-N145 PolarHBondContact O-ND2 2.91Å; L143-N145 PolarHBondContact O-N 3.42Å; N145-R149 WeakPolarHBondContact O-CG 3.49Å; N145-R149 PolarHBondContact O-N 3.31Å |
| 146 | Q | 98.2 | Very high | 98 | Very high | 81 Ų | 81 | 91.4 Ų | 91.4 | 38% | 0.379 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.7 | -47.2 | 175.1 | -172.8 | 56.6 | 37.6 | 0 | 0 | 111 | N142 L143 E144 H148 R149 D150 | N142-Q146 PolarHBondContact O-N 3.06Å; L143-Q146 WeakPolarHBondContact O-CB 3.35Å; L143-Q146 PolarHBondContact O-N 2.94Å; L143-Q146 VanDerWaalsContact O-N 3.17Å; E144-Q146 PolarHBondContact O-N 2.93Å; Q146-H148 VanDerWaalsContact C-N 3.29Å; Q146-H148 PolarHBondContact O-N 3.2Å; Q146-R149 WeakPolarHBondContact O-CB 3.47Å; Q146-R149 PolarHBondContact O-N 3.36Å; Q146-R149 VanDerWaalsContact O-N 3.08Å; Q146-D150 PolarHBondContact NE2-OD1 2.98Å; Q146-D150 PolarHBondContact NE2-OD2 2.96Å; Q146-D150 VanDerWaalsContact O-CG 3.29Å; Q146-D150 PolarHBondContact O-N 3.49Å |
| 147 | N | 97.9 | Very high | 98.1 | Very high | 97 Ų | 97 | 91 Ų | 91 | 52% | 0.519 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.3 | -40.2 | 175.8 | -67.1 | -15.6 | 0 | 0 | 0 | 112.2 | L143 E144 D150 G151 | L143-N147 PolarHBondContact O-N 3.49Å; E144-N147 PolarHBondContact O-N 2.77Å; N147-D150 PolarHBondContact O-N 3.47Å; N147-G151 PolarHBondContact O-N 3.11Å |
| 148 | H | 98.3 | Very high | 98.1 | Very high | 103 Ų | 103 | 89.3 Ų | 89.3 | 48% | 0.477 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.4 | -38.8 | 175.6 | -71.6 | -47.8 | 0 | 0 | 0 | 112.4 | E144 Q146 G151 L152 | E144-H148 WeakPolarHBondContact CG-NE2 3.45Å; E144-H148 PolarHBondContact O-CD2 2.99Å; E144-H148 PolarHBondContact O-N 3.29Å; E144-H148 IonicContact OE1-CD2 3.88Å; E144-H148 IonicContact OE1-CE1 3.95Å; E144-H148 IonicContact OE1-NE2 2.97Å; E144-H148 PolarHBondContact OE1-NE2 3.29Å; Q146-H148 VanDerWaalsContact C-N 3.29Å; Q146-H148 PolarHBondContact O-N 3.2Å; H148-G151 PolarHBondContact O-N 2.96Å; H148-L152 WeakPolarHBondContact O-CB 3.36Å; H148-L152 WeakPolarHBondContact O-CG 3.46Å; H148-L152 PolarHBondContact O-N 3.2Å |
| 149 | R | 98.3 | Very high | 98.1 | Very high | 157 Ų | 157 | 87.2 Ų | 87.2 | 59% | 0.592 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -64.9 | -43.2 | 175 | -74.7 | 176.2 | -170.9 | 143.4 | 3.2 | 111.7 | N145 Q146 G151 L152 A153 | N145-R149 WeakPolarHBondContact O-CG 3.49Å; N145-R149 PolarHBondContact O-N 3.31Å; Q146-R149 WeakPolarHBondContact O-CB 3.47Å; Q146-R149 PolarHBondContact O-N 3.36Å; Q146-R149 VanDerWaalsContact O-N 3.08Å; R149-G151 VanDerWaalsContact C-N 3.33Å; R149-L152 PolarHBondContact O-N 2.93Å; R149-A153 WeakPolarHBondContact O-CB 3.48Å; R149-A153 PolarHBondContact O-N 3.45Å |
| 150 | D | 98 | Very high | 98.1 | Very high | 86 Ų | 86 | 87.8 Ų | 87.8 | 46% | 0.46 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.2 | -40.6 | 178 | -61.8 | -20.4 | 0 | 0 | 0 | 110.5 | Q146 N147 A153 S154 | Q146-D150 PolarHBondContact NE2-OD1 2.98Å; Q146-D150 PolarHBondContact NE2-OD2 2.96Å; Q146-D150 VanDerWaalsContact O-CG 3.29Å; Q146-D150 PolarHBondContact O-N 3.49Å; N147-D150 PolarHBondContact O-N 3.47Å; D150-A153 PolarHBondContact O-N 3.07Å; D150-S154 PolarHBondContact O-N 3.18Å |
| 151 | G | 98.3 | Very high | 98.1 | Very high | 41 Ų | 41 | 87.2 Ų | 87.2 | 42% | 0.423 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.6 | -41.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | N147 H148 R149 S154 F155 | N147-G151 PolarHBondContact O-N 3.11Å; H148-G151 PolarHBondContact O-N 2.96Å; R149-G151 VanDerWaalsContact C-N 3.33Å; G151-S154 PolarHBondContact O-N 3.43Å; G151-F155 WeakPolarHBondContact O-CB 3.45Å; G151-F155 PolarHBondContact O-N 3.46Å |
| 152 | L | 98.3 | Very high | 98.1 | Very high | 118 Ų | 118 | 87.9 Ų | 87.9 | 62% | 0.618 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -66.3 | -37.6 | 175 | -76.3 | 172.7 | 0 | 0 | 0 | 112.4 | H148 R149 F155 A156 | H148-L152 WeakPolarHBondContact O-CB 3.36Å; H148-L152 WeakPolarHBondContact O-CG 3.46Å; H148-L152 PolarHBondContact O-N 3.2Å; R149-L152 PolarHBondContact O-N 2.93Å; L152-F155 PolarHBondContact O-N 2.91Å; L152-A156 WeakPolarHBondContact O-CB 3.38Å; L152-A156 PolarHBondContact O-N 3.31Å |
| 153 | A | 97.8 | Very high | 98.2 | Very high | 53 Ų | 53 | 88.7 Ų | 88.7 | 44% | 0.438 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.1 | -47.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | R149 D150 F155 A156 E157 | R149-A153 WeakPolarHBondContact O-CB 3.48Å; R149-A153 PolarHBondContact O-N 3.45Å; D150-A153 PolarHBondContact O-N 3.07Å; A153-F155 VanDerWaalsContact C-N 3.34Å; A153-F155 PolarHBondContact O-N 3.17Å; A153-A156 WeakPolarHBondContact O-CB 3.15Å; A153-A156 PolarHBondContact O-N 2.91Å; A153-E157 PolarHBondContact O-N 3.04Å |
| 154 | S | 97.5 | Very high | 98.2 | Very high | 67 Ų | 67 | 89 Ų | 89 | 47% | 0.469 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60.7 | -41.9 | 175.4 | 180 | 0 | 0 | 0 | 0 | 112.2 | D150 G151 A156 E157 V158 | D150-S154 PolarHBondContact O-N 3.18Å; G151-S154 PolarHBondContact O-N 3.43Å; S154-A156 VanDerWaalsContact C-N 3.34Å; S154-A156 PolarHBondContact O-N 3.25Å; S154-E157 PolarHBondContact O-N 2.94Å; S154-V158 WeakPolarHBondContact O-CG2 3.42Å; S154-V158 PolarHBondContact O-N 3.49Å; S154-V158 VanDerWaalsContact O-N 3.11Å |
| 155 | F | 97.9 | Very high | 98.2 | Very high | 135 Ų | 135 | 86.5 Ų | 86.5 | 59% | 0.592 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -61.8 | -41.3 | 175.1 | 179.6 | -104.8 | 0 | 0 | 0 | 112.3 | G151 L152 A153 E157 V158 V159 | G151-F155 WeakPolarHBondContact O-CB 3.45Å; G151-F155 PolarHBondContact O-N 3.46Å; L152-F155 PolarHBondContact O-N 2.91Å; A153-F155 VanDerWaalsContact C-N 3.34Å; A153-F155 PolarHBondContact O-N 3.17Å; F155-E157 VanDerWaalsContact C-N 3.34Å; F155-E157 PolarHBondContact O-N 3.38Å; F155-V158 PolarHBondContact O-N 3.31Å; F155-V159 HydrophobicContact CD1-CG2 4.16Å; F155-V159 HydrophobicContact CD2-CG2 4.5Å; F155-V159 HydrophobicContact CE1-CG2 3.7Å; F155-V159 HydrophobicContact CE2-CG2 4.07Å; F155-V159 HydrophobicContact CZ-CG2 3.65Å; F155-V159 WeakPolarHBondContact O-CG2 3.38Å; F155-V159 PolarHBondContact O-N 3.41Å |
| 156 | A | 98.1 | Very high | 98.2 | Very high | 51 Ų | 51 | 86.6 Ų | 86.6 | 42% | 0.421 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61.9 | -40.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | L152 A153 S154 V159 S160 | L152-A156 WeakPolarHBondContact O-CB 3.38Å; L152-A156 PolarHBondContact O-N 3.31Å; A153-A156 WeakPolarHBondContact O-CB 3.15Å; A153-A156 PolarHBondContact O-N 2.91Å; S154-A156 VanDerWaalsContact C-N 3.34Å; S154-A156 PolarHBondContact O-N 3.25Å; A156-V159 PolarHBondContact O-N 2.9Å; A156-S160 PolarHBondContact O-N 2.9Å; A156-S160 PolarHBondContact O-OG 3.21Å |
| 157 | E | 97.9 | Very high | 98.2 | Very high | 142 Ų | 142 | 89.1 Ų | 89.1 | 66% | 0.664 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -61.6 | -43.4 | 175.1 | -70 | 177.3 | 174.1 | 0 | 0 | 112.3 | A153 S154 F155 S160 S161 | A153-E157 PolarHBondContact O-N 3.04Å; S154-E157 PolarHBondContact O-N 2.94Å; F155-E157 VanDerWaalsContact C-N 3.34Å; F155-E157 PolarHBondContact O-N 3.38Å; E157-S160 PolarHBondContact O-N 2.89Å; E157-S161 WeakPolarHBondContact O-CB 3.29Å; E157-S161 PolarHBondContact O-N 2.63Å |
| 158 | V | 98.2 | Very high | 98.2 | Very high | 76 Ų | 76 | 88.4 Ų | 88.4 | 46% | 0.461 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62 | -45 | 175.9 | 172.8 | 0 | 0 | 0 | 0 | 111 | S154 F155 S161 L162 | S154-V158 WeakPolarHBondContact O-CG2 3.42Å; S154-V158 PolarHBondContact O-N 3.49Å; S154-V158 VanDerWaalsContact O-N 3.11Å; F155-V158 PolarHBondContact O-N 3.31Å; V158-S161 PolarHBondContact O-N 2.88Å; V158-L162 HydrophobicContact CG1-CD1 3.9Å; V158-L162 WeakPolarHBondContact O-CB 3.47Å; V158-L162 WeakPolarHBondContact O-CG 3.32Å; V158-L162 PolarHBondContact O-N 3.46Å |
| 159 | V | 98.4 | Very high | 98.2 | Very high | 49 Ų | 49 | 87.7 Ų | 87.7 | 30% | 0.297 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -61.6 | -44.6 | 177.2 | 170.7 | 0 | 0 | 0 | 0 | 111 | F155 A156 S161 L162 Q163 | F155-V159 HydrophobicContact CD1-CG2 4.16Å; F155-V159 HydrophobicContact CD2-CG2 4.5Å; F155-V159 HydrophobicContact CE1-CG2 3.7Å; F155-V159 HydrophobicContact CE2-CG2 4.07Å; F155-V159 HydrophobicContact CZ-CG2 3.65Å; F155-V159 WeakPolarHBondContact O-CG2 3.38Å; F155-V159 PolarHBondContact O-N 3.41Å; A156-V159 PolarHBondContact O-N 2.9Å; V159-S161 PolarHBondContact O-N 3.44Å; V159-L162 PolarHBondContact O-N 2.99Å; V159-Q163 HydrophobicContact CG1-CG 4.47Å; V159-Q163 VanDerWaalsContact O-CG 3.32Å; V159-Q163 WeakPolarHBondContact O-CG 3.48Å; V159-Q163 PolarHBondContact O-N 3.35Å |
| 160 | S | 98.3 | Very high | 98.3 | Very high | 71 Ų | 71 | 85 Ų | 85 | 50% | 0.497 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.9 | -39.5 | 176.6 | -66.8 | 0 | 0 | 0 | 0 | 112.6 | A156 E157 Q163 R164 | A156-S160 PolarHBondContact O-N 2.9Å; A156-S160 PolarHBondContact O-OG 3.21Å; E157-S160 PolarHBondContact O-N 2.89Å; S160-Q163 PolarHBondContact O-N 3.32Å; S160-R164 PolarHBondContact O-N 2.99Å; S160-R164 VanDerWaalsContact O-N 3.09Å |
| 161 | S | 98.3 | Very high | 98.3 | Very high | 47 Ų | 47 | 87.3 Ų | 87.3 | 33% | 0.329 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.6 | -43.3 | 174.3 | 176.7 | 0 | 0 | 0 | 0 | 112 | E157 V158 V159 R164 Q165 | E157-S161 WeakPolarHBondContact O-CB 3.29Å; E157-S161 PolarHBondContact O-N 2.63Å; V158-S161 PolarHBondContact O-N 2.88Å; V159-S161 PolarHBondContact O-N 3.44Å; S161-R164 PolarHBondContact O-N 3.25Å; S161-Q165 WeakPolarHBondContact O-CG 3.46Å; S161-Q165 PolarHBondContact O-N 3.28Å; S161-Q165 PolarHBondContact OG-NE2 3Å |
| 162 | L | 98.6 | Very high | 98.3 | Very high | 92 Ų | 92 | 90.5 Ų | 90.5 | 48% | 0.482 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64.2 | -41.3 | 176.4 | -78 | 165 | 0 | 0 | 0 | 111.9 | V158 V159 R164 Q165 V166 | V158-L162 HydrophobicContact CG1-CD1 3.9Å; V158-L162 WeakPolarHBondContact O-CB 3.47Å; V158-L162 WeakPolarHBondContact O-CG 3.32Å; V158-L162 PolarHBondContact O-N 3.46Å; V159-L162 PolarHBondContact O-N 2.99Å; L162-R164 VanDerWaalsContact C-N 3.35Å; L162-R164 PolarHBondContact O-N 3.23Å; L162-Q165 PolarHBondContact O-N 3.4Å; L162-V166 WeakPolarHBondContact O-CG2 3.36Å; L162-V166 PolarHBondContact O-N 3.42Å |
