| 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 | 41.1 | Very low | 38 | Very low | 255 Ų | 255 | 150.4 Ų | 150.4 | 100% | 1.256 | 85% | 0.85 | S | S | * | * | 0 | 123.1 | 0 | -139.7 | 153.9 | 172 | 0 | 0 | 106.9 | |||||
| 2 | K | 38.2 | Very low | 37.7 | Very low | 187 Ų | 187 | 151.3 Ų | 151.3 | 81% | 0.813 | 85% | 0.849 | S | S | * | * | trans | -89.8 | 166.5 | -169.4 | -158.9 | 178.2 | -173.3 | 179.9 | 0 | 110 | V4 | K2-V4 HydrophobicContact CG-CG2 4.44Š| ||
| 3 | V | 38.4 | Very low | 37.6 | Very low | 133 Ų | 133 | 147.5 Ų | 147.5 | 81% | 0.806 | 84% | 0.839 | S | S | * | * | trans | 133.4 | 87.2 | 153.4 | -177.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 4 | V | 36.2 | Very low | 38.3 | Very low | 112 Ų | 112 | 145.1 Ų | 145.1 | 68% | 0.679 | 83% | 0.832 | S | S | * | * | 68.6 | 105.4 | 75.4 | -179.9 | 0 | 0 | 0 | 0 | 111.8 | K2 | K2-V4 HydrophobicContact CG-CG2 4.44Š| |||
| 5 | G | 44.9 | Very low | 38.1 | Very low | 66 Ų | 66 | 144.7 Ų | 144.7 | 68% | 0.68 | 83% | 0.833 | S | S | * | * | trans | -94.4 | 162.7 | 163 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 6 | T | 35.5 | Very low | 38.2 | Very low | 134 Ų | 134 | 145.5 Ų | 145.5 | 82% | 0.822 | 83% | 0.834 | S | S | * | * | trans | -164.3 | 127.4 | 157.4 | 16.2 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 7 | T | 41.7 | Very low | 38.8 | Very low | 132 Ų | 132 | 140.9 Ų | 140.9 | 81% | 0.81 | 83% | 0.826 | S | S | * | * | trans | -54.2 | 140.8 | 157.8 | -50 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 8 | S | 36.2 | Very low | 38.7 | Very low | 118 Ų | 118 | 142.3 Ų | 142.3 | 83% | 0.825 | 83% | 0.829 | S | S | * | * | trans | -123.9 | 129.7 | 167.6 | -72.4 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 9 | T | 33.3 | Very low | 38.6 | Very low | 131 Ų | 131 | 145 Ų | 145 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | trans | -84.2 | 152.2 | -172.2 | 40.1 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 10 | M | 40.4 | Very low | 38.8 | Very low | 185 Ų | 185 | 144.5 Ų | 144.5 | 91% | 0.911 | 83% | 0.83 | S | S | * | * | trans | -57.3 | 145.6 | 164.4 | -81.2 | 177.2 | 167.6 | 0 | 0 | 112.8 | ||||
| 11 | Q | 31.9 | Very low | 38.9 | Very low | 201 Ų | 201 | 146.6 Ų | 146.6 | 94% | 0.939 | 83% | 0.83 | S | S | * | * | trans | -154.3 | 135.2 | 151 | -111.4 | 177.1 | -21.4 | 0 | 0 | 110.8 | ||||
| 12 | L | 35.2 | Very low | 38.7 | Very low | 161 Ų | 161 | 141 Ų | 141 | 84% | 0.843 | 81% | 0.81 | S | S | * | * | trans | -112.7 | 148.8 | -175.5 | -123.9 | 124.6 | 0 | 0 | 0 | 110.8 | ||||
| 13 | S | 36.5 | Very low | 39.1 | Very low | 103 Ų | 103 | 136.9 Ų | 136.9 | 72% | 0.72 | 80% | 0.804 | S | S | * | * | trans | 86.9 | 160.9 | 155.4 | -55.8 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 14 | P | 47 | Very low | 39 | Very low | 114 Ų | 114 | 136.1 Ų | 136.1 | 74% | 0.74 | 81% | 0.805 | S | S | * | * | cis | -133.2 | 174.9 | -45.2 | 36.5 | -20.6 | 0 | 0 | 0 | 111.3 | ||||
| 15 | T | 34.7 | Very low | 39.3 | Very low | 139 Ų | 139 | 136.9 Ų | 136.9 | 85% | 0.853 | 81% | 0.81 | S | S | * | * | trans | -177.4 | 141.3 | 142.9 | -71.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 16 | N | 40.1 | Very low | 38.9 | Very low | 157 Ų | 157 | 142.7 Ų | 142.7 | 84% | 0.84 | 82% | 0.82 | S | S | * | * | trans | -75.5 | 147.5 | -164.7 | -57.5 | -82.5 | 0 | 0 | 0 | 115.7 | ||||
| 17 | G | 48.3 | Very low | 39.3 | Very low | 68 Ų | 68 | 141 Ų | 141 | 70% | 0.701 | 82% | 0.819 | S | S | * | * | trans | 81.4 | 102.5 | 134.5 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 18 | D | 36.4 | Very low | 39.2 | Very low | 166 Ų | 166 | 142.9 Ų | 142.9 | 89% | 0.888 | 82% | 0.819 | S | S | * | * | -166.9 | 124.3 | 129.8 | -108.6 | -22.3 | 0 | 0 | 0 | 110.8 | |||||
| 19 | F | 38.1 | Very low | 39.5 | Very low | 193 Ų | 193 | 145 Ų | 145 | 85% | 0.846 | 82% | 0.821 | S | S | * | * | trans | -101.4 | 127.4 | 171.3 | -86.5 | -87.4 | 0 | 0 | 0 | 108.7 | F21 | F19-F21 HydrophobicContact CD1-CE2 4.44Š| ||
| 20 | T | 42.3 | Very low | 39.8 | Very low | 134 Ų | 134 | 146.4 Ų | 146.4 | 82% | 0.822 | 82% | 0.823 | S | S | * | * | trans | -122.7 | 123.5 | 170.6 | 40.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 21 | F | 41 | Very low | 40.3 | Very low | 189 Ų | 189 | 143 Ų | 143 | 83% | 0.829 | 82% | 0.817 | S | S | * | * | trans | -132 | 121.9 | 169.8 | -88.3 | -85.1 | 0 | 0 | 0 | 109 | F19 | F19-F21 HydrophobicContact CD1-CE2 4.44Š| ||
| 22 | V | 36.8 | Very low | 40.6 | Very low | 139 Ų | 139 | 136.2 Ų | 136.2 | 84% | 0.842 | 80% | 0.801 | S | S | * | * | trans | -154.1 | 105.2 | 155.3 | -178 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 23 | S | 45.6 | Very low | 41.1 | Very low | 99 Ų | 99 | 134.5 Ų | 134.5 | 69% | 0.692 | 80% | 0.797 | S | S | * | * | 66.2 | 119 | 95.1 | -159.8 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 24 | S | 36.9 | Very low | 41.7 | Very low | 118 Ų | 118 | 136.3 Ų | 136.3 | 83% | 0.825 | 80% | 0.798 | S | S | * | * | trans | -140.1 | 102.3 | 158 | -52.1 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 25 | T | 43.5 | Very low | 41.8 | Very low | 128 Ų | 128 | 137.9 Ų | 137.9 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | -46.1 | 123.6 | 155.2 | 32.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 26 | E | 35.8 | Very low | 42.4 | Very low | 187 Ų | 187 | 135.4 Ų | 135.4 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | trans | -155.9 | 106.8 | 148.3 | -107.2 | 160.1 | 176 | 0 | 0 | 107.3 | ||||
| 27 | A | 42.8 | Very low | 42.9 | Very low | 98 Ų | 98 | 133 Ų | 133 | 81% | 0.81 | 79% | 0.786 | S | S | * | * | trans | -83.9 | 106.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 28 | E | 39.6 | Very low | 42.7 | Very low | 172 Ų | 172 | 137.8 Ų | 137.8 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | -96 | 112.2 | 159.1 | -70.5 | -161.9 | 131.1 | 0 | 0 | 108.3 | L30 | E28-L30 VanDerWaalsContact C-N 3.32Å; E28-L30 PolarHBondContact O-N 3.36Å | ||
| 29 | D | 44 | Very low | 43.3 | Very low | 162 Ų | 162 | 134.4 Ų | 134.4 | 87% | 0.866 | 78% | 0.781 | S | S | * | * | trans | -64 | 87.9 | 172.1 | -83.8 | -51.7 | 0 | 0 | 0 | 110.2 | S31 | D29-S31 VanDerWaalsContact C-N 3.32Å; D29-S31 PolarHBondContact O-N 2.71Å | ||
| 30 | L | 39.7 | Very low | 43.7 | Very low | 161 Ų | 161 | 134.8 Ų | 134.8 | 84% | 0.843 | 78% | 0.782 | S | S | * | * | trans | -77.9 | 84.3 | 167.4 | -99.6 | 135.1 | 0 | 0 | 0 | 109.5 | E28 G32 | E28-L30 VanDerWaalsContact C-N 3.32Å; E28-L30 PolarHBondContact O-N 3.36Å; L30-G32 VanDerWaalsContact C-N 3.29Å; L30-G32 PolarHBondContact O-N 3.22Å | ||
| 31 | S | 49.2 | Very low | 43.8 | Very low | 115 Ų | 115 | 135.5 Ų | 135.5 | 80% | 0.804 | 78% | 0.78 | S | S | * | * | trans | -70.4 | 86.5 | 163.9 | -172.7 | 0 | 0 | 0 | 0 | 109.5 | D29 | D29-S31 VanDerWaalsContact C-N 3.32Å; D29-S31 PolarHBondContact O-N 2.71Å | ||
| 32 | G | 39.1 | Very low | 44.2 | Very low | 58 Ų | 58 | 134.3 Ų | 134.3 | 60% | 0.598 | 78% | 0.783 | S | S | * | * | trans | -91.5 | 100.4 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | L30 I34 | L30-G32 VanDerWaalsContact C-N 3.29Å; L30-G32 PolarHBondContact O-N 3.22Å; G32-I34 PolarHBondContact O-N 3.12Å | ||
| 33 | T | 46.4 | Very low | 44.4 | Very low | 124 Ų | 124 | 136.5 Ų | 136.5 | 76% | 0.761 | 79% | 0.786 | S | S | * | * | trans | -69.7 | 119.2 | 158.6 | -75.2 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 34 | I | 49.3 | Very low | 44 | Very low | 142 Ų | 142 | 135.3 Ų | 135.3 | 73% | 0.728 | 79% | 0.789 | S | S | * | * | trans | -97.9 | 106.4 | 171.1 | -57.5 | 172.8 | 0 | 0 | 0 | 106 | G32 A36 | G32-I34 PolarHBondContact O-N 3.12Å; I34-A36 PolarHBondContact O-N 3.31Å | ||
| 35 | D | 48.5 | Very low | 44.2 | Very low | 146 Ų | 146 | 134.7 Ų | 134.7 | 78% | 0.781 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 122.4 | 161.9 | -93.1 | -59.4 | 0 | 0 | 0 | 108.5 | ||
| 36 | A | 46.9 | Very low | 44.1 | Very low | 87 Ų | 87 | 135.3 Ų | 135.3 | 72% | 0.719 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 129 | 175.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | I34 | I34-A36 PolarHBondContact O-N 3.31Š|