| 163 | Q | 98.5 | Very high | 98.3 | Very high | 110 Ų | 110 | 88.3 Ų | 88.3 | 51% | 0.514 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -58.4 | -46.8 | 175.2 | -76.8 | 173.3 | -24.4 | 0 | 0 | 111.3 | V159 S160 Q165 V166 E167 | V159-Q163 HydrophobicContact CG1-CG 4.47Å; V159-Q163 VanDerWaalsContact O-CG 3.32Å; V159-Q163 WeakPolarHBondContact O-CG 3.48Å; V159-Q163 PolarHBondContact O-N 3.35Å; S160-Q163 PolarHBondContact O-N 3.32Å; Q163-Q165 PolarHBondContact O-N 2.9Å; Q163-V166 PolarHBondContact O-N 3.48Å; Q163-E167 WeakPolarHBondContact O-CG 3.41Å; Q163-E167 PolarHBondContact O-N 3.09Å |
| 164 | R | 98.2 | Very high | 98.3 | Very high | 118 Ų | 118 | 90 Ų | 90 | 45% | 0.445 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -59.5 | -44.3 | 175.4 | -174.5 | -173.6 | 60.6 | 74.9 | 6.5 | 112.3 | S160 S161 L162 V166 E167 E168 | S160-R164 PolarHBondContact O-N 2.99Å; S160-R164 VanDerWaalsContact O-N 3.09Å; S161-R164 PolarHBondContact O-N 3.25Å; L162-R164 VanDerWaalsContact C-N 3.35Å; L162-R164 PolarHBondContact O-N 3.23Å; R164-V166 VanDerWaalsContact C-N 3.33Å; R164-V166 PolarHBondContact O-N 3.43Å; R164-E167 PolarHBondContact O-N 2.96Å; R164-E168 IonicContact CZ-OE1 3.81Å; R164-E168 IonicContact CZ-OE2 3.75Å; R164-E168 IonicContact NH1-OE1 3.97Å; R164-E168 PolarHBondContact NH1-OE1 3.44Å; R164-E168 IonicContact NH1-OE2 2.63Å; R164-E168 PolarHBondContact NH1-OE2 3.13Å; R164-E168 WeakPolarHBondContact O-CG 3.37Å; R164-E168 PolarHBondContact O-N 2.93Å |
| 165 | Q | 98.4 | Very high | 98.4 | Very high | 44 Ų | 44 | 91.3 Ų | 91.3 | 21% | 0.206 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -62.9 | -39.3 | 177.6 | -71.2 | 174.2 | 28.6 | 0 | 0 | 112.2 | L41 S161 L162 Q163 E168 L169 | L41-Q165 HydrophobicContact CD1-CB 4.28Å; L41-Q165 HydrophobicContact CD1-CG 3.73Å; L41-Q165 VanDerWaalsContact CD1-OE1 3.32Å; S161-Q165 WeakPolarHBondContact O-CG 3.46Å; S161-Q165 PolarHBondContact O-N 3.28Å; S161-Q165 PolarHBondContact OG-NE2 3Å; L162-Q165 PolarHBondContact O-N 3.4Å; Q163-Q165 PolarHBondContact O-N 2.9Å; Q165-E168 PolarHBondContact O-N 3.39Å; Q165-L169 WeakPolarHBondContact O-CB 3.33Å; Q165-L169 WeakPolarHBondContact O-CG 3.23Å; Q165-L169 PolarHBondContact O-N 3.42Å |
| 166 | V | 98.6 | Very high | 98.4 | Very high | 81 Ų | 81 | 89.9 Ų | 89.9 | 49% | 0.491 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -64.7 | -42.6 | 175.7 | 169.6 | 0 | 0 | 0 | 0 | 111 | L162 Q163 R164 L169 L170 | L162-V166 WeakPolarHBondContact O-CG2 3.36Å; L162-V166 PolarHBondContact O-N 3.42Å; Q163-V166 PolarHBondContact O-N 3.48Å; R164-V166 VanDerWaalsContact C-N 3.33Å; R164-V166 PolarHBondContact O-N 3.43Å; V166-L169 PolarHBondContact O-N 3.31Å; V166-L170 HydrophobicContact CG1-CD1 3.97Å; V166-L170 HydrophobicContact CG1-CG 4.33Å; V166-L170 WeakPolarHBondContact O-CB 3.48Å; V166-L170 VanDerWaalsContact O-CG 3.25Å; V166-L170 WeakPolarHBondContact O-CG 3.25Å; V166-L170 PolarHBondContact O-N 3.4Å |
| 167 | E | 98.6 | Very high | 98.4 | Very high | 133 Ų | 133 | 93.3 Ų | 93.3 | 62% | 0.621 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -62 | -42 | 176.3 | -71.7 | 171.3 | -176.5 | 0 | 0 | 112.2 | Q163 R164 L170 K171 | Q163-E167 WeakPolarHBondContact O-CG 3.41Å; Q163-E167 PolarHBondContact O-N 3.09Å; R164-E167 PolarHBondContact O-N 2.96Å; E167-L170 PolarHBondContact O-N 2.9Å; E167-K171 WeakPolarHBondContact O-CB 3.47Å; E167-K171 PolarHBondContact O-N 2.86Å |
| 168 | E | 98.5 | Very high | 98.4 | Very high | 82 Ų | 82 | 93.4 Ų | 93.4 | 38% | 0.383 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62 | -48.4 | 174.8 | -76 | 168.5 | -174.2 | 0 | 0 | 111.6 | R164 Q165 L170 K171 E172 | R164-E168 IonicContact CZ-OE1 3.81Å; R164-E168 IonicContact CZ-OE2 3.75Å; R164-E168 IonicContact NH1-OE1 3.97Å; R164-E168 PolarHBondContact NH1-OE1 3.44Å; R164-E168 IonicContact NH1-OE2 2.63Å; R164-E168 PolarHBondContact NH1-OE2 3.13Å; R164-E168 WeakPolarHBondContact O-CG 3.37Å; R164-E168 PolarHBondContact O-N 2.93Å; Q165-E168 PolarHBondContact O-N 3.39Å; E168-L170 VanDerWaalsContact C-N 3.33Å; E168-L170 PolarHBondContact O-N 3.49Å; E168-K171 WeakPolarHBondContact O-CB 3.38Å; E168-K171 PolarHBondContact O-N 3.33Å; E168-K171 VanDerWaalsContact O-N 3.13Å; E168-E172 WeakPolarHBondContact O-CG 3.42Å; E168-E172 PolarHBondContact O-N 2.88Å |
| 169 | L | 98.6 | Very high | 98.4 | Very high | 88 Ų | 88 | 92.9 Ų | 92.9 | 46% | 0.461 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.5 | -37.1 | 177.6 | -73.5 | 171.8 | 0 | 0 | 0 | 112.7 | Q165 V166 K171 N173 | Q165-L169 WeakPolarHBondContact O-CB 3.33Å; Q165-L169 WeakPolarHBondContact O-CG 3.23Å; Q165-L169 PolarHBondContact O-N 3.42Å; V166-L169 PolarHBondContact O-N 3.31Å; L169-K171 VanDerWaalsContact C-N 3.32Å; L169-N173 VanDerWaalsContact O-CB 3.23Å; L169-N173 WeakPolarHBondContact O-CB 3.49Å; L169-N173 PolarHBondContact O-N 2.99Å |
| 170 | L | 98.6 | Very high | 98.4 | Very high | 102 Ų | 102 | 93.8 Ų | 93.8 | 53% | 0.534 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -66.3 | -37.3 | 175 | -74.1 | 174.5 | 0 | 0 | 0 | 111.4 | V166 E167 E168 N174 | V166-L170 HydrophobicContact CG1-CD1 3.97Å; V166-L170 HydrophobicContact CG1-CG 4.33Å; V166-L170 WeakPolarHBondContact O-CB 3.48Å; V166-L170 VanDerWaalsContact O-CG 3.25Å; V166-L170 WeakPolarHBondContact O-CG 3.25Å; V166-L170 PolarHBondContact O-N 3.4Å; E167-L170 PolarHBondContact O-N 2.9Å; E168-L170 VanDerWaalsContact C-N 3.33Å; E168-L170 PolarHBondContact O-N 3.49Å; L170-N174 VanDerWaalsContact O-CG 3.26Å; L170-N174 PolarHBondContact O-N 3.38Å; L170-N174 VanDerWaalsContact O-N 3.12Å; L170-N174 PolarHBondContact O-ND2 3.33Å; L170-N174 VanDerWaalsContact O-ND2 3.17Å |
| 171 | K | 98.5 | Very high | 98.4 | Very high | 134 Ų | 134 | 92.2 Ų | 92.2 | 58% | 0.583 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -64.7 | -50.8 | 174.1 | -173.9 | -174.2 | 173.6 | -162.2 | 0 | 111.1 | E167 E168 L169 N173 N174 E175 | E167-K171 WeakPolarHBondContact O-CB 3.47Å; E167-K171 PolarHBondContact O-N 2.86Å; E168-K171 WeakPolarHBondContact O-CB 3.38Å; E168-K171 PolarHBondContact O-N 3.33Å; E168-K171 VanDerWaalsContact O-N 3.13Å; L169-K171 VanDerWaalsContact C-N 3.32Å; K171-N173 VanDerWaalsContact C-N 3.3Å; K171-N173 PolarHBondContact O-N 3.12Å; K171-N174 PolarHBondContact O-N 3.17Å; K171-N174 VanDerWaalsContact O-N 3.12Å; K171-E175 VanDerWaalsContact CE-OE1 3.22Å; K171-E175 WeakPolarHBondContact CE-OE1 3.44Å; K171-E175 IonicContact NZ-OE1 2.88Å; K171-E175 WeakPolarHBondContact O-CG 3.38Å; K171-E175 PolarHBondContact O-N 3.1Å |
| 172 | E | 98.5 | Very high | 98.4 | Very high | 107 Ų | 107 | 91.9 Ų | 91.9 | 50% | 0.5 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -59.1 | -40.5 | 176.4 | -71 | 176.2 | -175.3 | 0 | 0 | 111.9 | E168 N174 E175 L176 | E168-E172 WeakPolarHBondContact O-CG 3.42Å; E168-E172 PolarHBondContact O-N 2.88Å; E172-N174 VanDerWaalsContact C-N 3.3Å; E172-N174 PolarHBondContact O-N 3.02Å; E172-E175 PolarHBondContact O-N 3.38Å; E172-L176 WeakPolarHBondContact O-CB 3.17Å; E172-L176 WeakPolarHBondContact O-CG 3.33Å; E172-L176 PolarHBondContact O-N 2.66Å |
| 173 | N | 98.5 | Very high | 98.4 | Very high | 73 Ų | 73 | 93.4 Ų | 93.4 | 39% | 0.39 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -62.5 | -37.4 | 176.6 | -171.1 | -97.9 | 0 | 0 | 0 | 112.4 | L169 K171 K177 | L169-N173 VanDerWaalsContact O-CB 3.23Å; L169-N173 WeakPolarHBondContact O-CB 3.49Å; L169-N173 PolarHBondContact O-N 2.99Å; K171-N173 VanDerWaalsContact C-N 3.3Å; K171-N173 PolarHBondContact O-N 3.12Å; N173-K177 WeakPolarHBondContact O-CG 3.22Å; N173-K177 PolarHBondContact O-N 3.12Å; N173-K177 WeakPolarHBondContact OD1-CE 3.36Å; N173-K177 PolarHBondContact OD1-NZ 3.09Å |
| 174 | N | 98.3 | Very high | 98.4 | Very high | 87 Ų | 87 | 93.3 Ų | 93.3 | 47% | 0.465 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -70.4 | -42.5 | 176.2 | -71 | -28.3 | 0 | 0 | 0 | 111.6 | L170 K171 E172 L176 K177 E178 | L170-N174 VanDerWaalsContact O-CG 3.26Å; L170-N174 PolarHBondContact O-N 3.38Å; L170-N174 VanDerWaalsContact O-N 3.12Å; L170-N174 PolarHBondContact O-ND2 3.33Å; L170-N174 VanDerWaalsContact O-ND2 3.17Å; K171-N174 PolarHBondContact O-N 3.17Å; K171-N174 VanDerWaalsContact O-N 3.12Å; E172-N174 VanDerWaalsContact C-N 3.3Å; E172-N174 PolarHBondContact O-N 3.02Å; N174-L176 VanDerWaalsContact C-N 3.32Å; N174-L176 PolarHBondContact O-N 2.98Å; N174-K177 WeakPolarHBondContact O-CB 3.49Å; N174-K177 PolarHBondContact O-N 2.8Å; N174-E178 WeakPolarHBondContact O-CG 3.48Å; N174-E178 PolarHBondContact O-N 3.48Å |
| 175 | E | 98.4 | Very high | 98.4 | Very high | 95 Ų | 95 | 94.3 Ų | 94.3 | 44% | 0.444 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -59.3 | -43.9 | 174 | -69.5 | 174.3 | -172.6 | 0 | 0 | 111 | K171 E172 K177 E178 V179 | K171-E175 VanDerWaalsContact CE-OE1 3.22Å; K171-E175 WeakPolarHBondContact CE-OE1 3.44Å; K171-E175 IonicContact NZ-OE1 2.88Å; K171-E175 WeakPolarHBondContact O-CG 3.38Å; K171-E175 PolarHBondContact O-N 3.1Å; E172-E175 PolarHBondContact O-N 3.38Å; E175-K177 PolarHBondContact O-N 3.23Å; E175-E178 PolarHBondContact O-N 3.42Å; E175-V179 VanDerWaalsContact O-CG2 3.32Å; E175-V179 WeakPolarHBondContact O-CG2 3.47Å; E175-V179 PolarHBondContact O-N 3.26Å |
| 176 | L | 98.5 | Very high | 98.4 | Very high | 106 Ų | 106 | 97 Ų | 97 | 56% | 0.555 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -62 | -41.4 | 175.3 | -76.7 | 170.2 | 0 | 0 | 0 | 112.5 | E172 N174 E178 V179 C180 | E172-L176 WeakPolarHBondContact O-CB 3.17Å; E172-L176 WeakPolarHBondContact O-CG 3.33Å; E172-L176 PolarHBondContact O-N 2.66Å; N174-L176 VanDerWaalsContact C-N 3.32Å; N174-L176 PolarHBondContact O-N 2.98Å; L176-E178 VanDerWaalsContact C-N 3.34Å; L176-E178 PolarHBondContact O-N 2.96Å; L176-V179 PolarHBondContact O-N 3.03Å; L176-C180 WeakPolarHBondContact O-CB 3.5Å; L176-C180 PolarHBondContact O-N 3.21Å; L176-C180 PolarHBondContact O-SG 3.11Å |
| 177 | K | 98.5 | Very high | 98.4 | Very high | 123 Ų | 123 | 98.4 Ų | 98.4 | 54% | 0.535 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.9 | -42.3 | 175.2 | -79.2 | 167.3 | 173.1 | 156.4 | 0 | 112.1 | N173 N174 E175 C180 A181 | N173-K177 WeakPolarHBondContact O-CG 3.22Å; N173-K177 PolarHBondContact O-N 3.12Å; N173-K177 WeakPolarHBondContact OD1-CE 3.36Å; N173-K177 PolarHBondContact OD1-NZ 3.09Å; N174-K177 WeakPolarHBondContact O-CB 3.49Å; N174-K177 PolarHBondContact O-N 2.8Å; E175-K177 PolarHBondContact O-N 3.23Å; K177-C180 PolarHBondContact O-N 2.9Å; K177-A181 WeakPolarHBondContact O-CB 3.25Å; K177-A181 PolarHBondContact O-N 2.94Å |
| 178 | E | 98.3 | Very high | 98.4 | Very high | 143 Ų | 143 | 98 Ų | 98 | 67% | 0.668 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -64.6 | -42.2 | 176.5 | -70.4 | -179.1 | 177.3 | 0 | 0 | 111.7 | N174 E175 L176 A181 S182 | N174-E178 WeakPolarHBondContact O-CG 3.48Å; N174-E178 PolarHBondContact O-N 3.48Å; E175-E178 PolarHBondContact O-N 3.42Å; L176-E178 VanDerWaalsContact C-N 3.34Å; L176-E178 PolarHBondContact O-N 2.96Å; E178-A181 PolarHBondContact O-N 3.3Å; E178-S182 WeakPolarHBondContact O-CB 3.48Å; E178-S182 PolarHBondContact O-N 3.46Å |
| 179 | V | 97.9 | Very high | 98.4 | Very high | 66 Ų | 66 | 98.8 Ų | 98.8 | 40% | 0.4 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.8 | -48.3 | 175.5 | 170.3 | 0 | 0 | 0 | 0 | 110.9 | E175 L176 A181 S182 Y183 | E175-V179 VanDerWaalsContact O-CG2 3.32Å; E175-V179 WeakPolarHBondContact O-CG2 3.47Å; E175-V179 PolarHBondContact O-N 3.26Å; L176-V179 PolarHBondContact O-N 3.03Å; V179-A181 PolarHBondContact O-N 3.47Å; V179-S182 WeakPolarHBondContact O-CA 3.32Å; V179-S182 WeakPolarHBondContact O-CB 3.5Å; V179-S182 PolarHBondContact O-N 3.21Å; V179-S182 VanDerWaalsContact O-N 3.09Å; V179-S182 PolarHBondContact O-OG 2.96Å; V179-Y183 HydrophobicContact CG1-CD2 3.63Å; V179-Y183 HydrophobicContact CG1-CE2 3.39Å; V179-Y183 VanDerWaalsContact O-CD2 3.25Å; V179-Y183 WeakPolarHBondContact O-CD2 3.38Å; V179-Y183 PolarHBondContact O-N 3.32Å |
| 180 | C | 98 | Very high | 98.4 | Very high | 68 Ų | 68 | 102 Ų | 102 | 46% | 0.459 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -57.7 | -48.4 | 175.7 | -71.6 | 0 | 0 | 0 | 0 | 111.7 | L176 K177 S182 Y183 E184 | L176-C180 WeakPolarHBondContact O-CB 3.5Å; L176-C180 PolarHBondContact O-N 3.21Å; L176-C180 PolarHBondContact O-SG 3.11Å; K177-C180 PolarHBondContact O-N 2.9Å; C180-S182 PolarHBondContact O-N 3Å; C180-Y183 WeakPolarHBondContact O-CB 3.49Å; C180-Y183 PolarHBondContact O-N 3.46Å; C180-E184 WeakPolarHBondContact O-CG 3.45Å; C180-E184 PolarHBondContact O-N 2.85Å |
| 181 | A | 98.2 | Very high | 98.4 | Very high | 37 Ų | 37 | 102.2 Ų | 102.2 | 31% | 0.306 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.2 | -31.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | K177 E178 V179 R185 | K177-A181 WeakPolarHBondContact O-CB 3.25Å; K177-A181 PolarHBondContact O-N 2.94Å; E178-A181 PolarHBondContact O-N 3.3Å; V179-A181 PolarHBondContact O-N 3.47Å; A181-R185 PolarHBondContact O-N 3.28Å |
| 182 | S | 97.8 | Very high | 98.4 | Very high | 40 Ų | 40 | 101.7 Ų | 101.7 | 28% | 0.28 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -70 | -37.7 | 173.7 | 89.2 | 0 | 0 | 0 | 0 | 112.7 | E178 V179 C180 R186 | E178-S182 WeakPolarHBondContact O-CB 3.48Å; E178-S182 PolarHBondContact O-N 3.46Å; V179-S182 WeakPolarHBondContact O-CA 3.32Å; V179-S182 WeakPolarHBondContact O-CB 3.5Å; V179-S182 PolarHBondContact O-N 3.21Å; V179-S182 VanDerWaalsContact O-N 3.09Å; V179-S182 PolarHBondContact O-OG 2.96Å; C180-S182 PolarHBondContact O-N 3Å; S182-R186 WeakPolarHBondContact O-CB 3.42Å; S182-R186 PolarHBondContact O-N 3.42Å; S182-R186 VanDerWaalsContact O-N 3.11Å |
| 183 | Y | 98.3 | Very high | 98.4 | Very high | 125 Ų | 125 | 100.5 Ų | 100.5 | 49% | 0.49 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -69 | -46.3 | 176.4 | -82.8 | -67.8 | 0 | 0 | 0 | 111.2 | V179 C180 R185 R186 E187 | V179-Y183 HydrophobicContact CG1-CD2 3.63Å; V179-Y183 HydrophobicContact CG1-CE2 3.39Å; V179-Y183 VanDerWaalsContact O-CD2 3.25Å; V179-Y183 WeakPolarHBondContact O-CD2 3.38Å; V179-Y183 PolarHBondContact O-N 3.32Å; C180-Y183 WeakPolarHBondContact O-CB 3.49Å; C180-Y183 PolarHBondContact O-N 3.46Å; Y183-R185 VanDerWaalsContact C-N 3.26Å; Y183-R185 PolarHBondContact O-N 3.19Å; Y183-R186 CarbonylContact O-C 3.53Å; Y183-R186 WeakPolarHBondContact O-CA 3.46Å; Y183-R186 WeakPolarHBondContact O-CB 3.43Å; Y183-R186 PolarHBondContact O-N 3.17Å; Y183-E187 WeakPolarHBondContact O-CB 3.49Å; Y183-E187 PolarHBondContact O-N 3.11Å |
| 184 | E | 98.4 | Very high | 98.4 | Very high | 108 Ų | 108 | 101.2 Ų | 101.2 | 51% | 0.505 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -57.7 | -38.3 | 175.1 | -70.8 | 171.8 | -175.3 | 0 | 0 | 112.2 | C180 R188 | C180-E184 WeakPolarHBondContact O-CG 3.45Å; C180-E184 PolarHBondContact O-N 2.85Å; E184-R188 WeakPolarHBondContact O-CG 3.48Å; E184-R188 PolarHBondContact O-N 2.82Å; E184-R188 VanDerWaalsContact O-N 3.11Å; E184-R188 PolarHBondContact O-NE 3.01Å; E184-R188 VanDerWaalsContact O-NE 3.17Å |
| 185 | R | 98.5 | Very high | 98.4 | Very high | 138 Ų | 138 | 100.9 Ų | 100.9 | 52% | 0.521 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -67.3 | -40 | 175.3 | -167.3 | -174.9 | -62.7 | 108.9 | 0.7 | 111.6 | A181 Y183 L189 | A181-R185 PolarHBondContact O-N 3.28Å; Y183-R185 VanDerWaalsContact C-N 3.26Å; Y183-R185 PolarHBondContact O-N 3.19Å; R185-L189 WeakPolarHBondContact O-CG 3.45Å; R185-L189 PolarHBondContact O-N 3.38Å; R185-L189 VanDerWaalsContact O-N 3.17Å |
| 186 | R | 98.6 | Very high | 98.4 | Very high | 101 Ų | 101 | 100.4 Ų | 100.4 | 38% | 0.381 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -67.8 | -38.3 | 178.6 | -167.5 | -173 | -46.9 | 165.8 | 13.2 | 111.6 | S182 Y183 L189 R190 | S182-R186 WeakPolarHBondContact O-CB 3.42Å; S182-R186 PolarHBondContact O-N 3.42Å; S182-R186 VanDerWaalsContact O-N 3.11Å; Y183-R186 CarbonylContact O-C 3.53Å; Y183-R186 WeakPolarHBondContact O-CA 3.46Å; Y183-R186 WeakPolarHBondContact O-CB 3.43Å; Y183-R186 PolarHBondContact O-N 3.17Å; R186-L189 PolarHBondContact O-N 2.96Å; R186-R190 WeakPolarHBondContact O-CG 3.29Å; R186-R190 PolarHBondContact O-N 3.28Å; R186-R190 VanDerWaalsContact O-N 3.11Å |
| 187 | E | 98.5 | Very high | 98.4 | Very high | 111 Ų | 111 | 100.8 Ų | 100.8 | 52% | 0.519 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.3 | -50.4 | 176 | -174.3 | 163.6 | -139.7 | 0 | 0 | 111 | Y183 L189 R190 E191 | Y183-E187 WeakPolarHBondContact O-CB 3.49Å; Y183-E187 PolarHBondContact O-N 3.11Å; E187-L189 VanDerWaalsContact C-N 3.32Å; E187-L189 PolarHBondContact O-N 2.76Å; E187-R190 WeakPolarHBondContact O-CA 3.4Å; E187-R190 WeakPolarHBondContact O-CB 3.44Å; E187-R190 PolarHBondContact O-N 3.17Å; E187-E191 PolarHBondContact O-N 3.26Å |
| 188 | R | 98.5 | Very high | 98.4 | Very high | 123 Ų | 123 | 100.8 Ų | 100.8 | 46% | 0.464 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -54.4 | -44.4 | 174 | -76.1 | 179.5 | -77 | 140.6 | -14.8 | 113.5 | E184 R190 E191 E192 | E184-R188 WeakPolarHBondContact O-CG 3.48Å; E184-R188 PolarHBondContact O-N 2.82Å; E184-R188 VanDerWaalsContact O-N 3.11Å; E184-R188 PolarHBondContact O-NE 3.01Å; E184-R188 VanDerWaalsContact O-NE 3.17Å; R188-R190 VanDerWaalsContact C-N 3.29Å; R188-R190 PolarHBondContact O-N 2.87Å; R188-E191 PolarHBondContact O-N 2.91Å; R188-E192 WeakPolarHBondContact O-CG 3.35Å; R188-E192 PolarHBondContact O-N 3.11Å |
| 189 | L | 98.5 | Very high | 98.4 | Very high | 99 Ų | 99 | 99 Ų | 99 | 52% | 0.518 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.1 | -34.9 | 176.3 | -73.3 | 171.5 | 0 | 0 | 0 | 112.8 | R185 R186 E187 T193 | R185-L189 WeakPolarHBondContact O-CG 3.45Å; R185-L189 PolarHBondContact O-N 3.38Å; R185-L189 VanDerWaalsContact O-N 3.17Å; R186-L189 PolarHBondContact O-N 2.96Å; E187-L189 VanDerWaalsContact C-N 3.32Å; E187-L189 PolarHBondContact O-N 2.76Å; L189-T193 WeakPolarHBondContact O-CB 3.37Å; L189-T193 PolarHBondContact O-N 3.07Å; L189-T193 VanDerWaalsContact O-N 3.07Å; L189-T193 PolarHBondContact O-OG1 3.5Å |
| 190 | R | 98.5 | Very high | 98.5 | Very high | 156 Ų | 156 | 98.7 Ų | 98.7 | 59% | 0.589 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -70 | -41.4 | 175.3 | -72.6 | 172.7 | -175.1 | 156.9 | -5.6 | 111.3 | R186 E187 R188 T193 L194 | R186-R190 WeakPolarHBondContact O-CG 3.29Å; R186-R190 PolarHBondContact O-N 3.28Å; R186-R190 VanDerWaalsContact O-N 3.11Å; E187-R190 WeakPolarHBondContact O-CA 3.4Å; E187-R190 WeakPolarHBondContact O-CB 3.44Å; E187-R190 PolarHBondContact O-N 3.17Å; R188-R190 VanDerWaalsContact C-N 3.29Å; R188-R190 PolarHBondContact O-N 2.87Å; R190-T193 PolarHBondContact O-N 3.1Å; R190-L194 VanDerWaalsContact O-CB 3.29Å; R190-L194 WeakPolarHBondContact O-CB 3.34Å; R190-L194 PolarHBondContact O-N 3.33Å |
| 191 | E | 98.6 | Very high | 98.5 | Very high | 107 Ų | 107 | 100.1 Ų | 100.1 | 50% | 0.5 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61.2 | -48.2 | 175.4 | -69.4 | 175.6 | 158 | 0 | 0 | 111.2 | E187 R188 T193 L194 D195 | E187-E191 PolarHBondContact O-N 3.26Å; R188-E191 PolarHBondContact O-N 2.91Å; E191-T193 VanDerWaalsContact C-N 3.29Å; E191-T193 PolarHBondContact O-N 2.86Å; E191-L194 PolarHBondContact O-N 3.31Å; E191-L194 VanDerWaalsContact O-N 3.1Å; E191-D195 PolarHBondContact O-N 2.91Å |
| 192 | E | 98.5 | Very high | 98.5 | Very high | 122 Ų | 122 | 100.9 Ų | 100.9 | 57% | 0.57 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -56.2 | -43.6 | 174.5 | -73.1 | 170.7 | -168.7 | 0 | 0 | 111.8 | R188 D195 Q196 | R188-E192 WeakPolarHBondContact O-CG 3.35Å; R188-E192 PolarHBondContact O-N 3.11Å; E192-D195 PolarHBondContact O-N 3.39Å; E192-Q196 WeakPolarHBondContact O-CB 3.34Å; E192-Q196 PolarHBondContact O-N 3.43Å |
| 193 | T | 98.5 | Very high | 98.6 | Very high | 83 Ų | 83 | 104.7 Ų | 104.7 | 51% | 0.509 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.6 | -40.7 | 177 | -57.2 | 0 | 0 | 0 | 0 | 111.7 | L189 R190 E191 Q196 L197 | L189-T193 WeakPolarHBondContact O-CB 3.37Å; L189-T193 PolarHBondContact O-N 3.07Å; L189-T193 VanDerWaalsContact O-N 3.07Å; L189-T193 PolarHBondContact O-OG1 3.5Å; R190-T193 PolarHBondContact O-N 3.1Å; E191-T193 VanDerWaalsContact C-N 3.29Å; E191-T193 PolarHBondContact O-N 2.86Å; T193-Q196 PolarHBondContact O-N 2.88Å; T193-L197 HydrophobicContact CG2-CD1 4.26Å; T193-L197 WeakPolarHBondContact O-CG 3.38Å; T193-L197 PolarHBondContact O-N 3.37Å |
| 194 | L | 98.7 | Very high | 98.6 | Very high | 88 Ų | 88 | 104.1 Ų | 104.1 | 46% | 0.461 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67 | -39.4 | 179.6 | -178.2 | 145.7 | 0 | 0 | 0 | 111.3 | R190 E191 L197 K198 | R190-L194 VanDerWaalsContact O-CB 3.29Å; R190-L194 WeakPolarHBondContact O-CB 3.34Å; R190-L194 PolarHBondContact O-N 3.33Å; E191-L194 PolarHBondContact O-N 3.31Å; E191-L194 VanDerWaalsContact O-N 3.1Å; L194-L197 PolarHBondContact O-N 2.93Å; L194-K198 HydrophobicContact CD2-CD 3.91Å; L194-K198 HydrophobicContact CD2-CG 4.48Å; L194-K198 WeakPolarHBondContact O-CG 3.33Å; L194-K198 PolarHBondContact O-N 3.48Å |
| 195 | D | 98.7 | Very high | 98.6 | Very high | 79 Ų | 79 | 104.5 Ų | 104.5 | 42% | 0.422 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66.5 | -39.3 | 173.9 | -75.2 | -17.5 | 0 | 0 | 0 | 112 | E191 E192 K198 Q199 | E191-D195 PolarHBondContact O-N 2.91Å; E192-D195 PolarHBondContact O-N 3.39Å; D195-K198 PolarHBondContact O-N 3Å; D195-K198 IonicContact OD1-NZ 3.96Å; D195-Q199 WeakPolarHBondContact O-CG 3.38Å; D195-Q199 PolarHBondContact O-N 2.94Å |