| 37 | P | 50.7 | Low | 44.4 | Very low | 106 Ų | 106 | 133.5 Ų | 133.5 | 69% | 0.688 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -72 | 134.1 | 165.8 | 29.6 | -28.8 | 0 | 0 | 0 | 108.5 | V39 | P37-V39 HydrophobicContact CG-CG2 4.34Å; P37-V39 PolarHBondContact O-N 2.97Å |
| 38 | D | 45.2 | Very low | 44.5 | Very low | 169 Ų | 169 | 133.9 Ų | 133.9 | 90% | 0.904 | 78% | 0.783 | S | S | * | * | trans | -72.1 | 89.4 | 179.5 | -150.9 | -8.6 | 0 | 0 | 0 | 109.2 | K40 | D38-K40 PolarHBondContact O-N 3.22Š| ||
| 39 | V | 47.9 | Very low | 45.1 | Very low | 95 Ų | 95 | 133.2 Ų | 133.2 | 58% | 0.576 | 78% | 0.777 | S | S | * | * | trans | -92.9 | 97.5 | 179.5 | -167 | 0 | 0 | 0 | 0 | 109.1 | P37 L41 | P37-V39 HydrophobicContact CG-CG2 4.34Å; P37-V39 PolarHBondContact O-N 2.97Å; V39-L41 HydrophobicContact CG1-CD1 4.18Å; V39-L41 HydrophobicContact CG1-CD2 3.58Å; V39-L41 HydrophobicContact CG1-CG 3.62Å; V39-L41 PolarHBondContact O-N 3.26Å | ||
| 40 | K | 46.7 | Very low | 45.6 | Very low | 201 Ų | 201 | 131.4 Ų | 131.4 | 87% | 0.874 | 77% | 0.768 | S | S | * | * | trans | -70.8 | 96.5 | 169.3 | -166.2 | 179.4 | -175.5 | -178.5 | 0 | 109.5 | D38 | D38-K40 PolarHBondContact O-N 3.22Š| ||
| 41 | L | 43.8 | Very low | 46.6 | Very low | 150 Ų | 150 | 128.5 Ų | 128.5 | 79% | 0.785 | 76% | 0.758 | S | S | * | * | trans | -101.1 | 115.4 | 172.8 | -62.5 | 179.9 | 0 | 0 | 0 | 110.3 | V39 | V39-L41 HydrophobicContact CG1-CD1 4.18Å; V39-L41 HydrophobicContact CG1-CD2 3.58Å; V39-L41 HydrophobicContact CG1-CG 3.62Å; V39-L41 PolarHBondContact O-N 3.26Å | ||
| 42 | N | 49.1 | Very low | 47.2 | Very low | 164 Ų | 164 | 133 Ų | 133 | 88% | 0.877 | 76% | 0.759 | S | S | * | * | trans | -93.2 | 105.5 | 166.4 | -177.5 | 53.2 | 0 | 0 | 0 | 107.8 | ||||
| 43 | M | 41.8 | Very low | 48.4 | Very low | 185 Ų | 185 | 132.7 Ų | 132.7 | 91% | 0.911 | 75% | 0.751 | S | S | * | * | trans | -151.7 | 138.6 | 162.2 | -149.2 | 157.7 | -154.1 | 0 | 0 | 111.2 | ||||
| 44 | G | 36.5 | Very low | 49.2 | Very low | 74 Ų | 74 | 128.6 Ų | 128.6 | 76% | 0.763 | 73% | 0.726 | S | S | * | * | trans | -69.2 | 171.6 | -166.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 45 | S | 42.3 | Very low | 50.2 | Low | 104 Ų | 104 | 125.6 Ų | 125.6 | 73% | 0.727 | 71% | 0.714 | S | S | * | * | trans | -43.6 | 150.9 | -173.1 | -144.8 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 46 | D | 41.3 | Very low | 51.4 | Low | 142 Ų | 142 | 123.9 Ų | 123.9 | 76% | 0.759 | 70% | 0.7 | S | S | * | * | trans | 105.6 | 70 | 146.7 | -54.6 | -24.4 | 0 | 0 | 0 | 118.8 | ||||
| 47 | N | 42.1 | Very low | 52.7 | Low | 149 Ų | 149 | 122.5 Ų | 122.5 | 80% | 0.797 | 68% | 0.68 | S | S | * | * | 179.3 | 124.4 | 112.4 | -118.4 | -42.2 | 0 | 0 | 0 | 109 | K49 | N47-K49 PolarHBondContact O-N 3.34Š| |||
| 48 | A | 45.4 | Very low | 53.6 | Low | 105 Ų | 105 | 125.1 Ų | 125.1 | 87% | 0.868 | 68% | 0.676 | S | S | * | * | trans | -65 | 93.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 49 | K | 51.8 | Low | 55.1 | Low | 158 Ų | 158 | 125.6 Ų | 125.6 | 69% | 0.687 | 67% | 0.67 | S | S | * | * | trans | -129.8 | 117.7 | 162.2 | -69.1 | -177.6 | -178.3 | 173.2 | 0 | 106.8 | N47 P51 | N47-K49 PolarHBondContact O-N 3.34Å; K49-P51 WeakPolarHBondContact O-CD 3.36Å; K49-P51 VanDerWaalsContact O-N 3.08Å | ||
| 50 | D | 54.1 | Low | 56.3 | Low | 125 Ų | 125 | 129.3 Ų | 129.3 | 67% | 0.668 | 67% | 0.674 | S | S | * | * | trans | -47.5 | 114.7 | -168.1 | -63.7 | -52.1 | 0 | 0 | 0 | 111.8 | Y52 A53 T54 | D50-Y52 PolarHBondContact O-N 2.93Å; D50-A53 HydrophobicContact CB-CB 4.32Å; D50-A53 PolarHBondContact O-N 3.39Å; D50-T54 PolarHBondContact O-N 2.96Å | ||
| 51 | P | 61 | Low | 57.1 | Low | 100 Ų | 100 | 122.7 Ų | 122.7 | 65% | 0.649 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -62.2 | -17.8 | -175 | 20.6 | -30.3 | 0 | 0 | 0 | 112.7 | K49 T54 T55 | K49-P51 WeakPolarHBondContact O-CD 3.36Å; K49-P51 VanDerWaalsContact O-N 3.08Å; P51-T54 PolarHBondContact O-OG1 2.94Å; P51-T54 VanDerWaalsContact O-OG1 3.08Å; P51-T55 WeakPolarHBondContact O-CB 3.42Å; P51-T55 PolarHBondContact O-N 3.36Å; P51-T55 PolarHBondContact O-OG1 3.3Å |
| 52 | Y | 61.6 | Low | 58.3 | Low | 208 Ų | 208 | 122.2 Ų | 122.2 | 82% | 0.816 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -72.5 | -41.8 | 173.9 | -134 | -98.1 | 0 | 0 | 0 | 112.6 | D50 F56 | D50-Y52 PolarHBondContact O-N 2.93Å; Y52-F56 WeakPolarHBondContact O-CB 3.31Å; Y52-F56 PolarHBondContact O-N 2.93Å |
| 53 | A | 63.2 | Low | 59 | Low | 52 Ų | 52 | 115.6 Ų | 115.6 | 43% | 0.43 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -69.7 | -39.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | D50 F56 L57 | D50-A53 HydrophobicContact CB-CB 4.32Å; D50-A53 PolarHBondContact O-N 3.39Å; A53-F56 PolarHBondContact O-N 3.35Å; A53-L57 WeakPolarHBondContact O-CG 3.45Å; A53-L57 PolarHBondContact O-N 3.46Å; A53-L57 VanDerWaalsContact O-N 3.12Å |
| 54 | T | 64.3 | Low | 60.1 | Low | 39 Ų | 39 | 115.9 Ų | 115.9 | 24% | 0.239 | 61% | 0.614 | C | S | . | * | H | α-helix | trans | -66.5 | -39 | 177.8 | 60.5 | 0 | 0 | 0 | 0 | 112.2 | D50 P51 R58 L66 | D50-T54 PolarHBondContact O-N 2.96Å; P51-T54 PolarHBondContact O-OG1 2.94Å; P51-T54 VanDerWaalsContact O-OG1 3.08Å; T54-R58 PolarHBondContact O-N 2.99Å; T54-L66 HydrophobicContact CG2-CD1 4.26Å; T54-L66 WeakPolarHBondContact O-CD1 3.47Å |
| 55 | T | 69.1 | Low | 61.5 | Low | 79 Ų | 79 | 118 Ų | 118 | 49% | 0.485 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -70.9 | -36.2 | 177.3 | -52.5 | 0 | 0 | 0 | 0 | 112 | P51 K59 | P51-T55 WeakPolarHBondContact O-CB 3.42Å; P51-T55 PolarHBondContact O-N 3.36Å; P51-T55 PolarHBondContact O-OG1 3.3Å; T55-K59 PolarHBondContact O-N 3.46Å; T55-K59 VanDerWaalsContact O-N 3.15Å |
| 56 | F | 74.9 | Confident | 62.7 | Low | 109 Ų | 109 | 116.3 Ų | 116.3 | 48% | 0.478 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -65.5 | -43.2 | 176.9 | -175.5 | -98.1 | 0 | 0 | 0 | 112.8 | Y52 A53 K59 R60 | Y52-F56 WeakPolarHBondContact O-CB 3.31Å; Y52-F56 PolarHBondContact O-N 2.93Å; A53-F56 PolarHBondContact O-N 3.35Å; F56-K59 PolarHBondContact O-N 3.47Å; F56-R60 PolarHBondContact O-N 3.27Å |
| 57 | L | 73.1 | Confident | 63.6 | Low | 58 Ų | 58 | 115.4 Ų | 115.4 | 30% | 0.304 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -65.3 | -40.1 | 178.4 | -69.4 | 171.1 | 0 | 0 | 0 | 112 | A53 K59 R60 Y62 L66 | A53-L57 WeakPolarHBondContact O-CG 3.45Å; A53-L57 PolarHBondContact O-N 3.46Å; A53-L57 VanDerWaalsContact O-N 3.12Å; L57-K59 PolarHBondContact O-N 3.24Å; L57-R60 PolarHBondContact O-N 3.35Å; L57-Y62 CarbonylContact O-C 3.5Å; L57-Y62 WeakPolarHBondContact O-CA 3.27Å; L57-Y62 PolarHBondContact O-N 3.01Å; L57-L66 HydrophobicContact CB-CD1 3.92Å; L57-L66 HydrophobicContact CD1-CD1 4.1Å; L57-L66 HydrophobicContact CD1-CD2 4.14Å; L57-L66 HydrophobicContact CD1-CG 4.23Å |
| 58 | R | 70.3 | Confident | 64.5 | Low | 161 Ų | 161 | 114.2 Ų | 114.2 | 61% | 0.608 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -61.7 | -42.1 | 174.8 | -168 | -179.1 | -63.1 | 137.8 | 0.6 | 112.2 | T54 R60 G61 | T54-R58 PolarHBondContact O-N 2.99Å; R58-R60 VanDerWaalsContact C-N 3.3Å; R58-R60 PolarHBondContact O-N 2.92Å; R58-G61 PolarHBondContact O-N 3.35Å |
| 59 | K | 76.7 | Confident | 65 | Low | 179 Ų | 179 | 114.6 Ų | 114.6 | 78% | 0.778 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -68.8 | -25.9 | -178.2 | -154.2 | 176.2 | -173.9 | -179.3 | 0 | 113.4 | T55 F56 L57 G61 | T55-K59 PolarHBondContact O-N 3.46Å; T55-K59 VanDerWaalsContact O-N 3.15Å; F56-K59 PolarHBondContact O-N 3.47Å; L57-K59 PolarHBondContact O-N 3.24Å; K59-G61 VanDerWaalsContact C-N 3.34Å |
| 60 | R | 72.6 | Confident | 64.9 | Low | 173 Ų | 173 | 116 Ų | 116 | 65% | 0.653 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.3 | 5 | 175 | -85 | -161.5 | 174 | 163.6 | 0.6 | 114.5 | F56 L57 R58 Y62 | F56-R60 PolarHBondContact O-N 3.27Å; L57-R60 PolarHBondContact O-N 3.35Å; R58-R60 VanDerWaalsContact C-N 3.3Å; R58-R60 PolarHBondContact O-N 2.92Å; R60-Y62 VanDerWaalsContact C-N 3.28Å; R60-Y62 HydrophobicContact CB-CD2 3.72Å; R60-Y62 HydrophobicContact CB-CE2 4.03Å; R60-Y62 PolarHBondContact O-N 2.79Å |