| 196 | Q | 98.6 | Very high | 98.6 | Very high | 86 Ų | 86 | 101.9 Ų | 101.9 | 40% | 0.402 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.9 | -46.4 | 172.6 | -176 | 57.5 | 53.9 | 0 | 0 | 111.5 | E192 T193 K198 Q199 D200 | E192-Q196 WeakPolarHBondContact O-CB 3.34Å; E192-Q196 PolarHBondContact O-N 3.43Å; T193-Q196 PolarHBondContact O-N 2.88Å; Q196-K198 VanDerWaalsContact C-N 3.34Å; Q196-K198 PolarHBondContact O-N 3.02Å; Q196-Q199 WeakPolarHBondContact O-CB 3.49Å; Q196-Q199 PolarHBondContact O-N 3.34Å; Q196-D200 VanDerWaalsContact NE2-CG 3.34Å; Q196-D200 PolarHBondContact NE2-OD1 3.15Å; Q196-D200 VanDerWaalsContact NE2-OD1 3.15Å; Q196-D200 PolarHBondContact NE2-OD2 2.95Å; Q196-D200 PolarHBondContact O-N 3.31Å |
| 197 | L | 98.6 | Very high | 98.6 | Very high | 113 Ų | 113 | 101.7 Ų | 101.7 | 59% | 0.592 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.3 | -38.8 | 177.2 | -74.2 | 171.7 | 0 | 0 | 0 | 112.4 | T193 L194 D200 L201 | T193-L197 HydrophobicContact CG2-CD1 4.26Å; T193-L197 WeakPolarHBondContact O-CG 3.38Å; T193-L197 PolarHBondContact O-N 3.37Å; L194-L197 PolarHBondContact O-N 2.93Å; L197-D200 PolarHBondContact O-N 3.35Å; L197-L201 WeakPolarHBondContact O-CB 3.5Å; L197-L201 PolarHBondContact O-N 3.01Å |
| 198 | K | 98.7 | Very high | 98.6 | Very high | 124 Ų | 124 | 101.5 Ų | 101.5 | 54% | 0.539 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.7 | -43.9 | 173.6 | -77.2 | 173.1 | 177.1 | 164.7 | 0 | 111.8 | L194 D195 Q196 L201 A202 | L194-K198 HydrophobicContact CD2-CD 3.91Å; L194-K198 HydrophobicContact CD2-CG 4.48Å; L194-K198 WeakPolarHBondContact O-CG 3.33Å; L194-K198 PolarHBondContact O-N 3.48Å; D195-K198 PolarHBondContact O-N 3Å; D195-K198 IonicContact OD1-NZ 3.96Å; Q196-K198 VanDerWaalsContact C-N 3.34Å; Q196-K198 PolarHBondContact O-N 3.02Å; K198-L201 PolarHBondContact O-N 3.2Å; K198-A202 PolarHBondContact O-N 3.44Å |
| 199 | Q | 98.6 | Very high | 98.6 | Very high | 106 Ų | 106 | 99.8 Ų | 99.8 | 50% | 0.495 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.2 | -43 | 176.9 | -71 | 176.4 | 29.7 | 0 | 0 | 111.6 | D195 Q196 A202 K203 | D195-Q199 WeakPolarHBondContact O-CG 3.38Å; D195-Q199 PolarHBondContact O-N 2.94Å; Q196-Q199 WeakPolarHBondContact O-CB 3.49Å; Q196-Q199 PolarHBondContact O-N 3.34Å; Q199-A202 PolarHBondContact O-N 3.33Å; Q199-K203 WeakPolarHBondContact O-CG 3.43Å; Q199-K203 PolarHBondContact O-N 3Å |
| 200 | D | 98.7 | Very high | 98.6 | Very high | 58 Ų | 58 | 97.2 Ų | 97.2 | 31% | 0.31 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -69.2 | -36.6 | 179.5 | -66.9 | -26.3 | 0 | 0 | 0 | 112 | Q196 L197 A202 K203 L204 | Q196-D200 VanDerWaalsContact NE2-CG 3.34Å; Q196-D200 PolarHBondContact NE2-OD1 3.15Å; Q196-D200 VanDerWaalsContact NE2-OD1 3.15Å; Q196-D200 PolarHBondContact NE2-OD2 2.95Å; Q196-D200 PolarHBondContact O-N 3.31Å; L197-D200 PolarHBondContact O-N 3.35Å; D200-A202 PolarHBondContact O-N 3.49Å; D200-K203 PolarHBondContact O-N 2.97Å; D200-K203 IonicContact OD1-NZ 2.85Å; D200-K203 PolarHBondContact OD1-NZ 2.85Å; D200-L204 WeakPolarHBondContact O-CG 3.31Å; D200-L204 PolarHBondContact O-N 2.98Å |
| 201 | L | 98.7 | Very high | 98.6 | Very high | 98 Ų | 98 | 94.5 Ų | 94.5 | 51% | 0.513 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.8 | -44.9 | 170.7 | -176.4 | 65.5 | 0 | 0 | 0 | 111.5 | L197 K198 K203 L204 Q205 | L197-L201 WeakPolarHBondContact O-CB 3.5Å; L197-L201 PolarHBondContact O-N 3.01Å; K198-L201 PolarHBondContact O-N 3.2Å; L201-K203 PolarHBondContact O-N 3.03Å; L201-L204 PolarHBondContact O-N 3.27Å; L201-Q205 WeakPolarHBondContact O-CG 3.4Å; L201-Q205 PolarHBondContact O-N 3.4Å |
| 202 | A | 98.6 | Very high | 98.5 | Very high | 53 Ų | 53 | 94 Ų | 94 | 44% | 0.438 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.1 | -39.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | K198 Q199 D200 Q205 S206 | K198-A202 PolarHBondContact O-N 3.44Å; Q199-A202 PolarHBondContact O-N 3.33Å; D200-A202 PolarHBondContact O-N 3.49Å; A202-Q205 PolarHBondContact O-N 2.87Å; A202-S206 PolarHBondContact O-N 3.02Å |
| 203 | K | 98.6 | Very high | 98.5 | Very high | 120 Ų | 120 | 93.6 Ų | 93.6 | 52% | 0.522 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.6 | -45 | 173.8 | -68.9 | 170.7 | -162.6 | 156.6 | 0 | 111.6 | Q199 D200 L201 S206 L207 | Q199-K203 WeakPolarHBondContact O-CG 3.43Å; Q199-K203 PolarHBondContact O-N 3Å; D200-K203 PolarHBondContact O-N 2.97Å; D200-K203 IonicContact OD1-NZ 2.85Å; D200-K203 PolarHBondContact OD1-NZ 2.85Å; L201-K203 PolarHBondContact O-N 3.03Å; K203-S206 PolarHBondContact O-N 3.3Å; K203-L207 WeakPolarHBondContact O-CB 3.39Å; K203-L207 PolarHBondContact O-N 2.92Å |
| 204 | L | 98.6 | Very high | 98.5 | Very high | 114 Ų | 114 | 94 Ų | 94 | 60% | 0.597 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64.6 | -39.3 | 178 | -74.2 | 172.9 | 0 | 0 | 0 | 111.9 | D200 L201 L207 N208 | D200-L204 WeakPolarHBondContact O-CG 3.31Å; D200-L204 PolarHBondContact O-N 2.98Å; L201-L204 PolarHBondContact O-N 3.27Å; L204-L207 PolarHBondContact O-N 3.43Å; L204-N208 VanDerWaalsContact O-CB 3.31Å; L204-N208 WeakPolarHBondContact O-CB 3.39Å; L204-N208 PolarHBondContact O-N 2.89Å |
| 205 | Q | 98.7 | Very high | 98.5 | Very high | 116 Ų | 116 | 93.6 Ų | 93.6 | 54% | 0.542 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.1 | -44.7 | 174.1 | -74.8 | 173.5 | -24.7 | 0 | 0 | 111.6 | L201 A202 N208 V209 | L201-Q205 WeakPolarHBondContact O-CG 3.4Å; L201-Q205 PolarHBondContact O-N 3.4Å; A202-Q205 PolarHBondContact O-N 2.87Å; Q205-N208 PolarHBondContact O-N 3.26Å; Q205-V209 WeakPolarHBondContact O-CG2 3.32Å; Q205-V209 PolarHBondContact O-N 3.46Å |
| 206 | S | 98.3 | Very high | 98.5 | Very high | 83 Ų | 83 | 94.4 Ų | 94.4 | 58% | 0.58 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -60.9 | -45.5 | 175.3 | -177.9 | 0 | 0 | 0 | 0 | 112.2 | A202 K203 N208 V209 A210 | A202-S206 PolarHBondContact O-N 3.02Å; K203-S206 PolarHBondContact O-N 3.3Å; S206-N208 VanDerWaalsContact C-N 3.32Å; S206-N208 PolarHBondContact O-N 3.26Å; S206-V209 PolarHBondContact O-N 3.38Å; S206-A210 PolarHBondContact O-N 3.27Å |
| 207 | L | 98.5 | Very high | 98.4 | Very high | 96 Ų | 96 | 96.3 Ų | 96.3 | 50% | 0.503 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.7 | -40.2 | 175.8 | -179.8 | 63.6 | 0 | 0 | 0 | 111.9 | K203 L204 A210 L211 | K203-L207 WeakPolarHBondContact O-CB 3.39Å; K203-L207 PolarHBondContact O-N 2.92Å; L204-L207 PolarHBondContact O-N 3.43Å; L207-A210 PolarHBondContact O-N 2.93Å; L207-L211 HydrophobicContact CD1-CD1 4.47Å; L207-L211 HydrophobicContact CD1-CG 4.45Å; L207-L211 HydrophobicContact CG-CD1 4.16Å; L207-L211 WeakPolarHBondContact O-CG 3.32Å; L207-L211 PolarHBondContact O-N 3.43Å |
| 208 | N | 98.3 | Very high | 98.4 | Very high | 108 Ų | 108 | 94.9 Ų | 94.9 | 58% | 0.578 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.4 | -42.5 | 178.2 | -168.8 | -92.6 | 0 | 0 | 0 | 111.6 | L204 Q205 S206 L211 Q212 | L204-N208 VanDerWaalsContact O-CB 3.31Å; L204-N208 WeakPolarHBondContact O-CB 3.39Å; L204-N208 PolarHBondContact O-N 2.89Å; Q205-N208 PolarHBondContact O-N 3.26Å; S206-N208 VanDerWaalsContact C-N 3.32Å; S206-N208 PolarHBondContact O-N 3.26Å; N208-L211 PolarHBondContact O-N 3.3Å; N208-Q212 WeakPolarHBondContact O-CB 3.42Å; N208-Q212 PolarHBondContact O-N 3.07Å |
| 209 | V | 98.6 | Very high | 98.4 | Very high | 86 Ų | 86 | 94.7 Ų | 94.7 | 52% | 0.521 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.5 | -43.2 | 174.1 | 173.3 | 0 | 0 | 0 | 0 | 111.4 | Q205 S206 Q212 M213 | Q205-V209 WeakPolarHBondContact O-CG2 3.32Å; Q205-V209 PolarHBondContact O-N 3.46Å; S206-V209 PolarHBondContact O-N 3.38Å; V209-Q212 PolarHBondContact O-N 3.03Å; V209-M213 WeakPolarHBondContact O-CG 3.5Å; V209-M213 PolarHBondContact O-N 3.46Å |
| 210 | A | 98.4 | Very high | 98.4 | Very high | 46 Ų | 46 | 93.2 Ų | 93.2 | 38% | 0.38 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.2 | -43.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | S206 L207 Q212 M213 Q214 | S206-A210 PolarHBondContact O-N 3.27Å; L207-A210 PolarHBondContact O-N 2.93Å; A210-Q212 VanDerWaalsContact C-N 3.34Å; A210-M213 PolarHBondContact O-N 2.93Å; A210-Q214 PolarHBondContact O-N 3.3Å |
| 211 | L | 98.2 | Very high | 98.3 | Very high | 98 Ų | 98 | 96 Ų | 96 | 51% | 0.513 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.2 | -38.8 | 175.3 | -74 | 171 | 0 | 0 | 0 | 111.9 | L207 N208 Q214 V215 | L207-L211 HydrophobicContact CD1-CD1 4.47Å; L207-L211 HydrophobicContact CD1-CG 4.45Å; L207-L211 HydrophobicContact CG-CD1 4.16Å; L207-L211 WeakPolarHBondContact O-CG 3.32Å; L207-L211 PolarHBondContact O-N 3.43Å; N208-L211 PolarHBondContact O-N 3.3Å; L211-Q214 PolarHBondContact O-N 2.94Å; L211-V215 WeakPolarHBondContact O-CG2 3.48Å; L211-V215 PolarHBondContact O-N 3.01Å |
| 212 | Q | 98.5 | Very high | 98.3 | Very high | 97 Ų | 97 | 95.8 Ų | 95.8 | 45% | 0.453 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.3 | -44 | 176.8 | -175.8 | 60.1 | 35 | 0 | 0 | 111.5 | N208 V209 A210 Q214 V215 E216 | N208-Q212 WeakPolarHBondContact O-CB 3.42Å; N208-Q212 PolarHBondContact O-N 3.07Å; V209-Q212 PolarHBondContact O-N 3.03Å; A210-Q212 VanDerWaalsContact C-N 3.34Å; Q212-Q214 VanDerWaalsContact C-N 3.34Å; Q212-Q214 PolarHBondContact O-N 3.47Å; Q212-V215 PolarHBondContact O-N 3.29Å; Q212-E216 PolarHBondContact NE2-OE1 3.05Å; Q212-E216 VanDerWaalsContact NE2-OE1 3.07Å; Q212-E216 WeakPolarHBondContact O-CG 3.4Å; Q212-E216 PolarHBondContact O-N 3.05Å |
| 213 | M | 97.9 | Very high | 98.3 | Very high | 113 Ų | 113 | 97.3 Ų | 97.3 | 56% | 0.557 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.5 | -40.3 | 174.4 | -68.2 | -172.3 | -59.2 | 0 | 0 | 112.2 | V209 A210 V215 E216 E217 | V209-M213 WeakPolarHBondContact O-CG 3.5Å; V209-M213 PolarHBondContact O-N 3.46Å; A210-M213 PolarHBondContact O-N 2.93Å; M213-V215 VanDerWaalsContact C-N 3.35Å; M213-E216 PolarHBondContact O-N 3.28Å; M213-E217 PolarHBondContact O-N 3.39Å |
| 214 | Q | 98.1 | Very high | 98.2 | Very high | 91 Ų | 91 | 94.3 Ų | 94.3 | 43% | 0.425 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.3 | -42.8 | 175.9 | -173.7 | 66.2 | 47.4 | 0 | 0 | 111.5 | A210 L211 Q212 E216 E217 D218 | A210-Q214 PolarHBondContact O-N 3.3Å; L211-Q214 PolarHBondContact O-N 2.94Å; Q212-Q214 VanDerWaalsContact C-N 3.34Å; Q212-Q214 PolarHBondContact O-N 3.47Å; Q214-E216 VanDerWaalsContact C-N 3.31Å; Q214-E216 PolarHBondContact O-N 2.89Å; Q214-E217 PolarHBondContact O-N 3.49Å; Q214-D218 PolarHBondContact NE2-OD1 3.21Å; Q214-D218 WeakPolarHBondContact O-CB 3.33Å; Q214-D218 VanDerWaalsContact O-CG 3.22Å; Q214-D218 PolarHBondContact O-N 2.87Å |
| 215 | V | 98.4 | Very high | 98.2 | Very high | 81 Ų | 81 | 91.5 Ų | 91.5 | 49% | 0.491 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.8 | -40.7 | 177.2 | 169.3 | 0 | 0 | 0 | 0 | 111.1 | L211 Q212 M213 D218 E219 | L211-V215 WeakPolarHBondContact O-CG2 3.48Å; L211-V215 PolarHBondContact O-N 3.01Å; Q212-V215 PolarHBondContact O-N 3.29Å; M213-V215 VanDerWaalsContact C-N 3.35Å; V215-D218 PolarHBondContact O-N 3.45Å; V215-E219 WeakPolarHBondContact O-CB 3.41Å; V215-E219 PolarHBondContact O-N 3.05Å |
| 216 | E | 98.1 | Very high | 98.1 | Very high | 96 Ų | 96 | 93.2 Ų | 93.2 | 45% | 0.449 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.3 | -37.6 | 176.7 | -71.6 | 168.7 | -164.1 | 0 | 0 | 112.7 | Q212 M213 Q214 S220 | Q212-E216 PolarHBondContact NE2-OE1 3.05Å; Q212-E216 VanDerWaalsContact NE2-OE1 3.07Å; Q212-E216 WeakPolarHBondContact O-CG 3.4Å; Q212-E216 PolarHBondContact O-N 3.05Å; M213-E216 PolarHBondContact O-N 3.28Å; Q214-E216 VanDerWaalsContact C-N 3.31Å; Q214-E216 PolarHBondContact O-N 2.89Å; E216-S220 WeakPolarHBondContact O-CB 3.42Å; E216-S220 PolarHBondContact O-N 3.3Å; E216-S220 PolarHBondContact O-OG 2.9Å |
| 217 | E | 98.1 | Very high | 98.1 | Very high | 126 Ų | 126 | 93.6 Ų | 93.6 | 59% | 0.589 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -65.8 | -47.2 | 173.6 | -176.9 | 172.7 | -168.2 | 0 | 0 | 111.4 | M213 Q214 E219 S220 H221 | M213-E217 PolarHBondContact O-N 3.39Å; Q214-E217 PolarHBondContact O-N 3.49Å; E217-E219 VanDerWaalsContact C-N 3.33Å; E217-E219 PolarHBondContact O-N 3.43Å; E217-S220 WeakPolarHBondContact O-CB 3.48Å; E217-S220 PolarHBondContact O-N 3.45Å; E217-H221 PolarHBondContact O-N 2.89Å |
| 218 | D | 98.2 | Very high | 98 | Very high | 83 Ų | 83 | 95.9 Ų | 95.9 | 44% | 0.444 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.8 | -40.6 | 177.9 | -70.5 | -9.5 | 0 | 0 | 0 | 111.1 | Q214 V215 H221 V222 | Q214-D218 PolarHBondContact NE2-OD1 3.21Å; Q214-D218 WeakPolarHBondContact O-CB 3.33Å; Q214-D218 VanDerWaalsContact O-CG 3.22Å; Q214-D218 PolarHBondContact O-N 2.87Å; V215-D218 PolarHBondContact O-N 3.45Å; D218-H221 WeakPolarHBondContact O-CB 3.34Å; D218-H221 PolarHBondContact O-N 2.87Å; D218-V222 VanDerWaalsContact O-CG2 3.31Å; D218-V222 WeakPolarHBondContact O-CG2 3.34Å; D218-V222 PolarHBondContact O-N 3.24Å |
| 219 | E | 98.4 | Very high | 97.9 | Very high | 119 Ų | 119 | 95 Ų | 95 | 56% | 0.556 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.2 | -45.9 | 174.2 | -177.3 | 173.7 | -170.7 | 0 | 0 | 111.2 | V215 E217 H221 V222 I223 | V215-E219 WeakPolarHBondContact O-CB 3.41Å; V215-E219 PolarHBondContact O-N 3.05Å; E217-E219 VanDerWaalsContact C-N 3.33Å; E217-E219 PolarHBondContact O-N 3.43Å; E219-H221 VanDerWaalsContact C-N 3.31Å; E219-H221 PolarHBondContact O-N 3Å; E219-V222 PolarHBondContact O-N 2.94Å; E219-I223 HydrophobicContact CG-CD1 4.24Å; E219-I223 WeakPolarHBondContact O-CG1 3.43Å; E219-I223 PolarHBondContact O-N 2.95Å |
| 220 | S | 98 | Very high | 97.8 | Very high | 76 Ų | 76 | 95.5 Ų | 95.5 | 53% | 0.531 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.5 | -40.2 | 175.8 | -59.9 | 0 | 0 | 0 | 0 | 111.8 | E216 E217 I223 A224 | E216-S220 WeakPolarHBondContact O-CB 3.42Å; E216-S220 PolarHBondContact O-N 3.3Å; E216-S220 PolarHBondContact O-OG 2.9Å; E217-S220 WeakPolarHBondContact O-CB 3.48Å; E217-S220 PolarHBondContact O-N 3.45Å; S220-I223 PolarHBondContact O-N 2.9Å; S220-A224 PolarHBondContact O-N 3.31Å |
| 221 | H | 97.8 | Very high | 97.7 | Very high | 115 Ų | 115 | 98 Ų | 98 | 53% | 0.532 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.4 | -42.7 | 176.5 | -169.8 | 79.1 | 0 | 0 | 0 | 112 | E217 D218 E219 A224 L225 | E217-H221 PolarHBondContact O-N 2.89Å; D218-H221 WeakPolarHBondContact O-CB 3.34Å; D218-H221 PolarHBondContact O-N 2.87Å; E219-H221 VanDerWaalsContact C-N 3.31Å; E219-H221 PolarHBondContact O-N 3Å; H221-A224 PolarHBondContact O-N 3.49Å; H221-L225 WeakPolarHBondContact NE2-CD1 3.47Å; H221-L225 WeakPolarHBondContact O-CB 3.31Å; H221-L225 WeakPolarHBondContact O-CG 3.48Å; H221-L225 PolarHBondContact O-N 3.27Å |
| 222 | V | 98 | Very high | 97.6 | Very high | 95 Ų | 95 | 98.2 Ų | 98.2 | 58% | 0.576 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.2 | -41.4 | 176.5 | 169.7 | 0 | 0 | 0 | 0 | 111.3 | D218 E219 L225 K226 | D218-V222 VanDerWaalsContact O-CG2 3.31Å; D218-V222 WeakPolarHBondContact O-CG2 3.34Å; D218-V222 PolarHBondContact O-N 3.24Å; E219-V222 PolarHBondContact O-N 2.94Å; V222-L225 PolarHBondContact O-N 2.89Å; V222-K226 WeakPolarHBondContact O-CB 3.45Å; V222-K226 PolarHBondContact O-N 3.47Å |
| 223 | I | 97.8 | Very high | 97.4 | Very high | 85 Ų | 85 | 98.1 Ų | 98.1 | 44% | 0.436 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.2 | -49.2 | 174.8 | -67.1 | 165 | 0 | 0 | 0 | 110.4 | E219 S220 L225 K226 D227 | E219-I223 HydrophobicContact CG-CD1 4.24Å; E219-I223 WeakPolarHBondContact O-CG1 3.43Å; E219-I223 PolarHBondContact O-N 2.95Å; S220-I223 PolarHBondContact O-N 2.9Å; I223-L225 VanDerWaalsContact C-N 3.34Å; I223-L225 PolarHBondContact O-N 2.91Å; I223-K226 WeakPolarHBondContact O-CB 3.28Å; I223-K226 PolarHBondContact O-N 3.13Å; I223-K226 VanDerWaalsContact O-N 3.13Å; I223-D227 PolarHBondContact O-N 3.4Å |
| 224 | A | 97.7 | Very high | 97.2 | Very high | 57 Ų | 57 | 97.3 Ų | 97.3 | 47% | 0.471 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.4 | -41.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | S220 H221 D227 R228 | S220-A224 PolarHBondContact O-N 3.31Å; H221-A224 PolarHBondContact O-N 3.49Å; A224-D227 PolarHBondContact O-N 2.89Å; A224-R228 WeakPolarHBondContact O-CB 3.45Å; A224-R228 PolarHBondContact O-N 2.86Å |
| 225 | L | 97.5 | Very high | 97 | Very high | 55 Ų | 55 | 98.3 Ų | 98.3 | 29% | 0.288 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.1 | -43.9 | 173.8 | -77.8 | 177.3 | 0 | 0 | 0 | 111.3 | H221 V222 I223 R228 H229 | H221-L225 WeakPolarHBondContact NE2-CD1 3.47Å; H221-L225 WeakPolarHBondContact O-CB 3.31Å; H221-L225 WeakPolarHBondContact O-CG 3.48Å; H221-L225 PolarHBondContact O-N 3.27Å; V222-L225 PolarHBondContact O-N 2.89Å; I223-L225 VanDerWaalsContact C-N 3.34Å; I223-L225 PolarHBondContact O-N 2.91Å; L225-R228 PolarHBondContact O-N 2.71Å; L225-H229 PolarHBondContact O-N 3.02Å; L225-H229 PolarHBondContact O-ND1 3.32Å |
| 226 | K | 97.9 | Very high | 96.7 | Very high | 152 Ų | 152 | 99.4 Ų | 99.4 | 66% | 0.661 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.5 | -45.8 | 177.5 | -178 | -174.1 | 173.7 | -172.2 | 0 | 111.3 | V222 I223 R228 H229 Q230 | V222-K226 WeakPolarHBondContact O-CB 3.45Å; V222-K226 PolarHBondContact O-N 3.47Å; I223-K226 WeakPolarHBondContact O-CB 3.28Å; I223-K226 PolarHBondContact O-N 3.13Å; I223-K226 VanDerWaalsContact O-N 3.13Å; K226-R228 PolarHBondContact O-N 3.32Å; K226-H229 PolarHBondContact O-N 3.01Å; K226-Q230 WeakPolarHBondContact O-CB 3.43Å; K226-Q230 PolarHBondContact O-N 3.4Å |
| 227 | D | 97.6 | Very high | 96.4 | Very high | 90 Ų | 90 | 98.3 Ų | 98.3 | 48% | 0.481 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.3 | -41.3 | 177.7 | -69.6 | -12.9 | 0 | 0 | 0 | 111.4 | I223 A224 Q230 I231 | I223-D227 PolarHBondContact O-N 3.4Å; A224-D227 PolarHBondContact O-N 2.89Å; D227-Q230 WeakPolarHBondContact O-CB 3.39Å; D227-Q230 PolarHBondContact O-N 3.01Å; D227-I231 WeakPolarHBondContact O-CG1 3.47Å; D227-I231 PolarHBondContact O-N 3.31Å |
| 228 | R | 97 | Very high | 95.9 | Very high | 145 Ų | 145 | 96.8 Ų | 96.8 | 55% | 0.547 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.3 | -47.9 | 174.2 | -172.7 | -174.1 | 72.1 | 163.8 | 3.6 | 111.9 | A224 L225 K226 Q230 I231 E232 | A224-R228 WeakPolarHBondContact O-CB 3.45Å; A224-R228 PolarHBondContact O-N 2.86Å; L225-R228 PolarHBondContact O-N 2.71Å; K226-R228 PolarHBondContact O-N 3.32Å; R228-Q230 VanDerWaalsContact C-N 3.29Å; R228-Q230 PolarHBondContact O-N 3.36Å; R228-I231 PolarHBondContact O-N 3.45Å; R228-E232 PolarHBondContact O-N 2.72Å |
| 229 | H | 96.5 | Very high | 95.4 | Very high | 90 Ų | 90 | 100.4 Ų | 100.4 | 42% | 0.417 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.3 | -37.6 | 177.7 | -73.7 | 98.8 | 0 | 0 | 0 | 111.5 | L225 K226 E232 I233 | L225-H229 PolarHBondContact O-N 3.02Å; L225-H229 PolarHBondContact O-ND1 3.32Å; K226-H229 PolarHBondContact O-N 3.01Å; H229-E232 PolarHBondContact O-N 3.48Å; H229-I233 VanDerWaalsContact O-CG1 3.28Å; H229-I233 WeakPolarHBondContact O-CG1 3.4Å; H229-I233 PolarHBondContact O-N 3.29Å |
| 230 | Q | 96.9 | Very high | 94.7 | Very high | 96 Ų | 96 | 97.3 Ų | 97.3 | 45% | 0.449 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.2 | -46.5 | 175.8 | -178.2 | 60.5 | 35.7 | 0 | 0 | 111.4 | K226 D227 R228 E232 I233 E234 | K226-Q230 WeakPolarHBondContact O-CB 3.43Å; K226-Q230 PolarHBondContact O-N 3.4Å; D227-Q230 WeakPolarHBondContact O-CB 3.39Å; D227-Q230 PolarHBondContact O-N 3.01Å; R228-Q230 VanDerWaalsContact C-N 3.29Å; R228-Q230 PolarHBondContact O-N 3.36Å; Q230-E232 VanDerWaalsContact C-N 3.34Å; Q230-E232 PolarHBondContact O-N 3.45Å; Q230-I233 PolarHBondContact O-N 2.95Å; Q230-E234 PolarHBondContact NE2-OE1 2.95Å; Q230-E234 WeakPolarHBondContact O-CG 3.32Å; Q230-E234 PolarHBondContact O-N 3.28Å |
| 231 | I | 95.8 | Very high | 93.8 | Very high | 98 Ų | 98 | 97.9 Ų | 97.9 | 50% | 0.503 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.7 | -42.8 | 175.5 | -66.3 | 163.9 | 0 | 0 | 0 | 111.1 | D227 R228 E234 L235 | D227-I231 WeakPolarHBondContact O-CG1 3.47Å; D227-I231 PolarHBondContact O-N 3.31Å; R228-I231 PolarHBondContact O-N 3.45Å; I231-E234 PolarHBondContact O-N 2.94Å; I231-L235 HydrophobicContact CG2-CD1 4.02Å; I231-L235 HydrophobicContact CG2-CG 4.4Å; I231-L235 WeakPolarHBondContact O-CG 3.33Å; I231-L235 PolarHBondContact O-N 2.95Å |
| 232 | E | 94.7 | Very high | 92.8 | Very high | 102 Ų | 102 | 95.1 Ų | 95.1 | 48% | 0.477 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.2 | -43.3 | 178.9 | -173.5 | 174.1 | -172.3 | 0 | 0 | 112.2 | R228 H229 Q230 E234 L235 L236 | R228-E232 PolarHBondContact O-N 2.72Å; H229-E232 PolarHBondContact O-N 3.48Å; Q230-E232 VanDerWaalsContact C-N 3.34Å; Q230-E232 PolarHBondContact O-N 3.45Å; E232-E234 VanDerWaalsContact C-N 3.34Å; E232-E234 PolarHBondContact O-N 3Å; E232-L235 PolarHBondContact O-N 3.37Å; E232-L236 HydrophobicContact CG-CD1 4.24Å; E232-L236 WeakPolarHBondContact O-CB 3.3Å; E232-L236 WeakPolarHBondContact O-CG 3.38Å; E232-L236 PolarHBondContact O-N 3.43Å |