| 61 | G | 64.4 | Low | 64.6 | Low | 63 Ų | 63 | 116.7 Ų | 116.7 | 65% | 0.649 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 80.2 | 6.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | R58 K59 G63 | R58-G61 PolarHBondContact O-N 3.35Å; K59-G61 VanDerWaalsContact C-N 3.34Å; G61-G63 PolarHBondContact O-N 3.48Å |
| 62 | Y | 68.8 | Low | 64 | Low | 139 Ų | 139 | 117.2 Ų | 117.2 | 55% | 0.545 | 58% | 0.576 | S | S | . | * | G | 310 helix | trans | -87.8 | 26.1 | 171.1 | -60.1 | -70.7 | 0 | 0 | 0 | 111.9 | L57 R60 W64 L65 | L57-Y62 CarbonylContact O-C 3.5Å; L57-Y62 WeakPolarHBondContact O-CA 3.27Å; L57-Y62 PolarHBondContact O-N 3.01Å; R60-Y62 VanDerWaalsContact C-N 3.28Å; R60-Y62 HydrophobicContact CB-CD2 3.72Å; R60-Y62 HydrophobicContact CB-CE2 4.03Å; R60-Y62 PolarHBondContact O-N 2.79Å; Y62-W64 PolarHBondContact O-N 2.86Å; Y62-L65 WeakPolarHBondContact O-CB 3.4Å; Y62-L65 PolarHBondContact O-N 3.47Å; Y62-L65 VanDerWaalsContact O-N 3.1Å |
| 63 | G | 64.5 | Low | 63.5 | Low | 26 Ų | 26 | 112.5 Ų | 112.5 | 27% | 0.268 | 57% | 0.571 | S | S | . | * | G | 310 helix | trans | -58.6 | -35.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | G61 L65 L66 E67 | G61-G63 PolarHBondContact O-N 3.48Å; G63-L65 PolarHBondContact O-N 3.19Å; G63-L66 PolarHBondContact O-N 2.91Å; G63-E67 PolarHBondContact O-N 3.05Å |
| 64 | W | 64.6 | Low | 62.8 | Low | 191 Ų | 191 | 117.5 Ų | 117.5 | 72% | 0.723 | 59% | 0.585 | S | S | * | * | G | 310 helix | trans | -58.1 | -26 | 175.1 | -179.8 | 73.1 | 0 | 0 | 0 | 113.9 | Y62 L66 E67 | Y62-W64 PolarHBondContact O-N 2.86Å; W64-L66 VanDerWaalsContact C-N 3.27Å; W64-L66 PolarHBondContact O-N 3.35Å; W64-E67 PolarHBondContact O-N 3.36Å |
| 65 | L | 66.4 | Low | 62.2 | Low | 119 Ų | 119 | 121.4 Ų | 121.4 | 62% | 0.623 | 61% | 0.605 | S | S | * | * | G | 310 helix | trans | -76.3 | -17.4 | 178 | -147.3 | 158.1 | 0 | 0 | 0 | 112.3 | Y62 G63 | Y62-L65 WeakPolarHBondContact O-CB 3.4Å; Y62-L65 PolarHBondContact O-N 3.47Å; Y62-L65 VanDerWaalsContact O-N 3.1Å; G63-L65 PolarHBondContact O-N 3.19Å |
| 66 | L | 66.1 | Low | 61.2 | Low | 68 Ų | 68 | 124 Ų | 124 | 36% | 0.356 | 62% | 0.616 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -102.7 | -5.8 | 176.2 | -64.4 | 175.4 | 0 | 0 | 0 | 112.6 | T54 L57 G63 W64 V68 | T54-L66 HydrophobicContact CG2-CD1 4.26Å; T54-L66 WeakPolarHBondContact O-CD1 3.47Å; L57-L66 HydrophobicContact CB-CD1 3.92Å; L57-L66 HydrophobicContact CD1-CD1 4.1Å; L57-L66 HydrophobicContact CD1-CD2 4.14Å; L57-L66 HydrophobicContact CD1-CG 4.23Å; G63-L66 PolarHBondContact O-N 2.91Å; W64-L66 VanDerWaalsContact C-N 3.27Å; W64-L66 PolarHBondContact O-N 3.35Å; L66-V68 PolarHBondContact O-N 3.18Å |
| 67 | E | 60 | Low | 60.2 | Low | 123 Ų | 123 | 124.1 Ų | 124.1 | 58% | 0.575 | 62% | 0.616 | S | S | * | * | trans | -74.7 | 86.2 | 168.1 | -139.5 | 161.6 | -156.8 | 0 | 0 | 105.5 | G63 W64 D69 | G63-E67 PolarHBondContact O-N 3.05Å; W64-E67 PolarHBondContact O-N 3.36Å; E67-D69 VanDerWaalsContact C-N 3.26Å; E67-D69 PolarHBondContact O-N 2.8Å | ||
| 68 | V | 62 | Low | 59.3 | Low | 123 Ų | 123 | 125 Ų | 125 | 75% | 0.745 | 63% | 0.626 | S | S | * | * | trans | -72.6 | 101.8 | 156.4 | -178.6 | 0 | 0 | 0 | 0 | 102.4 | L66 E70 | L66-V68 PolarHBondContact O-N 3.18Å; V68-E70 PolarHBondContact O-N 2.94Å | ||
| 69 | D | 56.3 | Low | 58.3 | Low | 114 Ų | 114 | 123.9 Ų | 123.9 | 61% | 0.61 | 63% | 0.631 | S | S | * | * | trans | -47.4 | 113.5 | 170.3 | -67.2 | -46.7 | 0 | 0 | 0 | 106 | E67 D71 | E67-D69 VanDerWaalsContact C-N 3.26Å; E67-D69 PolarHBondContact O-N 2.8Å; D69-D71 VanDerWaalsContact C-N 3.33Å; D69-D71 PolarHBondContact O-N 2.87Å | ||
| 70 | E | 48.3 | Very low | 57 | Low | 187 Ų | 187 | 119.6 Ų | 119.6 | 87% | 0.874 | 62% | 0.616 | S | S | * | * | trans | -61.9 | 105.2 | 172.9 | -72.7 | -176.4 | 161.7 | 0 | 0 | 104.8 | V68 D72 | V68-E70 PolarHBondContact O-N 2.94Å; E70-D72 PolarHBondContact O-N 3.5Å | ||
| 71 | D | 48.2 | Very low | 56 | Low | 140 Ų | 140 | 116.5 Ų | 116.5 | 75% | 0.749 | 61% | 0.609 | S | S | * | * | trans | -45.3 | 106 | -178.8 | -65 | -62.6 | 0 | 0 | 0 | 109 | D69 | D69-D71 VanDerWaalsContact C-N 3.33Å; D69-D71 PolarHBondContact O-N 2.87Å | ||
| 72 | D | 47.8 | Very low | 55.5 | Low | 111 Ų | 111 | 120.5 Ų | 120.5 | 59% | 0.594 | 61% | 0.611 | S | S | * | * | trans | -58.4 | 130 | 175 | -113.3 | -41.2 | 0 | 0 | 0 | 106.6 | E70 E74 D75 | E70-D72 PolarHBondContact O-N 3.5Å; D72-E74 PolarHBondContact O-N 3.32Å; D72-D75 PolarHBondContact O-N 2.87Å | ||
| 73 | P | 52.3 | Low | 55 | Low | 109 Ų | 109 | 119.3 Ų | 119.3 | 71% | 0.708 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.2 | -3.4 | -179.7 | 25 | -32.8 | 0 | 0 | 0 | 113.3 | ||
| 74 | E | 48.4 | Very low | 54.3 | Low | 156 Ų | 156 | 123.6 Ų | 123.6 | 73% | 0.729 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.4 | -15.7 | 170 | -65.9 | -165.1 | 168.4 | 0 | 0 | 114.1 | D72 N76 | D72-E74 PolarHBondContact O-N 3.32Å; E74-N76 VanDerWaalsContact C-N 3.32Å |
| 75 | D | 51.7 | Low | 53.8 | Low | 122 Ų | 122 | 116.5 Ų | 116.5 | 65% | 0.652 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -85.4 | -0.5 | 175.6 | -87.9 | -20 | 0 | 0 | 0 | 113.5 | D72 K77 | D72-D75 PolarHBondContact O-N 2.87Å; D75-K77 PolarHBondContact O-N 2.93Å |
| 76 | N | 47.2 | Very low | 53.4 | Low | 134 Ų | 134 | 115 Ų | 115 | 72% | 0.717 | 60% | 0.599 | S | S | * | * | trans | -86.4 | 34 | 168.3 | -77.5 | -84.4 | 0 | 0 | 0 | 112.3 | E74 | E74-N76 VanDerWaalsContact C-N 3.32Š| ||
| 77 | K | 54.6 | Low | 52.6 | Low | 110 Ų | 110 | 117.2 Ų | 117.2 | 48% | 0.478 | 61% | 0.61 | S | S | . | * | S | Bend | trans | -67.6 | 127.6 | 158.3 | -75.2 | 171.8 | 175.8 | -126.8 | 0 | 106.5 | D75 L79 E81 | D75-K77 PolarHBondContact O-N 2.93Å; K77-L79 PolarHBondContact O-N 3.03Å; K77-E81 HydrophobicContact CB-CB 4.16Å; K77-E81 HydrophobicContact CB-CG 4.24Å; K77-E81 HydrophobicContact CD-CG 4.24Å; K77-E81 WeakPolarHBondContact CD-OE1 3.4Å; K77-E81 WeakPolarHBondContact CE-OE1 3.35Å; K77-E81 HydrophobicContact CG-CG 4.41Å; K77-E81 WeakPolarHBondContact CG-OE2 3.32Å; K77-E81 IonicContact NZ-OE1 2.7Å; K77-E81 PolarHBondContact NZ-OE1 2.94Å |
| 78 | P | 54.7 | Low | 52 | Low | 78 Ų | 78 | 119.5 Ų | 119.5 | 51% | 0.506 | 62% | 0.618 | S | S | . | * | trans | -53.4 | 144.2 | -179.6 | 23.3 | -32.6 | 0 | 0 | 0 | 108.7 | L80 E81 | P78-L80 PolarHBondContact O-N 3.42Å; P78-E81 HydrophobicContact CG-CB 4.32Å; P78-E81 PolarHBondContact O-N 3.02Å | ||
| 79 | L | 48.5 | Very low | 51.6 | Low | 136 Ų | 136 | 115.6 Ų | 115.6 | 71% | 0.712 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.5 | -2.3 | -178.8 | -59.9 | 171.3 | 0 | 0 | 0 | 114.7 | K77 L83 | K77-L79 PolarHBondContact O-N 3.03Å; L79-L83 WeakPolarHBondContact O-CB 3.37Å; L79-L83 PolarHBondContact O-N 3.33Å |
| 80 | L | 48.8 | Very low | 51.6 | Low | 90 Ų | 90 | 111.1 Ų | 111.1 | 47% | 0.471 | 57% | 0.569 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.4 | -26.7 | 172.2 | -60.9 | 174.1 | 0 | 0 | 0 | 113.4 | P78 L83 D84 I85 | P78-L80 PolarHBondContact O-N 3.42Å; L80-L83 CarbonylContact O-C 3.44Å; L80-D84 PolarHBondContact O-N 3.13Å; L80-I85 CarbonylContact O-C 3.59Å; L80-I85 PolarHBondContact O-N 3.24Å |
| 81 | E | 52.4 | Low | 51.7 | Low | 107 Ų | 107 | 108.7 Ų | 108.7 | 50% | 0.5 | 55% | 0.552 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82.3 | -31.7 | 172.6 | -174.4 | 174.5 | 171.8 | 0 | 0 | 110.6 | K77 P78 | K77-E81 HydrophobicContact CB-CB 4.16Å; K77-E81 HydrophobicContact CB-CG 4.24Å; K77-E81 HydrophobicContact CD-CG 4.24Å; K77-E81 WeakPolarHBondContact CD-OE1 3.4Å; K77-E81 WeakPolarHBondContact CE-OE1 3.35Å; K77-E81 HydrophobicContact CG-CG 4.41Å; K77-E81 WeakPolarHBondContact CG-OE2 3.32Å; K77-E81 IonicContact NZ-OE1 2.7Å; K77-E81 PolarHBondContact NZ-OE1 2.94Å; P78-E81 HydrophobicContact CG-CB 4.32Å; P78-E81 PolarHBondContact O-N 3.02Å |
| 82 | E | 53.3 | Low | 52 | Low | 148 Ų | 148 | 107.8 Ų | 107.8 | 69% | 0.692 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.4 | -29.4 | 170.6 | -154.3 | -179.3 | -171.9 | 0 | 0 | 112.2 | ||
| 83 | L | 57.9 | Low | 52.3 | Low | 113 Ų | 113 | 102.7 Ų | 102.7 | 59% | 0.592 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.5 | 38.8 | 173.2 | -163 | 75.2 | 0 | 0 | 0 | 111.8 | L79 L80 I85 | L79-L83 WeakPolarHBondContact O-CB 3.37Å; L79-L83 PolarHBondContact O-N 3.33Å; L80-L83 CarbonylContact O-C 3.44Å; L83-I85 HydrophobicContact CD2-CD1 4.17Å; L83-I85 HydrophobicContact CG-CD1 4.3Å; L83-I85 WeakPolarHBondContact O-CB 3.43Å; L83-I85 WeakPolarHBondContact O-CG1 3.46Å; L83-I85 PolarHBondContact O-N 3.47Å |