| 233 | I | 95 | Very high | 91.3 | Very high | 96 Ų | 96 | 99.8 Ų | 99.8 | 49% | 0.492 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.9 | -44.1 | 174.4 | -69.2 | 166 | 0 | 0 | 0 | 110.6 | H229 Q230 L236 T237 | H229-I233 VanDerWaalsContact O-CG1 3.28Å; H229-I233 WeakPolarHBondContact O-CG1 3.4Å; H229-I233 PolarHBondContact O-N 3.29Å; Q230-I233 PolarHBondContact O-N 2.95Å; I233-L236 PolarHBondContact O-N 3.47Å; I233-T237 VanDerWaalsContact O-CB 3.3Å; I233-T237 WeakPolarHBondContact O-CB 3.37Å; I233-T237 PolarHBondContact O-N 2.86Å; I233-T237 PolarHBondContact O-OG1 2.92Å |
| 234 | E | 94.2 | Very high | 89.6 | Confident | 96 Ų | 96 | 102.5 Ų | 102.5 | 45% | 0.449 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.2 | -43.2 | 177.4 | -74.3 | 172 | -164.7 | 0 | 0 | 111.8 | Q230 I231 E232 T237 N238 | Q230-E234 PolarHBondContact NE2-OE1 2.95Å; Q230-E234 WeakPolarHBondContact O-CG 3.32Å; Q230-E234 PolarHBondContact O-N 3.28Å; I231-E234 PolarHBondContact O-N 2.94Å; E232-E234 VanDerWaalsContact C-N 3.34Å; E232-E234 PolarHBondContact O-N 3Å; E234-T237 PolarHBondContact O-N 3.39Å; E234-N238 WeakPolarHBondContact O-CB 3.47Å; E234-N238 PolarHBondContact O-N 2.95Å; E234-N238 PolarHBondContact O-ND2 3.33Å; E234-N238 VanDerWaalsContact O-ND2 3.13Å |
| 235 | L | 93.3 | Very high | 87.7 | Confident | 112 Ų | 112 | 107.2 Ų | 107.2 | 59% | 0.586 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.1 | -44.8 | 175.8 | -73.5 | 171.8 | 0 | 0 | 0 | 112.3 | I231 E232 N238 K239 | I231-L235 HydrophobicContact CG2-CD1 4.02Å; I231-L235 HydrophobicContact CG2-CG 4.4Å; I231-L235 WeakPolarHBondContact O-CG 3.33Å; I231-L235 PolarHBondContact O-N 2.95Å; E232-L235 PolarHBondContact O-N 3.37Å; L235-N238 PolarHBondContact O-N 3.13Å; L235-K239 WeakPolarHBondContact O-CB 3.37Å; L235-K239 PolarHBondContact O-N 3.2Å |
| 236 | L | 92.5 | Very high | 85.7 | Confident | 104 Ų | 104 | 108.9 Ų | 108.9 | 55% | 0.545 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.5 | -39.9 | 177.4 | -71.6 | 174.1 | 0 | 0 | 0 | 111.7 | E232 I233 K239 A240 | E232-L236 HydrophobicContact CG-CD1 4.24Å; E232-L236 WeakPolarHBondContact O-CB 3.3Å; E232-L236 WeakPolarHBondContact O-CG 3.38Å; E232-L236 PolarHBondContact O-N 3.43Å; I233-L236 PolarHBondContact O-N 3.47Å; L236-K239 PolarHBondContact O-N 2.89Å; L236-A240 WeakPolarHBondContact O-CB 3.33Å; L236-A240 PolarHBondContact O-N 3.41Å |
| 237 | T | 91.8 | Very high | 83.5 | Confident | 72 Ų | 72 | 105.2 Ų | 105.2 | 44% | 0.442 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.2 | -46.9 | 176.3 | -56.5 | 0 | 0 | 0 | 0 | 110.7 | I233 E234 K239 A240 L241 | I233-T237 VanDerWaalsContact O-CB 3.3Å; I233-T237 WeakPolarHBondContact O-CB 3.37Å; I233-T237 PolarHBondContact O-N 2.86Å; I233-T237 PolarHBondContact O-OG1 2.92Å; E234-T237 PolarHBondContact O-N 3.39Å; T237-K239 VanDerWaalsContact C-N 3.34Å; T237-K239 PolarHBondContact O-N 2.93Å; T237-A240 PolarHBondContact O-N 3.39Å; T237-L241 HydrophobicContact CG2-CD1 4.22Å; T237-L241 WeakPolarHBondContact O-CG 3.42Å; T237-L241 PolarHBondContact O-N 3.48Å |
| 238 | N | 87.5 | Confident | 81.3 | Confident | 94 Ų | 94 | 108.4 Ų | 108.4 | 50% | 0.503 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.2 | -42.9 | 175.6 | -73.2 | -30.4 | 0 | 0 | 0 | 111.8 | E234 L235 A240 L241 S242 | E234-N238 WeakPolarHBondContact O-CB 3.47Å; E234-N238 PolarHBondContact O-N 2.95Å; E234-N238 PolarHBondContact O-ND2 3.33Å; E234-N238 VanDerWaalsContact O-ND2 3.13Å; L235-N238 PolarHBondContact O-N 3.13Å; N238-A240 VanDerWaalsContact C-N 3.33Å; N238-A240 PolarHBondContact O-N 2.92Å; N238-L241 PolarHBondContact O-N 3.27Å; N238-S242 PolarHBondContact O-N 3.01Å; N238-S242 PolarHBondContact O-OG 3.32Å; N238-S242 VanDerWaalsContact O-OG 3.12Å |
| 239 | K | 88.1 | Confident | 79.1 | Confident | 160 Ų | 160 | 109.7 Ų | 109.7 | 70% | 0.696 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -63.2 | -37.8 | 176.1 | -173.7 | 177.3 | -179.2 | 179.5 | 0 | 112.4 | L235 L236 T237 R243 | L235-K239 WeakPolarHBondContact O-CB 3.37Å; L235-K239 PolarHBondContact O-N 3.2Å; L236-K239 PolarHBondContact O-N 2.89Å; T237-K239 VanDerWaalsContact C-N 3.34Å; T237-K239 PolarHBondContact O-N 2.93Å; K239-R243 PolarHBondContact O-N 2.86Å; K239-R243 VanDerWaalsContact O-N 3.17Å |
| 240 | A | 83.2 | Confident | 76.7 | Confident | 53 Ų | 53 | 111.5 Ų | 111.5 | 44% | 0.438 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -66.7 | -46.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | L236 T237 N238 S242 R243 E244 | L236-A240 WeakPolarHBondContact O-CB 3.33Å; L236-A240 PolarHBondContact O-N 3.41Å; T237-A240 PolarHBondContact O-N 3.39Å; N238-A240 VanDerWaalsContact C-N 3.33Å; N238-A240 PolarHBondContact O-N 2.92Å; A240-S242 PolarHBondContact O-N 3.18Å; A240-R243 WeakPolarHBondContact O-CB 3.46Å; A240-R243 PolarHBondContact O-N 3.26Å; A240-R243 VanDerWaalsContact O-N 3.08Å; A240-E244 PolarHBondContact O-N 3.08Å |
| 241 | L | 79.8 | Confident | 74 | Confident | 88 Ų | 88 | 114.4 Ų | 114.4 | 46% | 0.461 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -60.9 | -44.8 | 176.8 | -68.6 | 171.7 | 0 | 0 | 0 | 112 | T237 N238 R243 E244 E245 | T237-L241 HydrophobicContact CG2-CD1 4.22Å; T237-L241 WeakPolarHBondContact O-CG 3.42Å; T237-L241 PolarHBondContact O-N 3.48Å; N238-L241 PolarHBondContact O-N 3.27Å; L241-R243 PolarHBondContact O-N 3.39Å; L241-E244 PolarHBondContact O-N 3.17Å; L241-E245 PolarHBondContact O-N 3.46Å |
| 242 | S | 75.5 | Confident | 71.3 | Confident | 58 Ų | 58 | 115.5 Ų | 115.5 | 41% | 0.406 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -65.1 | -23.9 | 175.4 | -60 | 0 | 0 | 0 | 0 | 113.5 | N238 A240 N246 | N238-S242 PolarHBondContact O-N 3.01Å; N238-S242 PolarHBondContact O-OG 3.32Å; N238-S242 VanDerWaalsContact O-OG 3.12Å; A240-S242 PolarHBondContact O-N 3.18Å; S242-N246 WeakPolarHBondContact O-CB 3.43Å; S242-N246 PolarHBondContact O-N 3.04Å; S242-N246 PolarHBondContact O-ND2 3.25Å |
| 243 | R | 67.3 | Low | 69.1 | Low | 193 Ų | 193 | 116.3 Ų | 116.3 | 73% | 0.728 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -77.9 | -37.1 | 174.5 | -166.9 | 179 | -175.3 | -178.8 | 2.1 | 111.1 | K239 A240 L241 N246 S247 | K239-R243 PolarHBondContact O-N 2.86Å; K239-R243 VanDerWaalsContact O-N 3.17Å; A240-R243 WeakPolarHBondContact O-CB 3.46Å; A240-R243 PolarHBondContact O-N 3.26Å; A240-R243 VanDerWaalsContact O-N 3.08Å; L241-R243 PolarHBondContact O-N 3.39Å; R243-N246 PolarHBondContact O-N 3.12Å; R243-S247 VanDerWaalsContact O-CB 3.31Å; R243-S247 WeakPolarHBondContact O-CB 3.43Å; R243-S247 PolarHBondContact O-N 3.07Å; R243-S247 PolarHBondContact O-OG 3.46Å |
| 244 | E | 61.2 | Low | 66.6 | Low | 142 Ų | 142 | 119 Ų | 119 | 66% | 0.664 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -65.5 | -41.4 | 173.8 | -72 | -178.4 | 172.1 | 0 | 0 | 111.1 | A240 L241 N246 S247 | A240-E244 PolarHBondContact O-N 3.08Å; L241-E244 PolarHBondContact O-N 3.17Å; E244-N246 VanDerWaalsContact C-N 3.32Å; E244-N246 PolarHBondContact O-N 3.49Å; E244-S247 PolarHBondContact O-N 2.93Å |
| 245 | E | 58.6 | Low | 64 | Low | 155 Ų | 155 | 120.5 Ų | 120.5 | 72% | 0.724 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -67.1 | -29 | 175.7 | -69.8 | -179.7 | 163 | 0 | 0 | 113.7 | L241 | L241-E245 PolarHBondContact O-N 3.46Å |
| 246 | N | 54.5 | Low | 61.7 | Low | 91 Ų | 91 | 123.1 Ų | 123.1 | 49% | 0.487 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -91.9 | -9.1 | 176 | -75.5 | -53.7 | 0 | 0 | 0 | 114 | S242 R243 E244 D248 Q249 L250 | S242-N246 WeakPolarHBondContact O-CB 3.43Å; S242-N246 PolarHBondContact O-N 3.04Å; S242-N246 PolarHBondContact O-ND2 3.25Å; R243-N246 PolarHBondContact O-N 3.12Å; E244-N246 VanDerWaalsContact C-N 3.32Å; E244-N246 PolarHBondContact O-N 3.49Å; N246-D248 PolarHBondContact O-N 3.46Å; N246-Q249 PolarHBondContact O-N 3.34Å; N246-L250 HydrophobicContact CB-CD1 4.44Å; N246-L250 PolarHBondContact O-N 3.45Å |
| 247 | S | 53 | Low | 59.4 | Low | 74 Ų | 74 | 123.5 Ų | 123.5 | 52% | 0.517 | 67% | 0.665 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.5 | -13.2 | -179.6 | -70 | 0 | 0 | 0 | 0 | 113.1 | R243 E244 Q249 | R243-S247 VanDerWaalsContact O-CB 3.31Å; R243-S247 WeakPolarHBondContact O-CB 3.43Å; R243-S247 PolarHBondContact O-N 3.07Å; R243-S247 PolarHBondContact O-OG 3.46Å; E244-S247 PolarHBondContact O-N 2.93Å; S247-Q249 VanDerWaalsContact C-N 3.29Å; S247-Q249 PolarHBondContact O-N 3.48Å |
| 248 | D | 51.8 | Low | 57 | Low | 157 Ų | 157 | 124.9 Ų | 124.9 | 84% | 0.84 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.1 | -2.4 | 170.1 | -75.3 | -20.7 | 0 | 0 | 0 | 113.6 | N246 | N246-D248 PolarHBondContact O-N 3.46Š|
| 249 | Q | 49 | Very low | 54.9 | Low | 173 Ų | 173 | 127.7 Ų | 127.7 | 81% | 0.808 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.4 | 2.4 | -179.2 | -86.6 | -178.8 | 43.3 | 0 | 0 | 116.6 | N246 S247 | N246-Q249 PolarHBondContact O-N 3.34Å; S247-Q249 VanDerWaalsContact C-N 3.29Å; S247-Q249 PolarHBondContact O-N 3.48Å |
| 250 | L | 46.1 | Very low | 53.3 | Low | 128 Ų | 128 | 124.5 Ų | 124.5 | 67% | 0.67 | 69% | 0.69 | S | S | * | * | trans | -126.3 | 68 | -176.4 | -67.2 | 171.9 | 0 | 0 | 0 | 112.7 | N246 | N246-L250 HydrophobicContact CB-CD1 4.44Å; N246-L250 PolarHBondContact O-N 3.45Å | ||
| 251 | N | 41.2 | Very low | 52.4 | Low | 157 Ų | 157 | 127 Ų | 127 | 84% | 0.84 | 70% | 0.704 | S | S | * | * | trans | -79.6 | 134.8 | 146.5 | -87.6 | -32.8 | 0 | 0 | 0 | 107.6 | ||||
| 252 | S | 39.8 | Very low | 52 | Low | 120 Ų | 120 | 128 Ų | 128 | 84% | 0.839 | 71% | 0.709 | S | S | * | * | trans | 75.5 | 86.1 | 174.6 | 46.4 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 253 | S | 48.3 | Very low | 52.3 | Low | 119 Ų | 119 | 131.6 Ų | 131.6 | 83% | 0.832 | 72% | 0.719 | S | S | * | * | -165.8 | 145.6 | 120.8 | 57 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 254 | N | 42 | Very low | 53.1 | Low | 153 Ų | 153 | 125.1 Ų | 125.1 | 82% | 0.818 | 70% | 0.695 | S | S | * | * | trans | -58 | 137.9 | -164.6 | -78.8 | -21.6 | 0 | 0 | 0 | 114.9 | E256 | N254-E256 PolarHBondContact O-N 3.44Å; N254-E256 VanDerWaalsContact O-N 3.15Å | ||
| 255 | V | 40.6 | Very low | 54.3 | Low | 127 Ų | 127 | 124 Ų | 124 | 77% | 0.77 | 69% | 0.69 | S | S | * | * | trans | -64.2 | 97.9 | 155.4 | 176.6 | 0 | 0 | 0 | 0 | 108 | T257 | V255-T257 HydrophobicContact CG1-CG2 3.79Š| ||
| 256 | E | 45 | Very low | 55.7 | Low | 167 Ų | 167 | 116.6 Ų | 116.6 | 78% | 0.78 | 66% | 0.655 | S | S | * | * | trans | -96 | 86.4 | 153.6 | -76 | -172.8 | 171.1 | 0 | 0 | 107 | N254 S258 | N254-E256 PolarHBondContact O-N 3.44Å; N254-E256 VanDerWaalsContact O-N 3.15Å; E256-S258 PolarHBondContact O-N 3.4Å | ||