| 84 | D | 50.6 | Low | 52.4 | Low | 116 Ų | 116 | 99.2 Ų | 99.2 | 62% | 0.62 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 35.1 | 34.6 | 166.2 | -140.8 | 3.4 | 0 | 0 | 0 | 117 | L80 | L80-D84 PolarHBondContact O-N 3.13Š|
| 85 | I | 53.4 | Low | 52.5 | Low | 42 Ų | 42 | 98.7 Ų | 98.7 | 22% | 0.215 | 48% | 0.478 | C | S | . | . | trans | -129.4 | 78.9 | -176.3 | -65 | 162.4 | 0 | 0 | 0 | 107 | L80 L83 L87 I90 W118 | L80-I85 CarbonylContact O-C 3.59Å; L80-I85 PolarHBondContact O-N 3.24Å; L83-I85 HydrophobicContact CD2-CD1 4.17Å; L83-I85 HydrophobicContact CG-CD1 4.3Å; L83-I85 WeakPolarHBondContact O-CB 3.43Å; L83-I85 WeakPolarHBondContact O-CG1 3.46Å; L83-I85 PolarHBondContact O-N 3.47Å; I85-L87 HydrophobicContact CG2-CD2 4.48Å; I85-L87 PolarHBondContact O-N 2.97Å; I85-I90 HydrophobicContact CG2-CD1 4.04Å; I85-W118 HydrophobicContact CD1-CG 4.5Å | ||
| 86 | D | 57.6 | Low | 52.5 | Low | 89 Ų | 89 | 94 Ų | 94 | 48% | 0.476 | 46% | 0.455 | S | S | . | . | trans | -82.1 | 100.3 | 171 | -170.2 | -11.3 | 0 | 0 | 0 | 110 | K88 D89 I90 | D86-K88 PolarHBondContact O-N 3.29Å; D86-K88 WeakPolarHBondContact OD1-CA 3.3Å; D86-K88 WeakPolarHBondContact OD1-CB 3.48Å; D86-K88 PolarHBondContact OD1-N 3.29Å; D86-D89 HydrophobicContact CB-CB 3.72Å; D86-D89 WeakPolarHBondContact O-CB 3.44Å; D86-D89 PolarHBondContact O-N 2.95Å; D86-D89 VanDerWaalsContact O-N 3.11Å; D86-D89 PolarHBondContact OD1-N 3.48Å; D86-I90 WeakPolarHBondContact O-CG1 3.29Å; D86-I90 PolarHBondContact O-N 3.46Å | ||
| 87 | L | 50.3 | Low | 52.6 | Low | 113 Ų | 113 | 87.8 Ų | 87.8 | 59% | 0.592 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -59.5 | -27.9 | 176.4 | -69 | 170.2 | 0 | 0 | 0 | 112.7 | I85 I90 Y91 | I85-L87 HydrophobicContact CG2-CD2 4.48Å; I85-L87 PolarHBondContact O-N 2.97Å; L87-I90 HydrophobicContact CD2-CD1 4.37Å; L87-Y91 VanDerWaalsContact O-CB 3.31Å; L87-Y91 WeakPolarHBondContact O-CB 3.21Å; L87-Y91 PolarHBondContact O-N 2.93Å |
| 88 | K | 46.4 | Very low | 52.6 | Low | 172 Ų | 172 | 85.7 Ų | 85.7 | 75% | 0.748 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -73.4 | -38 | 177.8 | -132.8 | 173.5 | -172.7 | 176.2 | 0 | 110.1 | D86 Y91 Y92 | D86-K88 PolarHBondContact O-N 3.29Å; D86-K88 WeakPolarHBondContact OD1-CA 3.3Å; D86-K88 WeakPolarHBondContact OD1-CB 3.48Å; D86-K88 PolarHBondContact OD1-N 3.29Å; K88-Y91 PolarHBondContact O-N 3.15Å; K88-Y92 VanDerWaalsContact O-CB 3.32Å; K88-Y92 WeakPolarHBondContact O-CB 3.37Å; K88-Y92 PolarHBondContact O-N 3.47Å |
| 89 | D | 53.8 | Low | 52.3 | Low | 40 Ų | 40 | 87.3 Ų | 87.3 | 21% | 0.214 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -70.3 | -42.5 | 173.2 | -154.7 | 40.6 | 0 | 0 | 0 | 111.2 | D86 Y91 Y92 K93 | D86-D89 HydrophobicContact CB-CB 3.72Å; D86-D89 WeakPolarHBondContact O-CB 3.44Å; D86-D89 PolarHBondContact O-N 2.95Å; D86-D89 VanDerWaalsContact O-N 3.11Å; D86-D89 PolarHBondContact OD1-N 3.48Å; D89-Y91 VanDerWaalsContact C-N 3.34Å; D89-Y91 PolarHBondContact O-N 2.95Å; D89-Y92 CarbonylContact O-C 3.58Å; D89-Y92 WeakPolarHBondContact O-CB 3.19Å; D89-Y92 PolarHBondContact O-N 2.93Å; D89-Y92 VanDerWaalsContact O-N 3.15Å; D89-K93 WeakPolarHBondContact O-CB 2.99Å; D89-K93 WeakPolarHBondContact O-CG 3.43Å; D89-K93 PolarHBondContact O-N 3.23Å; D89-K93 WeakPolarHBondContact OD2-CE 3.17Å; D89-K93 IonicContact OD2-NZ 2.74Å; D89-K93 PolarHBondContact OD2-NZ 3.08Å |
| 90 | I | 56.7 | Low | 52.1 | Low | 21 Ų | 21 | 82 Ų | 82 | 11% | 0.108 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -57.4 | -46 | 171.5 | -68.5 | 166.1 | 0 | 0 | 0 | 110.9 | I85 D86 L87 Y92 K93 I94 | I85-I90 HydrophobicContact CG2-CD1 4.04Å; D86-I90 WeakPolarHBondContact O-CG1 3.29Å; D86-I90 PolarHBondContact O-N 3.46Å; L87-I90 HydrophobicContact CD2-CD1 4.37Å; I90-Y92 VanDerWaalsContact C-N 3.34Å; I90-Y92 PolarHBondContact O-N 3.39Å; I90-K93 PolarHBondContact O-N 2.88Å; I90-I94 HydrophobicContact CG2-CD1 3.7Å; I90-I94 HydrophobicContact CG2-CG1 4.33Å; I90-I94 VanDerWaalsContact O-CB 3.28Å; I90-I94 WeakPolarHBondContact O-CB 3.16Å; I90-I94 WeakPolarHBondContact O-CG1 2.99Å; I90-I94 PolarHBondContact O-N 3.37Å |
| 91 | Y | 51.2 | Low | 51.7 | Low | 135 Ų | 135 | 83.2 Ų | 83.2 | 53% | 0.529 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -63.1 | -39.3 | 176.4 | 178.4 | -99.4 | 0 | 0 | 0 | 112.4 | L87 K88 D89 I94 R95 | L87-Y91 VanDerWaalsContact O-CB 3.31Å; L87-Y91 WeakPolarHBondContact O-CB 3.21Å; L87-Y91 PolarHBondContact O-N 2.93Å; K88-Y91 PolarHBondContact O-N 3.15Å; D89-Y91 VanDerWaalsContact C-N 3.34Å; D89-Y91 PolarHBondContact O-N 2.95Å; Y91-I94 PolarHBondContact O-N 3.48Å; Y91-R95 WeakPolarHBondContact O-CB 3.24Å; Y91-R95 PolarHBondContact O-N 3.46Å; Y91-R95 PolarHBondContact OH-NH1 3.43Å |
| 92 | Y | 53.7 | Low | 51.2 | Low | 121 Ų | 121 | 84.2 Ų | 84.2 | 48% | 0.475 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -65.6 | -43.9 | 175.6 | -167.3 | -103.9 | 0 | 0 | 0 | 111.5 | K88 D89 I90 R95 C96 F106 | K88-Y92 VanDerWaalsContact O-CB 3.32Å; K88-Y92 WeakPolarHBondContact O-CB 3.37Å; K88-Y92 PolarHBondContact O-N 3.47Å; D89-Y92 CarbonylContact O-C 3.58Å; D89-Y92 WeakPolarHBondContact O-CB 3.19Å; D89-Y92 PolarHBondContact O-N 2.93Å; D89-Y92 VanDerWaalsContact O-N 3.15Å; I90-Y92 VanDerWaalsContact C-N 3.34Å; I90-Y92 PolarHBondContact O-N 3.39Å; Y92-R95 PolarHBondContact O-N 3.5Å; Y92-C96 PolarHBondContact O-N 3.36Å; Y92-C96 PolarHBondContact O-SG 2.91Å; Y92-F106 AromaticContact CD1-CD1 3.89Å; Y92-F106 HydrophobicContact CD1-CD1 3.89Å; Y92-F106 AromaticContact CD1-CE1 3.85Å; Y92-F106 HydrophobicContact CD1-CE1 3.85Å; Y92-F106 HydrophobicContact CD2-CD1 4.49Å; Y92-F106 AromaticContact CD2-CE1 3.69Å; Y92-F106 HydrophobicContact CD2-CE1 3.69Å; Y92-F106 AromaticContact CE1-CD1 3.18Å; Y92-F106 HydrophobicContact CE1-CD1 3.18Å; Y92-F106 AromaticContact CE1-CE1 3.38Å; Y92-F106 HydrophobicContact CE1-CE1 3.38Å; Y92-F106 HydrophobicContact CE1-CG 4.47Å; Y92-F106 AromaticContact CE2-CD1 3.88Å; Y92-F106 HydrophobicContact CE2-CD1 3.88Å; Y92-F106 AromaticContact CE2-CE1 3.19Å; Y92-F106 HydrophobicContact CE2-CE1 3.19Å; Y92-F106 HydrophobicContact CE2-CZ 4.11Å; Y92-F106 HydrophobicContact CG-CD1 4.49Å; Y92-F106 AromaticContact CG-CE1 3.99Å; Y92-F106 HydrophobicContact CG-CE1 3.99Å; Y92-F106 AromaticContact CZ-CD1 3.15Å; Y92-F106 AromaticContact CZ-CE1 2.99Å; Y92-F106 WeakPolarHBondContact OH-CD1 3.45Å; Y92-F106 VanDerWaalsContact OH-CE1 3.24Å; Y92-F106 WeakPolarHBondContact OH-CE1 3.35Å |
| 93 | K | 53.6 | Low | 50.4 | Low | 5 Ų | 5 | 82.3 Ų | 82.3 | 2% | 0.022 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -62.4 | -42.7 | 174 | -68 | 173.5 | 176.5 | 158.2 | 0 | 111.8 | D89 I90 R95 C96 V97 V111 D116 | D89-K93 WeakPolarHBondContact O-CB 2.99Å; D89-K93 WeakPolarHBondContact O-CG 3.43Å; D89-K93 PolarHBondContact O-N 3.23Å; D89-K93 WeakPolarHBondContact OD2-CE 3.17Å; D89-K93 IonicContact OD2-NZ 2.74Å; D89-K93 PolarHBondContact OD2-NZ 3.08Å; I90-K93 PolarHBondContact O-N 2.88Å; K93-R95 VanDerWaalsContact C-N 3.34Å; K93-R95 PolarHBondContact O-N 2.83Å; K93-C96 WeakPolarHBondContact O-CB 3.24Å; K93-C96 PolarHBondContact O-N 2.92Å; K93-V97 WeakPolarHBondContact O-CG2 3.39Å; K93-V97 PolarHBondContact O-N 2.84Å; K93-V111 HydrophobicContact CB-CG2 4.08Å; K93-V111 HydrophobicContact CD-CG2 3.96Å; K93-V111 HydrophobicContact CG-CG2 3.58Å; K93-D116 IonicContact NZ-OD2 2.82Å; K93-D116 PolarHBondContact NZ-OD2 3.21Å |
| 94 | I | 56.1 | Low | 49.5 | Very low | 36 Ų | 36 | 81.8 Ų | 81.8 | 19% | 0.185 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -58.9 | -44.5 | 173.2 | -77.8 | 172.4 | 0 | 0 | 0 | 111.2 | I90 Y91 V97 L98 Y175 L178 | I90-I94 HydrophobicContact CG2-CD1 3.7Å; I90-I94 HydrophobicContact CG2-CG1 4.33Å; I90-I94 VanDerWaalsContact O-CB 3.28Å; I90-I94 WeakPolarHBondContact O-CB 3.16Å; I90-I94 WeakPolarHBondContact O-CG1 2.99Å; I90-I94 PolarHBondContact O-N 3.37Å; Y91-I94 PolarHBondContact O-N 3.48Å; I94-V97 PolarHBondContact O-N 2.91Å; I94-L98 WeakPolarHBondContact O-CB 3.38Å; I94-L98 PolarHBondContact O-N 3.41Å; I94-Y175 HydrophobicContact CG1-CD1 4.4Å; I94-L178 HydrophobicContact CB-CD1 3.8Å; I94-L178 HydrophobicContact CD1-CD1 3.77Å; I94-L178 HydrophobicContact CG1-CD1 3.46Å; I94-L178 VanDerWaalsContact CG1-CD1 3.46Å; I94-L178 HydrophobicContact CG2-CD1 3.24Å; I94-L178 HydrophobicContact CG2-CD2 3.92Å; I94-L178 HydrophobicContact CG2-CG 4.22Å |