| 257 | T | 42.5 | Very low | 57 | Low | 113 Ų | 113 | 120.1 Ų | 120.1 | 69% | 0.693 | 67% | 0.669 | S | S | * | * | trans | -68 | 90 | 157.6 | 40.1 | 0 | 0 | 0 | 0 | 107 | V255 D259 | V255-T257 HydrophobicContact CG1-CG2 3.79Å; T257-D259 PolarHBondContact O-N 3.26Å | ||
| 258 | S | 42.6 | Very low | 58.4 | Low | 100 Ų | 100 | 117.2 Ų | 117.2 | 70% | 0.699 | 65% | 0.65 | S | S | * | * | trans | -66.9 | 91.9 | 159.8 | -56.1 | 0 | 0 | 0 | 0 | 106.9 | E256 S260 | E256-S258 PolarHBondContact O-N 3.4Å; S258-S260 PolarHBondContact O-N 3.34Å | ||
| 259 | D | 43.3 | Very low | 60.2 | Low | 154 Ų | 154 | 111.6 Ų | 111.6 | 82% | 0.824 | 62% | 0.623 | S | S | * | * | trans | -60.9 | 83.6 | 161.2 | -104.5 | -18.7 | 0 | 0 | 0 | 107.2 | T257 S261 | T257-D259 PolarHBondContact O-N 3.26Å; D259-S261 VanDerWaalsContact C-N 3.29Å; D259-S261 PolarHBondContact O-N 2.97Å; D259-S261 VanDerWaalsContact O-N 3.1Å | ||
| 260 | S | 53.8 | Low | 61.9 | Low | 92 Ų | 92 | 107.2 Ų | 107.2 | 64% | 0.643 | 61% | 0.611 | S | S | * | * | trans | -71.8 | 95.6 | 158.9 | 57.7 | 0 | 0 | 0 | 0 | 105.7 | S258 I262 | S258-S260 PolarHBondContact O-N 3.34Å; S260-I262 PolarHBondContact O-N 3.38Å | ||
| 261 | S | 64.2 | Low | 63.8 | Low | 107 Ų | 107 | 105.1 Ų | 105.1 | 75% | 0.748 | 60% | 0.601 | S | S | * | * | trans | -52.3 | 106.2 | 164 | -76.1 | 0 | 0 | 0 | 0 | 107.7 | D259 E263 | D259-S261 VanDerWaalsContact C-N 3.29Å; D259-S261 PolarHBondContact O-N 2.97Å; D259-S261 VanDerWaalsContact O-N 3.1Å; S261-E263 PolarHBondContact O-N 3.15Å | ||
| 262 | I | 72.5 | Confident | 66 | Low | 107 Ų | 107 | 101.4 Ų | 101.4 | 55% | 0.549 | 58% | 0.584 | S | S | . | * | trans | -71 | 109.2 | 172.4 | -65 | 170.6 | 0 | 0 | 0 | 105.6 | S260 Y264 | S260-I262 PolarHBondContact O-N 3.38Å; I262-Y264 HydrophobicContact CB-CE2 4.49Å; I262-Y264 HydrophobicContact CG2-CD2 4.4Å; I262-Y264 HydrophobicContact CG2-CE1 4.26Å; I262-Y264 HydrophobicContact CG2-CE2 3.93Å | ||
| 263 | E | 81.6 | Confident | 68.4 | Low | 134 Ų | 134 | 97.5 Ų | 97.5 | 63% | 0.626 | 55% | 0.552 | S | S | * | * | trans | -87.5 | 126.9 | 168.7 | -71.3 | -175.8 | 174.1 | 0 | 0 | 108.8 | S261 | S261-E263 PolarHBondContact O-N 3.15Š| ||
| 264 | Y | 83.1 | Confident | 70.1 | Confident | 58 Ų | 58 | 97.1 Ų | 97.1 | 23% | 0.227 | 55% | 0.55 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.1 | 130 | 174.7 | -59.1 | -96.7 | 0 | 0 | 0 | 108.8 | I262 T272 F273 E276 F279 | I262-Y264 HydrophobicContact CB-CE2 4.49Å; I262-Y264 HydrophobicContact CG2-CD2 4.4Å; I262-Y264 HydrophobicContact CG2-CE1 4.26Å; I262-Y264 HydrophobicContact CG2-CE2 3.93Å; Y264-T272 CarbonylContact O-C 3.47Å; Y264-T272 VanDerWaalsContact O-CA 3.29Å; Y264-T272 WeakPolarHBondContact O-CA 3.39Å; Y264-F273 PolarHBondContact N-O 3.47Å; Y264-F273 PolarHBondContact O-N 2.93Å; Y264-E276 HydrophobicContact CE1-CB 4.18Å; Y264-E276 HydrophobicContact CE1-CG 3.94Å; Y264-E276 HydrophobicContact CE2-CB 3.83Å; Y264-E276 HydrophobicContact CE2-CG 4.5Å; Y264-E276 WeakPolarHBondContact OH-CB 3.48Å; Y264-E276 PolarHBondContact OH-OE2 3.45Å; Y264-F279 HydrophobicContact CD1-CB 4.49Å; Y264-F279 AromaticContact CD1-CD1 3.69Å; Y264-F279 HydrophobicContact CD1-CD1 3.69Å; Y264-F279 HydrophobicContact CD1-CE1 4.17Å; Y264-F279 HydrophobicContact CD1-CG 4.23Å; Y264-F279 HydrophobicContact CG-CB 4.01Å; Y264-F279 AromaticContact CG-CD1 3.95Å; Y264-F279 HydrophobicContact CG-CD1 3.95Å; Y264-F279 HydrophobicContact CG-CG 4.01Å |
| 265 | Q | 87.5 | Confident | 72.1 | Confident | 117 Ų | 117 | 91.9 Ų | 91.9 | 55% | 0.547 | 53% | 0.525 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.7 | 131.5 | -179.3 | -171.2 | 171.7 | 28.7 | 0 | 0 | 111.1 | S270 D271 T272 F279 | Q265-S270 PolarHBondContact NE2-O 3.38Å; Q265-D271 WeakPolarHBondContact CA-O 3.43Å; Q265-T272 HydrophobicContact CB-CG2 4.14Å; Q265-T272 HydrophobicContact CG-CG2 3.97Å; Q265-F279 WeakPolarHBondContact O-CE2 3.44Å |
| 266 | C | 86.3 | Confident | 74.3 | Confident | 0 Ų | 0 | 91 Ų | 91 | 0% | 0 | 51% | 0.513 | C | S | . | . | trans | -80.7 | 120.7 | 173.8 | 178.7 | 0 | 0 | 0 | 0 | 110.8 | G268 C269 S270 D271 F273 F279 H282 | C266-G268 PolarHBondContact O-N 2.92Å; C266-G268 PolarHBondContact SG-N 3.49Å; C266-C269 VanDerWaalsContact SG-SG 3.64Å; C266-S270 WeakPolarHBondContact O-CA 3.23Å; C266-S270 PolarHBondContact O-N 2.63Å; C266-D271 PolarHBondContact N-O 3.18Å; C266-F273 HydrophobicContact CB-CE2 4.3Å; C266-F279 HydrophobicContact CB-CE2 4.21Å; C266-H282 WeakPolarHBondContact CB-NE2 3.38Å; C266-H282 PolarHBondContact SG-NE2 2.88Å | ||
| 267 | E | 83.3 | Confident | 76.4 | Confident | 165 Ų | 165 | 90.4 Ų | 90.4 | 77% | 0.771 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.2 | -23.6 | 178.5 | -65.6 | -169.3 | 163.7 | 0 | 0 | 113.3 | ||
| 268 | G | 82.6 | Confident | 78.4 | Confident | 13 Ų | 13 | 87.6 Ų | 87.6 | 13% | 0.134 | 50% | 0.495 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -76.9 | -36 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | C266 R288 | C266-G268 PolarHBondContact O-N 2.92Å; C266-G268 PolarHBondContact SG-N 3.49Å; G268-R288 WeakPolarHBondContact O-CB 3.26Å; G268-R288 VanDerWaalsContact O-CD 3.26Å; G268-R288 WeakPolarHBondContact O-CD 3.14Å |
| 269 | C | 88.1 | Confident | 80.7 | Confident | 39 Ų | 39 | 84.6 Ų | 84.6 | 26% | 0.264 | 47% | 0.469 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -126 | -2.5 | -177.4 | 65.6 | 0 | 0 | 0 | 0 | 114.9 | C266 D271 H282 | C266-C269 VanDerWaalsContact SG-SG 3.64Å; C269-D271 PolarHBondContact O-N 3.44Å; C269-D271 VanDerWaalsContact SG-CG 3.53Å; C269-D271 PolarHBondContact SG-OD2 3.36Å; C269-H282 PolarHBondContact SG-CE1 3.1Å; C269-H282 PolarHBondContact SG-NE2 2.86Å |
| 270 | S | 85.3 | Confident | 82.8 | Confident | 81 Ų | 81 | 81 Ų | 81 | 57% | 0.566 | 45% | 0.449 | S | S | * | . | trans | 65.2 | 9.4 | -177.7 | -50.5 | 0 | 0 | 0 | 0 | 115.9 | Q265 C266 | Q265-S270 PolarHBondContact NE2-O 3.38Å; C266-S270 WeakPolarHBondContact O-CA 3.23Å; C266-S270 PolarHBondContact O-N 2.63Å | ||
| 271 | D | 87 | Confident | 84.4 | Confident | 84 Ų | 84 | 82 Ų | 82 | 45% | 0.449 | 45% | 0.446 | S | S | . | . | trans | -69 | 141.5 | 177 | -69.1 | -30.6 | 0 | 0 | 0 | 111.4 | Q265 C266 C269 F273 H282 | Q265-D271 WeakPolarHBondContact CA-O 3.43Å; C266-D271 PolarHBondContact N-O 3.18Å; C269-D271 PolarHBondContact O-N 3.44Å; C269-D271 VanDerWaalsContact SG-CG 3.53Å; C269-D271 PolarHBondContact SG-OD2 3.36Å; D271-F273 HydrophobicContact CB-CE2 3.75Å; D271-F273 HydrophobicContact CB-CZ 3.86Å; D271-H282 IonicContact OD2-CE1 3.86Å | ||
| 272 | T | 87.6 | Confident | 85.5 | Confident | 80 Ų | 80 | 78.5 Ų | 78.5 | 49% | 0.491 | 42% | 0.418 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 141.9 | 178.1 | 55.7 | 0 | 0 | 0 | 0 | 111.7 | Y264 Q265 | Y264-T272 CarbonylContact O-C 3.47Å; Y264-T272 VanDerWaalsContact O-CA 3.29Å; Y264-T272 WeakPolarHBondContact O-CA 3.39Å; Q265-T272 HydrophobicContact CB-CG2 4.14Å; Q265-T272 HydrophobicContact CG-CG2 3.97Å |
| 273 | F | 88.5 | Confident | 86.2 | Confident | 38 Ų | 38 | 75.3 Ų | 75.3 | 17% | 0.167 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.2 | 129.9 | -175.9 | -59.2 | -89.9 | 0 | 0 | 0 | 109.2 | Y264 C266 D271 S275 F279 H282 | Y264-F273 PolarHBondContact N-O 3.47Å; Y264-F273 PolarHBondContact O-N 2.93Å; C266-F273 HydrophobicContact CB-CE2 4.3Å; D271-F273 HydrophobicContact CB-CE2 3.75Å; D271-F273 HydrophobicContact CB-CZ 3.86Å; F273-S275 VanDerWaalsContact C-N 3.31Å; F273-F279 HydrophobicContact CB-CB 3.95Å; F273-F279 HydrophobicContact CD2-CB 4.27Å; F273-F279 AromaticContact CD2-CD2 3.67Å; F273-F279 HydrophobicContact CD2-CD2 3.67Å; F273-F279 HydrophobicContact CD2-CG 4.46Å; F273-F279 HydrophobicContact CE2-CD2 4.21Å; F273-F279 HydrophobicContact CG-CB 4.15Å; F273-F279 HydrophobicContact CG-CD2 4.39Å; F273-H282 HydrophobicContact CE1-CB 3.75Å; F273-H282 HydrophobicContact CE2-CB 3.97Å; F273-H282 AromaticContact CE2-CD2 3.67Å; F273-H282 AromaticContact CE2-CG 3.67Å; F273-H282 HydrophobicContact CZ-CB 3.43Å; F273-H282 VanDerWaalsContact CZ-CB 3.43Å; F273-H282 AromaticContact CZ-CD2 3.67Å; F273-H282 AromaticContact CZ-CE1 3.96Å; F273-H282 AromaticContact CZ-CG 3.2Å; F273-H282 AromaticContact CZ-ND1 3.44Å; F273-H282 WeakPolarHBondContact CZ-ND1 3.42Å |
| 274 | S | 83.8 | Confident | 86.2 | Confident | 111 Ų | 111 | 75.7 Ų | 75.7 | 78% | 0.776 | 40% | 0.403 | S | S | * | . | S | Bend | trans | -86.2 | -1 | 178.8 | 53.3 | 0 | 0 | 0 | 0 | 113.8 | ||
| 275 | S | 85.7 | Confident | 86.3 | Confident | 42 Ų | 42 | 78 Ų | 78 | 29% | 0.294 | 43% | 0.426 | S | S | . | . | S | Bend | trans | -136.3 | 140.8 | 175 | 60.8 | 0 | 0 | 0 | 0 | 110.3 | F273 E277 S278 F279 | F273-S275 VanDerWaalsContact C-N 3.31Å; S275-E277 VanDerWaalsContact C-N 3.31Å; S275-E277 PolarHBondContact O-N 3.32Å; S275-S278 PolarHBondContact O-N 3.15Å; S275-S278 VanDerWaalsContact OG-CB 3.22Å; S275-S278 WeakPolarHBondContact OG-CB 3.49Å; S275-S278 PolarHBondContact OG-N 3.04Å; S275-S278 PolarHBondContact OG-OG 3.16Å; S275-F279 PolarHBondContact O-N 3.41Å |
| 276 | E | 87.1 | Confident | 86.2 | Confident | 110 Ų | 110 | 72.9 Ų | 72.9 | 51% | 0.514 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -60 | -41.7 | 177.3 | -168.5 | 172.3 | 178.2 | 0 | 0 | 111.7 | Y264 S278 F279 I280 | Y264-E276 HydrophobicContact CE1-CB 4.18Å; Y264-E276 HydrophobicContact CE1-CG 3.94Å; Y264-E276 HydrophobicContact CE2-CB 3.83Å; Y264-E276 HydrophobicContact CE2-CG 4.5Å; Y264-E276 WeakPolarHBondContact OH-CB 3.48Å; Y264-E276 PolarHBondContact OH-OE2 3.45Å; E276-S278 PolarHBondContact O-N 3.23Å; E276-F279 WeakPolarHBondContact O-CB 3.31Å; E276-F279 PolarHBondContact O-N 3.15Å; E276-F279 VanDerWaalsContact O-N 3.15Å; E276-I280 HydrophobicContact CG-CD1 3.96Å; E276-I280 HydrophobicContact CG-CG1 4.47Å; E276-I280 WeakPolarHBondContact O-CG1 3.22Å; E276-I280 PolarHBondContact O-N 2.76Å |
| 277 | E | 87.3 | Confident | 85.8 | Confident | 153 Ų | 153 | 74.8 Ų | 74.8 | 72% | 0.715 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -59.5 | -43.9 | 178.3 | -72.8 | 176.3 | 157 | 0 | 0 | 112 | S275 F279 I280 I281 | S275-E277 VanDerWaalsContact C-N 3.31Å; S275-E277 PolarHBondContact O-N 3.32Å; E277-F279 VanDerWaalsContact C-N 3.31Å; E277-F279 PolarHBondContact O-N 3.4Å; E277-I280 PolarHBondContact O-N 3.17Å; E277-I281 WeakPolarHBondContact O-CD1 3.43Å; E277-I281 VanDerWaalsContact O-CG1 3.23Å; E277-I281 WeakPolarHBondContact O-CG1 3.28Å; E277-I281 PolarHBondContact O-N 3.48Å |