| 95 | R | 50.3 | Low | 48.9 | Very low | 144 Ų | 144 | 79.7 Ų | 79.7 | 54% | 0.543 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -71.3 | -32.3 | -179.5 | -161.7 | 169.4 | -175.8 | 149.6 | -3.9 | 112.6 | Y91 Y92 K93 M99 | Y91-R95 WeakPolarHBondContact O-CB 3.24Å; Y91-R95 PolarHBondContact O-N 3.46Å; Y91-R95 PolarHBondContact OH-NH1 3.43Å; Y92-R95 PolarHBondContact O-N 3.5Å; K93-R95 VanDerWaalsContact C-N 3.34Å; K93-R95 PolarHBondContact O-N 2.83Å; R95-M99 PolarHBondContact O-N 3.43Å |
| 96 | C | 50.3 | Low | 48.5 | Very low | 25 Ų | 25 | 80.5 Ų | 80.5 | 17% | 0.169 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -62.7 | -42.1 | 169.7 | -67.2 | 0 | 0 | 0 | 0 | 112.3 | Y92 K93 M99 F106 | Y92-C96 PolarHBondContact O-N 3.36Å; Y92-C96 PolarHBondContact O-SG 2.91Å; K93-C96 WeakPolarHBondContact O-CB 3.24Å; K93-C96 PolarHBondContact O-N 2.92Å; C96-M99 CarbonylContact O-C 3.6Å; C96-M99 VanDerWaalsContact O-O 3.04Å; C96-F106 VanDerWaalsContact SG-CB 3.53Å; C96-F106 WeakPolarHBondContact SG-CD1 3.32Å; C96-F106 WeakPolarHBondContact SG-CE1 3.28Å; C96-F106 WeakPolarHBondContact SG-CG 2.92Å |
| 97 | V | 50.1 | Low | 47.9 | Very low | 3 Ų | 3 | 81.5 Ų | 81.5 | 2% | 0.018 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -76.2 | -32.4 | -176.7 | 173 | 0 | 0 | 0 | 0 | 111.3 | K93 I94 M99 Y175 S176 S211 L215 | K93-V97 WeakPolarHBondContact O-CG2 3.39Å; K93-V97 PolarHBondContact O-N 2.84Å; I94-V97 PolarHBondContact O-N 2.91Å; V97-M99 VanDerWaalsContact C-N 3.31Å; V97-M99 PolarHBondContact O-N 2.81Å; V97-Y175 WeakPolarHBondContact CG1-O 3.4Å; V97-S176 VanDerWaalsContact CG1-CA 3.49Å; V97-S211 PolarHBondContact O-OG 3.3Å; V97-L215 HydrophobicContact CG2-CD1 3.78Å |
| 98 | L | 54.8 | Low | 48 | Very low | 66 Ų | 66 | 81.4 Ų | 81.4 | 35% | 0.346 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -68.7 | -27.9 | 175.6 | -169.1 | 67.5 | 0 | 0 | 0 | 112.3 | I94 L178 P179 V182 W207 | I94-L98 WeakPolarHBondContact O-CB 3.38Å; I94-L98 PolarHBondContact O-N 3.41Å; L98-L178 HydrophobicContact CD1-CD2 3.94Å; L98-P179 HydrophobicContact CD1-CB 4.45Å; L98-P179 HydrophobicContact CD1-CG 4.29Å; L98-V182 HydrophobicContact CD1-CG2 4.26Å; L98-W207 VanDerWaalsContact O-CZ2 3.29Å; L98-W207 WeakPolarHBondContact O-CZ2 3.14Å; L98-W207 PolarHBondContact O-NE1 2.94Å |
| 99 | M | 47.9 | Very low | 47.9 | Very low | 111 Ų | 111 | 78.4 Ų | 78.4 | 55% | 0.547 | 41% | 0.406 | S | S | . | . | trans | -126.6 | 94.1 | 179.6 | -158.4 | 179.7 | -150.2 | 0 | 0 | 110.9 | R95 C96 V97 M101 | R95-M99 PolarHBondContact O-N 3.43Å; C96-M99 CarbonylContact O-C 3.6Å; C96-M99 VanDerWaalsContact O-O 3.04Å; V97-M99 VanDerWaalsContact C-N 3.31Å; V97-M99 PolarHBondContact O-N 2.81Å; M99-M101 HydrophobicContact CE-CG 4.4Å; M99-M101 HydrophobicContact CG-CB 4.33Å; M99-M101 HydrophobicContact CG-CG 3.96Å; M99-M101 PolarHBondContact O-N 2.77Å; M99-M101 HydrophobicContact SD-CG 4.39Å | ||
| 100 | P | 45.5 | Very low | 47.6 | Very low | 26 Ų | 26 | 79 Ų | 79 | 17% | 0.169 | 41% | 0.411 | C | S | . | . | trans | -78.1 | 54.6 | -179.4 | 35 | -34 | 0 | 0 | 0 | 110.3 | P102 W207 Y210 | P100-P102 WeakPolarHBondContact O-CD 3.43Å; P100-W207 HydrophobicContact CG-CZ2 4.1Å; P100-Y210 HydrophobicContact CB-CD1 4.06Å; P100-Y210 HydrophobicContact CB-CE1 3.96Å; P100-Y210 HydrophobicContact CG-CD1 3.84Å; P100-Y210 HydrophobicContact CG-CE1 3.97Å | ||
| 101 | M | 38.7 | Very low | 47.4 | Very low | 114 Ų | 114 | 79.1 Ų | 79.1 | 56% | 0.562 | 41% | 0.413 | S | S | * | . | trans | -91.8 | 116.7 | 174.9 | -82.9 | -73.9 | -104.7 | 0 | 0 | 109.1 | M99 S103 | M99-M101 HydrophobicContact CE-CG 4.4Å; M99-M101 HydrophobicContact CG-CB 4.33Å; M99-M101 HydrophobicContact CG-CG 3.96Å; M99-M101 PolarHBondContact O-N 2.77Å; M99-M101 HydrophobicContact SD-CG 4.39Å; M101-S103 PolarHBondContact O-N 2.98Å | ||
| 102 | P | 42.6 | Very low | 47.4 | Very low | 128 Ų | 128 | 76.7 Ų | 76.7 | 83% | 0.831 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.8 | -9.2 | 178.2 | -19.8 | 31.2 | 0 | 0 | 0 | 114.7 | P100 | P100-P102 WeakPolarHBondContact O-CD 3.43Š|
| 103 | S | 37.3 | Very low | 47.3 | Very low | 108 Ų | 108 | 75.4 Ų | 75.4 | 76% | 0.755 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.8 | -7.4 | -168.8 | -174.3 | 0 | 0 | 0 | 0 | 115 | M101 | M101-S103 PolarHBondContact O-N 2.98Š|
| 104 | L | 39.4 | Very low | 47.3 | Very low | 103 Ų | 103 | 79 Ų | 79 | 54% | 0.539 | 42% | 0.423 | S | S | . | . | S | Bend | trans | -102.7 | 23.4 | -166.2 | -137.5 | 136.3 | 0 | 0 | 0 | 114.8 | F106 | L104-F106 HydrophobicContact CB-CD2 3.69Å; L104-F106 HydrophobicContact CB-CE2 3.72Å; L104-F106 HydrophobicContact CD2-CD2 3.84Å; L104-F106 HydrophobicContact CD2-CE2 3.09Å; L104-F106 HydrophobicContact CD2-CZ 3.63Å; L104-F106 HydrophobicContact CG-CD2 4.32Å; L104-F106 HydrophobicContact CG-CE2 3.89Å; L104-F106 WeakPolarHBondContact O-CD2 3.4Å; L104-F106 PolarHBondContact O-N 3.29Å |
| 105 | G | 37.6 | Very low | 47.3 | Very low | 72 Ų | 72 | 81 Ų | 81 | 74% | 0.742 | 44% | 0.439 | S | S | * | . | trans | 60.3 | 14.4 | 165.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | N107 | G105-N107 PolarHBondContact O-N 3.13Š| ||
| 106 | F | 44.3 | Very low | 48 | Very low | 58 Ų | 58 | 75.2 Ų | 75.2 | 25% | 0.254 | 42% | 0.419 | S | S | . | . | trans | -76.9 | 121.8 | -178.8 | -73.8 | -79.8 | 0 | 0 | 0 | 110.2 | Y92 C96 L104 R108 | Y92-F106 AromaticContact CD1-CD1 3.89Å; Y92-F106 HydrophobicContact CD1-CD1 3.89Å; Y92-F106 AromaticContact CD1-CE1 3.85Å; Y92-F106 HydrophobicContact CD1-CE1 3.85Å; Y92-F106 HydrophobicContact CD2-CD1 4.49Å; Y92-F106 AromaticContact CD2-CE1 3.69Å; Y92-F106 HydrophobicContact CD2-CE1 3.69Å; Y92-F106 AromaticContact CE1-CD1 3.18Å; Y92-F106 HydrophobicContact CE1-CD1 3.18Å; Y92-F106 AromaticContact CE1-CE1 3.38Å; Y92-F106 HydrophobicContact CE1-CE1 3.38Å; Y92-F106 HydrophobicContact CE1-CG 4.47Å; Y92-F106 AromaticContact CE2-CD1 3.88Å; Y92-F106 HydrophobicContact CE2-CD1 3.88Å; Y92-F106 AromaticContact CE2-CE1 3.19Å; Y92-F106 HydrophobicContact CE2-CE1 3.19Å; Y92-F106 HydrophobicContact CE2-CZ 4.11Å; Y92-F106 HydrophobicContact CG-CD1 4.49Å; Y92-F106 AromaticContact CG-CE1 3.99Å; Y92-F106 HydrophobicContact CG-CE1 3.99Å; Y92-F106 AromaticContact CZ-CD1 3.15Å; Y92-F106 AromaticContact CZ-CE1 2.99Å; Y92-F106 WeakPolarHBondContact OH-CD1 3.45Å; Y92-F106 VanDerWaalsContact OH-CE1 3.24Å; Y92-F106 WeakPolarHBondContact OH-CE1 3.35Å; C96-F106 VanDerWaalsContact SG-CB 3.53Å; C96-F106 WeakPolarHBondContact SG-CD1 3.32Å; C96-F106 WeakPolarHBondContact SG-CE1 3.28Å; C96-F106 WeakPolarHBondContact SG-CG 2.92Å; L104-F106 HydrophobicContact CB-CD2 3.69Å; L104-F106 HydrophobicContact CB-CE2 3.72Å; L104-F106 HydrophobicContact CD2-CD2 3.84Å; L104-F106 HydrophobicContact CD2-CE2 3.09Å; L104-F106 HydrophobicContact CD2-CZ 3.63Å; L104-F106 HydrophobicContact CG-CD2 4.32Å; L104-F106 HydrophobicContact CG-CE2 3.89Å; L104-F106 WeakPolarHBondContact O-CD2 3.4Å; L104-F106 PolarHBondContact O-N 3.29Å; F106-R108 VanDerWaalsContact C-N 3.33Å; F106-R108 PolarHBondContact O-N 2.9Å | ||
| 107 | N | 45.1 | Very low | 48.7 | Very low | 110 Ų | 110 | 79 Ų | 79 | 59% | 0.588 | 43% | 0.433 | S | S | * | . | trans | -64.9 | 91.7 | 177.1 | -75.5 | -42.3 | 0 | 0 | 0 | 110.3 | G105 Q109 V110 | G105-N107 PolarHBondContact O-N 3.13Å; N107-Q109 PolarHBondContact O-N 3.34Å; N107-V110 HydrophobicContact CB-CB 4.2Å; N107-V110 HydrophobicContact CB-CG2 3.58Å; N107-V110 PolarHBondContact O-N 3.21Å | ||
| 108 | R | 51.6 | Low | 49.8 | Very low | 112 Ų | 112 | 87.1 Ų | 87.1 | 42% | 0.423 | 46% | 0.463 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.4 | -19.5 | 167.6 | -123.7 | 151.7 | 82.4 | 139.4 | 3 | 113.3 | F106 S214 L215 G218 | F106-R108 VanDerWaalsContact C-N 3.33Å; F106-R108 PolarHBondContact O-N 2.9Å; R108-S214 PolarHBondContact NH1-O 3.03Å; R108-S214 PolarHBondContact NH2-O 2.73Å; R108-L215 HydrophobicContact CG-CD2 3.4Å; R108-L215 VanDerWaalsContact CG-CD2 3.4Å; R108-G218 VanDerWaalsContact NH2-CA 3.35Å |