| 278 | S | 86.3 | Confident | 85.5 | Confident | 55 Ų | 55 | 75.1 Ų | 75.1 | 39% | 0.385 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -67.2 | -34.8 | 177.9 | -60.1 | 0 | 0 | 0 | 0 | 112 | S275 E276 H282 | S275-S278 PolarHBondContact O-N 3.15Å; S275-S278 VanDerWaalsContact OG-CB 3.22Å; S275-S278 WeakPolarHBondContact OG-CB 3.49Å; S275-S278 PolarHBondContact OG-N 3.04Å; S275-S278 PolarHBondContact OG-OG 3.16Å; E276-S278 PolarHBondContact O-N 3.23Å; S278-H282 WeakPolarHBondContact O-CB 3.37Å; S278-H282 PolarHBondContact O-N 2.8Å |
| 279 | F | 90.5 | Very high | 85 | Confident | 37 Ų | 37 | 77.2 Ų | 77.2 | 16% | 0.162 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -66.8 | -46.4 | 176.1 | 179.4 | -121 | 0 | 0 | 0 | 112.2 | Y264 Q265 C266 F273 S275 E276 E277 I281 H282 L283 | Y264-F279 HydrophobicContact CD1-CB 4.49Å; Y264-F279 AromaticContact CD1-CD1 3.69Å; Y264-F279 HydrophobicContact CD1-CD1 3.69Å; Y264-F279 HydrophobicContact CD1-CE1 4.17Å; Y264-F279 HydrophobicContact CD1-CG 4.23Å; Y264-F279 HydrophobicContact CG-CB 4.01Å; Y264-F279 AromaticContact CG-CD1 3.95Å; Y264-F279 HydrophobicContact CG-CD1 3.95Å; Y264-F279 HydrophobicContact CG-CG 4.01Å; Q265-F279 WeakPolarHBondContact O-CE2 3.44Å; C266-F279 HydrophobicContact CB-CE2 4.21Å; F273-F279 HydrophobicContact CB-CB 3.95Å; F273-F279 HydrophobicContact CD2-CB 4.27Å; F273-F279 AromaticContact CD2-CD2 3.67Å; F273-F279 HydrophobicContact CD2-CD2 3.67Å; F273-F279 HydrophobicContact CD2-CG 4.46Å; F273-F279 HydrophobicContact CE2-CD2 4.21Å; F273-F279 HydrophobicContact CG-CB 4.15Å; F273-F279 HydrophobicContact CG-CD2 4.39Å; S275-F279 PolarHBondContact O-N 3.41Å; E276-F279 WeakPolarHBondContact O-CB 3.31Å; E276-F279 PolarHBondContact O-N 3.15Å; E276-F279 VanDerWaalsContact O-N 3.15Å; E277-F279 VanDerWaalsContact C-N 3.31Å; E277-F279 PolarHBondContact O-N 3.4Å; F279-I281 PolarHBondContact O-N 3.06Å; F279-H282 WeakPolarHBondContact O-CB 3.48Å; F279-H282 PolarHBondContact O-N 3.18Å; F279-H282 VanDerWaalsContact O-N 3.16Å; F279-L283 HydrophobicContact CD1-CD1 4.19Å; F279-L283 HydrophobicContact CE1-CD1 3.73Å; F279-L283 HydrophobicContact CE1-CG 4.36Å; F279-L283 HydrophobicContact CE2-CD1 4.42Å; F279-L283 HydrophobicContact CE2-CD2 4.12Å; F279-L283 HydrophobicContact CE2-CG 4.2Å; F279-L283 HydrophobicContact CZ-CD1 3.86Å; F279-L283 HydrophobicContact CZ-CD2 4.07Å; F279-L283 HydrophobicContact CZ-CG 4.12Å; F279-L283 WeakPolarHBondContact O-CG 3.29Å; F279-L283 PolarHBondContact O-N 2.95Å |
| 280 | I | 86.2 | Confident | 84.1 | Confident | 79 Ų | 79 | 80.8 Ų | 80.8 | 41% | 0.405 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -62.5 | -43.9 | 178.3 | -67.2 | 170.2 | 0 | 0 | 0 | 110.9 | E276 E277 H282 L283 H284 | E276-I280 HydrophobicContact CG-CD1 3.96Å; E276-I280 HydrophobicContact CG-CG1 4.47Å; E276-I280 WeakPolarHBondContact O-CG1 3.22Å; E276-I280 PolarHBondContact O-N 2.76Å; E277-I280 PolarHBondContact O-N 3.17Å; I280-H282 VanDerWaalsContact C-N 3.28Å; I280-H282 PolarHBondContact O-N 3.21Å; I280-L283 PolarHBondContact O-N 3.12Å; I280-H284 PolarHBondContact O-CD2 2.9Å; I280-H284 PolarHBondContact O-N 3.36Å |
| 281 | I | 87.5 | Confident | 83.2 | Confident | 113 Ų | 113 | 84.7 Ų | 84.7 | 58% | 0.579 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -59.6 | -42.7 | 175.4 | -68.1 | 166 | 0 | 0 | 0 | 110.3 | E277 F279 H284 C285 | E277-I281 WeakPolarHBondContact O-CD1 3.43Å; E277-I281 VanDerWaalsContact O-CG1 3.23Å; E277-I281 WeakPolarHBondContact O-CG1 3.28Å; E277-I281 PolarHBondContact O-N 3.48Å; F279-I281 PolarHBondContact O-N 3.06Å; I281-H284 PolarHBondContact O-N 3.25Å; I281-C285 PolarHBondContact O-N 3.16Å |
| 282 | H | 89 | Confident | 81.9 | Confident | 33 Ų | 33 | 86.9 Ų | 86.9 | 15% | 0.153 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -63.1 | -42.6 | 177.5 | 175 | 82.5 | 0 | 0 | 0 | 112.8 | C266 C269 D271 F273 S278 F279 I280 H284 C285 C286 | C266-H282 WeakPolarHBondContact CB-NE2 3.38Å; C266-H282 PolarHBondContact SG-NE2 2.88Å; C269-H282 PolarHBondContact SG-CE1 3.1Å; C269-H282 PolarHBondContact SG-NE2 2.86Å; D271-H282 IonicContact OD2-CE1 3.86Å; F273-H282 HydrophobicContact CE1-CB 3.75Å; F273-H282 HydrophobicContact CE2-CB 3.97Å; F273-H282 AromaticContact CE2-CD2 3.67Å; F273-H282 AromaticContact CE2-CG 3.67Å; F273-H282 HydrophobicContact CZ-CB 3.43Å; F273-H282 VanDerWaalsContact CZ-CB 3.43Å; F273-H282 AromaticContact CZ-CD2 3.67Å; F273-H282 AromaticContact CZ-CE1 3.96Å; F273-H282 AromaticContact CZ-CG 3.2Å; F273-H282 AromaticContact CZ-ND1 3.44Å; F273-H282 WeakPolarHBondContact CZ-ND1 3.42Å; S278-H282 WeakPolarHBondContact O-CB 3.37Å; S278-H282 PolarHBondContact O-N 2.8Å; F279-H282 WeakPolarHBondContact O-CB 3.48Å; F279-H282 PolarHBondContact O-N 3.18Å; F279-H282 VanDerWaalsContact O-N 3.16Å; I280-H282 VanDerWaalsContact C-N 3.28Å; I280-H282 PolarHBondContact O-N 3.21Å; H282-H284 PolarHBondContact O-N 3.47Å; H282-C285 CarbonylContact O-C 3.59Å; H282-C285 PolarHBondContact O-N 3.26Å; H282-C286 WeakPolarHBondContact NE2-CB 3.41Å; H282-C286 VanDerWaalsContact O-CB 3.28Å; H282-C286 WeakPolarHBondContact O-CB 3.44Å; H282-C286 PolarHBondContact O-N 3.15Å |
| 283 | L | 86 | Confident | 80.1 | Confident | 39 Ų | 39 | 93.1 Ų | 93.1 | 20% | 0.204 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -58.2 | -33.5 | 177.9 | -70.8 | 176.3 | 0 | 0 | 0 | 112.7 | F279 I280 C285 F289 | F279-L283 HydrophobicContact CD1-CD1 4.19Å; F279-L283 HydrophobicContact CE1-CD1 3.73Å; F279-L283 HydrophobicContact CE1-CG 4.36Å; F279-L283 HydrophobicContact CE2-CD1 4.42Å; F279-L283 HydrophobicContact CE2-CD2 4.12Å; F279-L283 HydrophobicContact CE2-CG 4.2Å; F279-L283 HydrophobicContact CZ-CD1 3.86Å; F279-L283 HydrophobicContact CZ-CD2 4.07Å; F279-L283 HydrophobicContact CZ-CG 4.12Å; F279-L283 WeakPolarHBondContact O-CG 3.29Å; F279-L283 PolarHBondContact O-N 2.95Å; I280-L283 PolarHBondContact O-N 3.12Å; L283-C285 VanDerWaalsContact C-N 3.34Å; L283-F289 HydrophobicContact CD2-CD1 3.82Å; L283-F289 HydrophobicContact CD2-CD2 3.77Å; L283-F289 HydrophobicContact CD2-CE1 3.88Å; L283-F289 HydrophobicContact CD2-CE2 3.83Å; L283-F289 HydrophobicContact CD2-CG 3.77Å; L283-F289 HydrophobicContact CD2-CZ 3.89Å |
| 284 | H | 82.8 | Confident | 79.7 | Confident | 143 Ų | 143 | 95.9 Ų | 95.9 | 66% | 0.662 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -72.6 | -23 | 175.1 | -84.4 | -72.7 | 0 | 0 | 0 | 114.2 | I280 I281 H282 Q290 | I280-H284 PolarHBondContact O-CD2 2.9Å; I280-H284 PolarHBondContact O-N 3.36Å; I281-H284 PolarHBondContact O-N 3.25Å; H282-H284 PolarHBondContact O-N 3.47Å; H284-Q290 PolarHBondContact O-NE2 2.75Å; H284-Q290 VanDerWaalsContact O-NE2 3.15Å |
| 285 | C | 84.8 | Confident | 79.5 | Confident | 105 Ų | 105 | 95.1 Ų | 95.1 | 71% | 0.709 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -109 | -11 | -177.4 | -60 | 0 | 0 | 0 | 0 | 113.9 | I281 H282 L283 G287 | I281-C285 PolarHBondContact O-N 3.16Å; H282-C285 CarbonylContact O-C 3.59Å; H282-C285 PolarHBondContact O-N 3.26Å; L283-C285 VanDerWaalsContact C-N 3.34Å; C285-G287 PolarHBondContact O-N 3.15Å; C285-G287 VanDerWaalsContact O-N 3.15Å |
| 286 | C | 84.6 | Confident | 79.1 | Confident | 10 Ų | 10 | 98.1 Ų | 98.1 | 7% | 0.068 | 49% | 0.487 | C | S | . | . | trans | -78.7 | 100.1 | -178.3 | -171.9 | 0 | 0 | 0 | 0 | 110.7 | H282 R288 F289 Q290 | H282-C286 WeakPolarHBondContact NE2-CB 3.41Å; H282-C286 VanDerWaalsContact O-CB 3.28Å; H282-C286 WeakPolarHBondContact O-CB 3.44Å; H282-C286 PolarHBondContact O-N 3.15Å; C286-R288 PolarHBondContact O-N 3.01Å; C286-R288 VanDerWaalsContact O-N 3.16Å; C286-F289 HydrophobicContact CB-CB 4.01Å; C286-F289 PolarHBondContact O-N 2.81Å; C286-Q290 PolarHBondContact O-N 3.19Å | ||
| 287 | G | 79 | Confident | 78.7 | Confident | 41 Ų | 41 | 97.4 Ų | 97.4 | 42% | 0.423 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -57.1 | -29.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | C285 Q290 E291 | C285-G287 PolarHBondContact O-N 3.15Å; C285-G287 VanDerWaalsContact O-N 3.15Å; G287-Q290 PolarHBondContact O-N 2.8Å; G287-E291 WeakPolarHBondContact O-CG 3.37Å; G287-E291 PolarHBondContact O-N 3.31Å |
| 288 | R | 75.6 | Confident | 78.1 | Confident | 171 Ų | 171 | 93.9 Ų | 93.9 | 65% | 0.645 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -75.4 | -24 | 177.7 | -69.9 | -160.6 | 173.9 | -173.2 | 0.3 | 114.5 | G268 C286 | G268-R288 WeakPolarHBondContact O-CB 3.26Å; G268-R288 VanDerWaalsContact O-CD 3.26Å; G268-R288 WeakPolarHBondContact O-CD 3.14Å; C286-R288 PolarHBondContact O-N 3.01Å; C286-R288 VanDerWaalsContact O-N 3.16Å |
| 289 | F | 72.2 | Confident | 77.6 | Confident | 58 Ų | 58 | 96.5 Ų | 96.5 | 25% | 0.254 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -78.4 | -37 | 173 | -172.5 | -99.2 | 0 | 0 | 0 | 110.8 | L283 C286 E291 Q292 | L283-F289 HydrophobicContact CD2-CD1 3.82Å; L283-F289 HydrophobicContact CD2-CD2 3.77Å; L283-F289 HydrophobicContact CD2-CE1 3.88Å; L283-F289 HydrophobicContact CD2-CE2 3.83Å; L283-F289 HydrophobicContact CD2-CG 3.77Å; L283-F289 HydrophobicContact CD2-CZ 3.89Å; C286-F289 HydrophobicContact CB-CB 4.01Å; C286-F289 PolarHBondContact O-N 2.81Å; F289-E291 VanDerWaalsContact C-N 3.31Å; F289-E291 PolarHBondContact O-N 2.98Å; F289-Q292 PolarHBondContact O-N 3.19Å |
| 290 | Q | 69.4 | Low | 76.7 | Confident | 114 Ų | 114 | 100.7 Ų | 100.7 | 53% | 0.533 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -70.1 | -23.5 | 176.1 | -71.5 | -179.8 | 2.3 | 0 | 0 | 113.8 | H284 C286 G287 Q292 | H284-Q290 PolarHBondContact O-NE2 2.75Å; H284-Q290 VanDerWaalsContact O-NE2 3.15Å; C286-Q290 PolarHBondContact O-N 3.19Å; G287-Q290 PolarHBondContact O-N 2.8Å; Q290-Q292 VanDerWaalsContact C-N 3.31Å |
| 291 | E | 66.1 | Low | 75.9 | Confident | 163 Ų | 163 | 102.4 Ų | 102.4 | 76% | 0.762 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.9 | -11.2 | 176.7 | -79 | 175.5 | 178.6 | 0 | 0 | 114 | G287 F289 | G287-E291 WeakPolarHBondContact O-CG 3.37Å; G287-E291 PolarHBondContact O-N 3.31Å; F289-E291 VanDerWaalsContact C-N 3.31Å; F289-E291 PolarHBondContact O-N 2.98Å |
| 292 | Q | 59.1 | Low | 75 | Confident | 129 Ų | 129 | 101.5 Ų | 101.5 | 60% | 0.603 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.8 | -0.8 | -178.4 | -76.1 | -175.5 | -22.7 | 0 | 0 | 114.5 | F289 Q290 | F289-Q292 PolarHBondContact O-N 3.19Å; Q290-Q292 VanDerWaalsContact C-N 3.31Å |
| 293 | H | 51 | Low | 73.7 | Confident | 212 Ų | 212 | 107.7 Ų | 107.7 | 98% | 0.981 | 53% | 0.531 | S | S | * | . | trans | -129 | 0 | 177.4 | -78.1 | -65.4 | 0 | 0 | 0 | 111.6 |
Retrieved 293 of 293 residues in 441.8 ms
(Link to these results)