| 109 | Q | 46 | Very low | 50.9 | Low | 109 Ų | 109 | 84.2 Ų | 84.2 | 51% | 0.509 | 45% | 0.449 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.5 | -29.8 | 174.6 | -65.5 | 178.3 | -14 | 0 | 0 | 112.6 | N107 V111 R112 D113 | N107-Q109 PolarHBondContact O-N 3.34Å; Q109-V111 PolarHBondContact O-N 2.79Å; Q109-R112 CarbonylContact O-C 3.42Å; Q109-R112 WeakPolarHBondContact O-CA 3.31Å; Q109-R112 VanDerWaalsContact O-CB 3.23Å; Q109-R112 WeakPolarHBondContact O-CB 3.15Å; Q109-R112 PolarHBondContact O-N 3.05Å; Q109-D113 WeakPolarHBondContact O-CB 3.46Å; Q109-D113 PolarHBondContact O-N 3.1Å; Q109-D113 VanDerWaalsContact O-OD2 3.08Å |
| 110 | V | 47.8 | Very low | 52.5 | Low | 51 Ų | 51 | 79 Ų | 79 | 31% | 0.309 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -72.1 | -33.3 | -178.5 | 172.5 | 0 | 0 | 0 | 0 | 113.1 | N107 R112 N114 | N107-V110 HydrophobicContact CB-CB 4.2Å; N107-V110 HydrophobicContact CB-CG2 3.58Å; N107-V110 PolarHBondContact O-N 3.21Å; V110-R112 PolarHBondContact O-N 3.36Å; V110-N114 PolarHBondContact O-N 3.15Å |
| 111 | V | 51.5 | Low | 54.3 | Low | 25 Ų | 25 | 80.1 Ų | 80.1 | 15% | 0.152 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -65.2 | -28.6 | 167.4 | 176.8 | 0 | 0 | 0 | 0 | 111.4 | K93 Q109 V172 | K93-V111 HydrophobicContact CB-CG2 4.08Å; K93-V111 HydrophobicContact CD-CG2 3.96Å; K93-V111 HydrophobicContact CG-CG2 3.58Å; Q109-V111 PolarHBondContact O-N 2.79Å; V111-V172 HydrophobicContact CG1-CG2 4.38Å |
| 112 | R | 50.8 | Low | 56.4 | Low | 83 Ų | 83 | 77.2 Ų | 77.2 | 31% | 0.313 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -84.5 | -33.2 | -175.2 | -168.6 | 173.3 | 70.1 | 165 | 2.8 | 111.4 | Q109 V110 Q168 | Q109-R112 CarbonylContact O-C 3.42Å; Q109-R112 WeakPolarHBondContact O-CA 3.31Å; Q109-R112 VanDerWaalsContact O-CB 3.23Å; Q109-R112 WeakPolarHBondContact O-CB 3.15Å; Q109-R112 PolarHBondContact O-N 3.05Å; V110-R112 PolarHBondContact O-N 3.36Å; R112-Q168 HydrophobicContact CG-CB 4.45Å; R112-Q168 HydrophobicContact CG-CG 3.8Å; R112-Q168 VanDerWaalsContact O-CG 3.27Å; R112-Q168 WeakPolarHBondContact O-CG 3.37Å; R112-Q168 PolarHBondContact O-NE2 2.82Å |
| 113 | D | 52.3 | Low | 58.4 | Low | 94 Ų | 94 | 71.7 Ų | 71.7 | 50% | 0.503 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -93 | -26.1 | -169.2 | -60.7 | -19.9 | 0 | 0 | 0 | 112.7 | Q109 | Q109-D113 WeakPolarHBondContact O-CB 3.46Å; Q109-D113 PolarHBondContact O-N 3.1Å; Q109-D113 VanDerWaalsContact O-OD2 3.08Å |
| 114 | N | 52.9 | Low | 60.8 | Low | 81 Ų | 81 | 66.7 Ų | 66.7 | 43% | 0.433 | 35% | 0.351 | S | S | . | . | S | Bend | trans | -120 | 91.9 | 171.3 | -61.8 | -45.6 | 0 | 0 | 0 | 110.4 | V110 D116 | V110-N114 PolarHBondContact O-N 3.15Å; N114-D116 PolarHBondContact O-N 2.84Å |
| 115 | P | 55.9 | Low | 63.1 | Low | 79 Ų | 79 | 65.6 Ų | 65.6 | 51% | 0.513 | 35% | 0.345 | S | S | . | . | trans | -75.7 | 89 | -177.4 | 30.4 | -33.5 | 0 | 0 | 0 | 110.9 | F117 | P115-F117 PolarHBondContact O-N 3.48Š| ||
| 116 | D | 65.9 | Low | 65.4 | Low | 22 Ų | 22 | 66.2 Ų | 66.2 | 12% | 0.118 | 33% | 0.331 | C | S | . | . | trans | -65.2 | 105.9 | 168.5 | -52.7 | -43 | 0 | 0 | 0 | 108.2 | K93 N114 W118 P120 | K93-D116 IonicContact NZ-OD2 2.82Å; K93-D116 PolarHBondContact NZ-OD2 3.21Å; N114-D116 PolarHBondContact O-N 2.84Å; D116-W118 VanDerWaalsContact C-N 3.29Å; D116-P120 WeakPolarHBondContact O-CD 3.22Å; D116-P120 WeakPolarHBondContact O-CG 3.35Å | ||
| 117 | F | 64.9 | Low | 67.4 | Low | 105 Ų | 105 | 63.5 Ų | 63.5 | 46% | 0.461 | 32% | 0.319 | S | S | . | . | S | Bend | trans | -69.8 | -31.8 | 175.6 | 177.2 | -105 | 0 | 0 | 0 | 111.6 | P115 P120 L121 W146 L170 | P115-F117 PolarHBondContact O-N 3.48Å; F117-P120 WeakPolarHBondContact O-CD 3.38Å; F117-L121 HydrophobicContact CD1-CD1 4.09Å; F117-L121 HydrophobicContact CE1-CD1 3.32Å; F117-L121 HydrophobicContact CZ-CD1 3.65Å; F117-L121 WeakPolarHBondContact O-CB 3.49Å; F117-L121 PolarHBondContact O-N 2.88Å; F117-W146 HydrophobicContact CE2-CH2 4.45Å; F117-L170 HydrophobicContact CD2-CD2 4Å; F117-L170 HydrophobicContact CE2-CD2 3.78Å |
| 118 | W | 73.9 | Confident | 69.3 | Low | 172 Ų | 172 | 58.4 Ų | 58.4 | 65% | 0.652 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -72.9 | -35.5 | -173.9 | -74.4 | 96.4 | 0 | 0 | 0 | 113.7 | I85 D116 A122 | I85-W118 HydrophobicContact CD1-CG 4.5Å; D116-W118 VanDerWaalsContact C-N 3.29Å; W118-A122 VanDerWaalsContact O-CB 3.28Å; W118-A122 WeakPolarHBondContact O-CB 3.27Å; W118-A122 PolarHBondContact O-N 3.2Å |
| 119 | G | 76.8 | Confident | 70.8 | Confident | 5 Ų | 5 | 57.7 Ų | 57.7 | 5% | 0.052 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -63.1 | -57.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | L121 A122 V123 | G119-L121 VanDerWaalsContact C-N 3.28Å; G119-L121 PolarHBondContact O-N 2.86Å; G119-A122 PolarHBondContact O-N 3.33Å; G119-V123 WeakPolarHBondContact O-CG2 3.33Å; G119-V123 PolarHBondContact O-N 2.9Å |
| 120 | P | 81.9 | Confident | 72.4 | Confident | 2 Ų | 2 | 55.7 Ų | 55.7 | 1% | 0.013 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60 | -39 | 176.1 | -14 | 24.6 | 0 | 0 | 0 | 111.8 | D116 F117 V123 V124 W146 G171 Y175 | D116-P120 WeakPolarHBondContact O-CD 3.22Å; D116-P120 WeakPolarHBondContact O-CG 3.35Å; F117-P120 WeakPolarHBondContact O-CD 3.38Å; P120-V123 PolarHBondContact O-N 3.39Å; P120-V124 WeakPolarHBondContact O-CB 3.41Å; P120-V124 WeakPolarHBondContact O-CG2 3.13Å; P120-V124 PolarHBondContact O-N 3.19Å; P120-W146 HydrophobicContact CB-CZ2 3.96Å; P120-G171 VanDerWaalsContact CG-CA 3.42Å; P120-Y175 HydrophobicContact CB-CD2 4.42Å; P120-Y175 HydrophobicContact CB-CE2 4.4Å; P120-Y175 VanDerWaalsContact CD-CZ 3.4Å; P120-Y175 WeakPolarHBondContact CD-OH 3.23Å; P120-Y175 HydrophobicContact CG-CD2 3.84Å; P120-Y175 HydrophobicContact CG-CE1 4.26Å; P120-Y175 HydrophobicContact CG-CE2 3.42Å; P120-Y175 VanDerWaalsContact CG-CE2 3.42Å; P120-Y175 HydrophobicContact CG-CG 4.41Å |
| 121 | L | 83.6 | Confident | 73.8 | Confident | 49 Ų | 49 | 53.5 Ų | 53.5 | 26% | 0.257 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -61.2 | -46.7 | 176.9 | -176.3 | 155.6 | 0 | 0 | 0 | 111 | F117 G119 V123 V124 L125 W146 | F117-L121 HydrophobicContact CD1-CD1 4.09Å; F117-L121 HydrophobicContact CE1-CD1 3.32Å; F117-L121 HydrophobicContact CZ-CD1 3.65Å; F117-L121 WeakPolarHBondContact O-CB 3.49Å; F117-L121 PolarHBondContact O-N 2.88Å; G119-L121 VanDerWaalsContact C-N 3.28Å; G119-L121 PolarHBondContact O-N 2.86Å; L121-V123 VanDerWaalsContact C-N 3.33Å; L121-V123 PolarHBondContact O-N 3.45Å; L121-V124 PolarHBondContact O-N 2.7Å; L121-L125 HydrophobicContact CD2-CD1 4.41Å; L121-L125 VanDerWaalsContact O-CB 3.26Å; L121-L125 WeakPolarHBondContact O-CB 3.49Å; L121-L125 PolarHBondContact O-N 2.86Å; L121-W146 HydrophobicContact CB-CH2 4.24Å |
| 122 | A | 82.5 | Confident | 74.3 | Confident | 54 Ų | 54 | 55.4 Ų | 55.4 | 45% | 0.446 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -61.8 | -41.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | W118 G119 L125 L126 | W118-A122 VanDerWaalsContact O-CB 3.28Å; W118-A122 WeakPolarHBondContact O-CB 3.27Å; W118-A122 PolarHBondContact O-N 3.2Å; G119-A122 PolarHBondContact O-N 3.33Å; A122-L125 PolarHBondContact O-N 3.33Å; A122-L126 VanDerWaalsContact O-CB 3.3Å; A122-L126 WeakPolarHBondContact O-CB 3.34Å; A122-L126 PolarHBondContact O-N 3.11Å |
| 123 | V | 84.1 | Confident | 74.6 | Confident | 12 Ų | 12 | 62.1 Ų | 62.1 | 7% | 0.073 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.1 | -47.2 | 175.8 | 173.8 | 0 | 0 | 0 | 0 | 111.1 | G119 P120 L121 L125 L126 F127 G174 Y175 L177 L178 I181 | G119-V123 WeakPolarHBondContact O-CG2 3.33Å; G119-V123 PolarHBondContact O-N 2.9Å; P120-V123 PolarHBondContact O-N 3.39Å; L121-V123 VanDerWaalsContact C-N 3.33Å; L121-V123 PolarHBondContact O-N 3.45Å; V123-L125 VanDerWaalsContact C-N 3.34Å; V123-L125 PolarHBondContact O-N 3.37Å; V123-L126 PolarHBondContact O-N 3.1Å; V123-F127 WeakPolarHBondContact O-CB 3.12Å; V123-F127 PolarHBondContact O-N 3.16Å; V123-G174 VanDerWaalsContact CG1-O 3.32Å; V123-G174 WeakPolarHBondContact CG1-O 3.34Å; V123-Y175 HydrophobicContact CG2-CD1 4.31Å; V123-L177 HydrophobicContact CG1-CB 4.27Å; V123-L178 HydrophobicContact CG1-CB 4.34Å; V123-L178 HydrophobicContact CG2-CD1 4.39Å; V123-I181 HydrophobicContact CG1-CD1 3.64Å; V123-I181 VanDerWaalsContact O-CD1 3.3Å; V123-I181 WeakPolarHBondContact O-CD1 3.47Å |
| 124 | V | 88.3 | Confident | 75 | Confident | 2 Ų | 2 | 59.2 Ų | 59.2 | 1% | 0.012 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63.5 | -40.9 | 177.9 | 173.3 | 0 | 0 | 0 | 0 | 111 | P120 L121 F127 S128 I142 W146 L177 | P120-V124 WeakPolarHBondContact O-CB 3.41Å; P120-V124 WeakPolarHBondContact O-CG2 3.13Å; P120-V124 PolarHBondContact O-N 3.19Å; L121-V124 PolarHBondContact O-N 2.7Å; V124-F127 PolarHBondContact O-N 3.28Å; V124-S128 VanDerWaalsContact O-CB 3.23Å; V124-S128 WeakPolarHBondContact O-CB 3.45Å; V124-S128 PolarHBondContact O-N 2.89Å; V124-I142 HydrophobicContact CG1-CG2 4.08Å; V124-W146 HydrophobicContact CB-CD2 4.44Å; V124-W146 HydrophobicContact CG1-CB 4.37Å; V124-W146 HydrophobicContact CG1-CD2 4.18Å; V124-W146 HydrophobicContact CG1-CE3 4.25Å; V124-W146 HydrophobicContact CG1-CG 4.24Å; V124-W146 HydrophobicContact CG2-CD2 3.77Å; V124-W146 HydrophobicContact CG2-CE3 4.35Å; V124-W146 HydrophobicContact CG2-CG 3.97Å; V124-W146 HydrophobicContact CG2-CZ2 4.09Å; V124-L177 HydrophobicContact CB-CD1 4.36Å; V124-L177 HydrophobicContact CG2-CD1 3.59Å |
| 125 | L | 87.3 | Confident | 75.7 | Confident | 80 Ų | 80 | 61.5 Ų | 61.5 | 42% | 0.419 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -65.3 | -41.7 | 177.8 | -168.7 | 154.3 | 0 | 0 | 0 | 111.1 | L121 A122 V123 S128 M129 | L121-L125 HydrophobicContact CD2-CD1 4.41Å; L121-L125 VanDerWaalsContact O-CB 3.26Å; L121-L125 WeakPolarHBondContact O-CB 3.49Å; L121-L125 PolarHBondContact O-N 2.86Å; A122-L125 PolarHBondContact O-N 3.33Å; V123-L125 VanDerWaalsContact C-N 3.34Å; V123-L125 PolarHBondContact O-N 3.37Å; L125-S128 CarbonylContact O-C 3.41Å; L125-S128 WeakPolarHBondContact O-CB 3.44Å; L125-S128 PolarHBondContact O-N 3.4Å; L125-M129 HydrophobicContact CD2-CG 4.2Å; L125-M129 WeakPolarHBondContact O-CG 3.17Å; L125-M129 PolarHBondContact O-N 3.19Å |
| 126 | L | 85.6 | Confident | 76.6 | Confident | 85 Ų | 85 | 66.2 Ų | 66.2 | 45% | 0.445 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -65.8 | -45.4 | 176.8 | -166.3 | 151.6 | 0 | 0 | 0 | 111.2 | A122 V123 S128 M129 I130 I181 | A122-L126 VanDerWaalsContact O-CB 3.3Å; A122-L126 WeakPolarHBondContact O-CB 3.34Å; A122-L126 PolarHBondContact O-N 3.11Å; V123-L126 PolarHBondContact O-N 3.1Å; L126-S128 VanDerWaalsContact C-N 3.26Å; L126-S128 PolarHBondContact O-N 2.89Å; L126-M129 PolarHBondContact O-N 2.86Å; L126-I130 HydrophobicContact CD2-CD1 3.43Å; L126-I130 VanDerWaalsContact CD2-CD1 3.43Å; L126-I130 HydrophobicContact CG-CD1 4.35Å; L126-I130 PolarHBondContact O-N 2.74Å; L126-I130 VanDerWaalsContact O-N 3.1Å; L126-I181 HydrophobicContact CD2-CB 4.48Å; L126-I181 HydrophobicContact CD2-CD1 3.93Å; L126-I181 HydrophobicContact CD2-CG1 4.33Å; L126-I181 HydrophobicContact CD2-CG2 3.36Å |
| 127 | F | 86.8 | Confident | 77.3 | Confident | 1 Ų | 1 | 74.3 Ų | 74.3 | 0% | 0.004 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -55.4 | -45 | 170.8 | 175.5 | -103.8 | 0 | 0 | 0 | 111.1 | V123 V124 M129 I130 S131 I142 L180 I181 F239 Y243 | V123-F127 WeakPolarHBondContact O-CB 3.12Å; V123-F127 PolarHBondContact O-N 3.16Å; V124-F127 PolarHBondContact O-N 3.28Å; F127-M129 VanDerWaalsContact C-N 3.32Å; F127-M129 PolarHBondContact O-N 2.62Å; F127-I130 PolarHBondContact O-N 2.77Å; F127-S131 WeakPolarHBondContact O-CB 3.38Å; F127-S131 PolarHBondContact O-N 2.69Å; F127-I142 HydrophobicContact CD1-CG2 4.2Å; F127-I142 HydrophobicContact CE1-CD1 4.44Å; F127-I142 HydrophobicContact CE1-CG2 4.48Å; F127-L180 HydrophobicContact CD2-CB 4.32Å; F127-L180 HydrophobicContact CE2-CB 4.01Å; F127-L180 HydrophobicContact CE2-CD2 3.98Å; F127-L180 HydrophobicContact CZ-CD2 4.24Å; F127-I181 HydrophobicContact CB-CD1 3.87Å; F127-I181 HydrophobicContact CB-CG1 3.77Å; F127-I181 HydrophobicContact CD2-CG1 4.05Å; F127-I181 HydrophobicContact CG-CG1 4.41Å; F127-F239 HydrophobicContact CE1-CB 4.33Å; F127-F239 HydrophobicContact CE1-CD1 4.2Å; F127-F239 HydrophobicContact CZ-CB 4.32Å; F127-Y243 HydrophobicContact CE2-CD2 4.31Å |
| 128 | S | 86.1 | Confident | 78.2 | Confident | 4 Ų | 4 | 70.4 Ų | 70.4 | 3% | 0.028 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -64.2 | -33.7 | 179.3 | -173.6 | 0 | 0 | 0 | 0 | 113.7 | V124 L125 L126 V139 | V124-S128 VanDerWaalsContact O-CB 3.23Å; V124-S128 WeakPolarHBondContact O-CB 3.45Å; V124-S128 PolarHBondContact O-N 2.89Å; L125-S128 CarbonylContact O-C 3.41Å; L125-S128 WeakPolarHBondContact O-CB 3.44Å; L125-S128 PolarHBondContact O-N 3.4Å; L126-S128 VanDerWaalsContact C-N 3.26Å; L126-S128 PolarHBondContact O-N 2.89Å; S128-V139 WeakPolarHBondContact OG-CA 3.37Å; S128-V139 WeakPolarHBondContact OG-CB 3.16Å; S128-V139 WeakPolarHBondContact OG-CG1 3.42Å; S128-V139 VanDerWaalsContact OG-CG2 3.32Å; S128-V139 WeakPolarHBondContact OG-CG2 3.19Å |
| 129 | M | 82.3 | Confident | 78.7 | Confident | 96 Ų | 96 | 63.3 Ų | 63.3 | 47% | 0.473 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -69.2 | -38.8 | 174.7 | -79.2 | -65.5 | 161.1 | 0 | 0 | 111.8 | L125 L126 F127 | L125-M129 HydrophobicContact CD2-CG 4.2Å; L125-M129 WeakPolarHBondContact O-CG 3.17Å; L125-M129 PolarHBondContact O-N 3.19Å; L126-M129 PolarHBondContact O-N 2.86Å; F127-M129 VanDerWaalsContact C-N 3.32Å; F127-M129 PolarHBondContact O-N 2.62Å |
| 130 | I | 80.4 | Confident | 79.3 | Confident | 67 Ų | 67 | 66.5 Ų | 66.5 | 34% | 0.344 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -72.9 | -30.2 | 176.9 | -88.1 | 137.5 | 0 | 0 | 0 | 112.8 | L126 F127 I132 I181 A184 Y243 | L126-I130 HydrophobicContact CD2-CD1 3.43Å; L126-I130 VanDerWaalsContact CD2-CD1 3.43Å; L126-I130 HydrophobicContact CG-CD1 4.35Å; L126-I130 PolarHBondContact O-N 2.74Å; L126-I130 VanDerWaalsContact O-N 3.1Å; F127-I130 PolarHBondContact O-N 2.77Å; I130-I132 VanDerWaalsContact C-N 3.29Å; I130-I132 PolarHBondContact O-N 2.77Å; I130-I132 VanDerWaalsContact O-N 3.16Å; I130-I181 HydrophobicContact CD1-CG2 4.37Å; I130-A184 HydrophobicContact CG2-CB 3.62Å; I130-Y243 HydrophobicContact CG2-CE2 3.95Å |
| 131 | S | 76.6 | Confident | 79.6 | Confident | 6 Ų | 6 | 73 Ų | 73 | 4% | 0.042 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -56 | -39.2 | -168.3 | -160.2 | 0 | 0 | 0 | 0 | 113.5 | F127 Y243 | F127-S131 WeakPolarHBondContact O-CB 3.38Å; F127-S131 PolarHBondContact O-N 2.69Å; S131-Y243 WeakPolarHBondContact OG-CA 3.48Å |
| 132 | I | 61.1 | Low | 79.9 | Confident | 65 Ų | 65 | 70.6 Ų | 70.6 | 33% | 0.333 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -161.6 | 61.8 | 177.7 | -51.1 | -177.4 | 0 | 0 | 0 | 109.4 | I130 G134 V138 | I130-I132 VanDerWaalsContact C-N 3.29Å; I130-I132 PolarHBondContact O-N 2.77Å; I130-I132 VanDerWaalsContact O-N 3.16Å; I132-G134 PolarHBondContact O-N 3.43Å; I132-V138 HydrophobicContact CD1-CG1 3.98Å; I132-V138 HydrophobicContact CD1-CG2 4.07Å; I132-V138 HydrophobicContact CG1-CG1 4.39Å |
| 133 | Y | 58.3 | Low | 80.2 | Confident | 223 Ų | 223 | 71.3 Ų | 71.3 | 88% | 0.875 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 34.5 | 41.7 | 172.1 | -83.2 | -86.9 | 0 | 0 | 0 | 117 | ||
| 134 | G | 59.3 | Low | 80.6 | Confident | 34 Ų | 34 | 74.1 Ų | 74.1 | 35% | 0.351 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 85.4 | 30 | 162.7 | 0 | 0 | 0 | 0 | 0 | 120.6 | I132 F136 | I132-G134 PolarHBondContact O-N 3.43Å; G134-F136 PolarHBondContact O-N 2.79Å |
| 135 | Q | 68.8 | Low | 80.8 | Confident | 129 Ų | 129 | 75.2 Ų | 75.2 | 60% | 0.603 | 36% | 0.363 | S | S | * | . | trans | -73.5 | 114.3 | 163.9 | -81.5 | -173.7 | -4 | 0 | 0 | 111.2 | R137 V138 V139 | Q135-R137 PolarHBondContact O-N 3.27Å; Q135-V138 HydrophobicContact CB-CG2 4.12Å; Q135-V138 PolarHBondContact O-N 3Å; Q135-V139 PolarHBondContact O-N 3.35Å | ||
| 136 | F | 74.3 | Confident | 81 | Confident | 177 Ų | 177 | 71.7 Ų | 71.7 | 78% | 0.776 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -51.6 | -29.5 | 179 | -69.1 | -69.5 | 0 | 0 | 0 | 114.2 | G134 S140 | G134-F136 PolarHBondContact O-N 2.79Å; F136-S140 PolarHBondContact O-N 3.25Å; F136-S140 VanDerWaalsContact O-N 3.14Å |
| 137 | R | 80.3 | Confident | 81.3 | Confident | 193 Ų | 193 | 70.6 Ų | 70.6 | 73% | 0.728 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -62.2 | -43.5 | 176.5 | -177.4 | -179.9 | -79.9 | -111.2 | 1 | 112 | Q135 W141 | Q135-R137 PolarHBondContact O-N 3.27Å; R137-W141 VanDerWaalsContact O-CD1 3.24Å; R137-W141 PolarHBondContact O-N 2.85Å |
| 138 | V | 84.1 | Confident | 81.6 | Confident | 23 Ų | 23 | 77 Ų | 77 | 14% | 0.139 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -73.1 | -38 | -177.3 | -176.5 | 0 | 0 | 0 | 0 | 110.2 | I132 Q135 S140 W141 I142 | I132-V138 HydrophobicContact CD1-CG1 3.98Å; I132-V138 HydrophobicContact CD1-CG2 4.07Å; I132-V138 HydrophobicContact CG1-CG1 4.39Å; Q135-V138 HydrophobicContact CB-CG2 4.12Å; Q135-V138 PolarHBondContact O-N 3Å; V138-S140 VanDerWaalsContact C-N 3.34Å; V138-S140 PolarHBondContact O-N 3.47Å; V138-W141 WeakPolarHBondContact O-CB 3.01Å; V138-W141 PolarHBondContact O-N 3.46Å; V138-W141 VanDerWaalsContact O-N 3.15Å; V138-I142 HydrophobicContact CG1-CD1 4.06Å; V138-I142 WeakPolarHBondContact O-CG1 3.36Å; V138-I142 PolarHBondContact O-N 3.36Å |
| 139 | V | 85.4 | Confident | 81.9 | Confident | 22 Ų | 22 | 77.3 Ų | 77.3 | 13% | 0.133 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -57.9 | -47.3 | 175.9 | 178.2 | 0 | 0 | 0 | 0 | 111.4 | S128 Q135 W141 I142 I143 | S128-V139 WeakPolarHBondContact OG-CA 3.37Å; S128-V139 WeakPolarHBondContact OG-CB 3.16Å; S128-V139 WeakPolarHBondContact OG-CG1 3.42Å; S128-V139 VanDerWaalsContact OG-CG2 3.32Å; S128-V139 WeakPolarHBondContact OG-CG2 3.19Å; Q135-V139 PolarHBondContact O-N 3.35Å; V139-W141 VanDerWaalsContact C-N 3.3Å; V139-W141 PolarHBondContact O-N 2.79Å; V139-I142 PolarHBondContact O-N 3.46Å; V139-I143 HydrophobicContact CG1-CD1 4.15Å; V139-I143 WeakPolarHBondContact O-CG1 3.3Å; V139-I143 PolarHBondContact O-N 2.59Å; V139-I143 VanDerWaalsContact O-N 3.1Å |
| 140 | S | 87.6 | Confident | 82.3 | Confident | 72 Ų | 72 | 72.7 Ų | 72.7 | 50% | 0.503 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -59.7 | -40.3 | 177 | -174.8 | 0 | 0 | 0 | 0 | 112.4 | F136 V138 T144 | F136-S140 PolarHBondContact O-N 3.25Å; F136-S140 VanDerWaalsContact O-N 3.14Å; V138-S140 VanDerWaalsContact C-N 3.34Å; V138-S140 PolarHBondContact O-N 3.47Å; S140-T144 WeakPolarHBondContact O-CB 3.3Å; S140-T144 PolarHBondContact O-N 3.01Å; S140-T144 PolarHBondContact O-OG1 2.88Å |
| 141 | W | 88.9 | Confident | 82.9 | Confident | 138 Ų | 138 | 72.6 Ų | 72.6 | 52% | 0.523 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -64.4 | -45.5 | 176.1 | -86 | 108.5 | 0 | 0 | 0 | 112.8 | R137 V138 V139 I143 T144 I145 | R137-W141 VanDerWaalsContact O-CD1 3.24Å; R137-W141 PolarHBondContact O-N 2.85Å; V138-W141 WeakPolarHBondContact O-CB 3.01Å; V138-W141 PolarHBondContact O-N 3.46Å; V138-W141 VanDerWaalsContact O-N 3.15Å; V139-W141 VanDerWaalsContact C-N 3.3Å; V139-W141 PolarHBondContact O-N 2.79Å; W141-I143 VanDerWaalsContact C-N 3.35Å; W141-I143 PolarHBondContact O-N 3.19Å; W141-T144 PolarHBondContact O-N 2.85Å; W141-I145 HydrophobicContact CE3-CD1 4.04Å; W141-I145 WeakPolarHBondContact O-CB 3.49Å; W141-I145 WeakPolarHBondContact O-CD1 3.14Å; W141-I145 WeakPolarHBondContact O-CG1 3.43Å; W141-I145 PolarHBondContact O-N 3.05Å |
| 142 | I | 90.1 | Very high | 83.6 | Confident | 0 Ų | 0 | 75.5 Ų | 75.5 | 0% | 0 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -58.7 | -47.3 | 178.6 | -69 | 166.7 | 0 | 0 | 0 | 110.5 | V124 F127 V138 V139 I145 W146 F239 L242 | V124-I142 HydrophobicContact CG1-CG2 4.08Å; F127-I142 HydrophobicContact CD1-CG2 4.2Å; F127-I142 HydrophobicContact CE1-CD1 4.44Å; F127-I142 HydrophobicContact CE1-CG2 4.48Å; V138-I142 HydrophobicContact CG1-CD1 4.06Å; V138-I142 WeakPolarHBondContact O-CG1 3.36Å; V138-I142 PolarHBondContact O-N 3.36Å; V139-I142 PolarHBondContact O-N 3.46Å; I142-I145 PolarHBondContact O-N 3.03Å; I142-W146 VanDerWaalsContact O-CB 3.29Å; I142-W146 WeakPolarHBondContact O-CB 3.48Å; I142-W146 PolarHBondContact O-N 2.97Å; I142-F239 HydrophobicContact CG2-CD1 4.44Å; I142-F239 HydrophobicContact CG2-CE1 4.13Å; I142-L242 HydrophobicContact CG1-CD1 3.84Å |
| 143 | I | 89.6 | Confident | 85 | Confident | 68 Ų | 68 | 72.6 Ų | 72.6 | 35% | 0.349 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -64.9 | -45 | 178.7 | -66.2 | 176.5 | 0 | 0 | 0 | 110.8 | V139 W141 I145 W146 I147 | V139-I143 HydrophobicContact CG1-CD1 4.15Å; V139-I143 WeakPolarHBondContact O-CG1 3.3Å; V139-I143 PolarHBondContact O-N 2.59Å; V139-I143 VanDerWaalsContact O-N 3.1Å; W141-I143 VanDerWaalsContact C-N 3.35Å; W141-I143 PolarHBondContact O-N 3.19Å; I143-I145 VanDerWaalsContact C-N 3.33Å; I143-I145 PolarHBondContact O-N 2.61Å; I143-W146 WeakPolarHBondContact O-CB 3.4Å; I143-W146 PolarHBondContact O-N 2.98Å; I143-I147 HydrophobicContact CG2-CG1 4.44Å; I143-I147 WeakPolarHBondContact O-CG1 3.48Å; I143-I147 PolarHBondContact O-N 3.41Å |
| 144 | T | 91.7 | Very high | 86.5 | Confident | 72 Ų | 72 | 64 Ų | 64 | 44% | 0.442 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -59.6 | -45.5 | 180 | -60.1 | 0 | 0 | 0 | 0 | 111.3 | S140 W141 W146 I147 F148 | S140-T144 WeakPolarHBondContact O-CB 3.3Å; S140-T144 PolarHBondContact O-N 3.01Å; S140-T144 PolarHBondContact O-OG1 2.88Å; W141-T144 PolarHBondContact O-N 2.85Å; T144-W146 VanDerWaalsContact C-N 3.34Å; T144-I147 PolarHBondContact O-N 2.98Å; T144-F148 VanDerWaalsContact O-CB 3.25Å; T144-F148 WeakPolarHBondContact O-CB 3.49Å; T144-F148 PolarHBondContact O-N 2.98Å |
| 145 | I | 91.6 | Very high | 88 | Confident | 24 Ų | 24 | 67 Ų | 67 | 12% | 0.123 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -69.2 | -34.7 | 178 | -73.6 | 156.4 | 0 | 0 | 0 | 111.5 | W141 I142 I143 G149 L235 Y238 F239 L242 | W141-I145 HydrophobicContact CE3-CD1 4.04Å; W141-I145 WeakPolarHBondContact O-CB 3.49Å; W141-I145 WeakPolarHBondContact O-CD1 3.14Å; W141-I145 WeakPolarHBondContact O-CG1 3.43Å; W141-I145 PolarHBondContact O-N 3.05Å; I142-I145 PolarHBondContact O-N 3.03Å; I143-I145 VanDerWaalsContact C-N 3.33Å; I143-I145 PolarHBondContact O-N 2.61Å; I145-G149 WeakPolarHBondContact O-CA 3.17Å; I145-G149 PolarHBondContact O-N 2.91Å; I145-L235 HydrophobicContact CG2-CD1 3.81Å; I145-Y238 HydrophobicContact CD1-CD1 3.66Å; I145-Y238 HydrophobicContact CD1-CE1 3.07Å; I145-Y238 HydrophobicContact CG1-CE1 4.26Å; I145-Y238 HydrophobicContact CG2-CD1 4.23Å; I145-F239 HydrophobicContact CG2-CE1 4.26Å; I145-F239 HydrophobicContact CG2-CZ 4.3Å; I145-L242 HydrophobicContact CD1-CD1 3.8Å |
| 146 | W | 91.9 | Very high | 88.9 | Confident | 6 Ų | 6 | 63.3 Ų | 63.3 | 2% | 0.023 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63.1 | -47.9 | 174.7 | 174.7 | 59.7 | 0 | 0 | 0 | 111.9 | F117 P120 L121 V124 I142 I143 T144 S150 L170 F239 | F117-W146 HydrophobicContact CE2-CH2 4.45Å; P120-W146 HydrophobicContact CB-CZ2 3.96Å; L121-W146 HydrophobicContact CB-CH2 4.24Å; V124-W146 HydrophobicContact CB-CD2 4.44Å; V124-W146 HydrophobicContact CG1-CB 4.37Å; V124-W146 HydrophobicContact CG1-CD2 4.18Å; V124-W146 HydrophobicContact CG1-CE3 4.25Å; V124-W146 HydrophobicContact CG1-CG 4.24Å; V124-W146 HydrophobicContact CG2-CD2 3.77Å; V124-W146 HydrophobicContact CG2-CE3 4.35Å; V124-W146 HydrophobicContact CG2-CG 3.97Å; V124-W146 HydrophobicContact CG2-CZ2 4.09Å; I142-W146 VanDerWaalsContact O-CB 3.29Å; I142-W146 WeakPolarHBondContact O-CB 3.48Å; I142-W146 PolarHBondContact O-N 2.97Å; I143-W146 WeakPolarHBondContact O-CB 3.4Å; I143-W146 PolarHBondContact O-N 2.98Å; T144-W146 VanDerWaalsContact C-N 3.34Å; W146-S150 WeakPolarHBondContact O-CB 3.1Å; W146-S150 PolarHBondContact O-N 3.11Å; W146-S150 PolarHBondContact O-OG 3.46Å; W146-L170 HydrophobicContact CD2-CD1 3.87Å; W146-L170 VanDerWaalsContact CE2-CD1 3.43Å; W146-L170 HydrophobicContact CE3-CD1 4.23Å; W146-L170 HydrophobicContact CH2-CD1 3.88Å; W146-L170 HydrophobicContact CH2-CD2 4.07Å; W146-L170 HydrophobicContact CH2-CG 3.9Å; W146-L170 HydrophobicContact CZ2-CD1 3.46Å; W146-L170 VanDerWaalsContact CZ2-CD1 3.46Å; W146-L170 HydrophobicContact CZ2-CD2 4.18Å; W146-L170 HydrophobicContact CZ2-CG 3.5Å; W146-L170 HydrophobicContact CZ3-CD1 4.24Å; W146-L170 PolarHBondContact NE1-O 2.85Å; W146-F239 HydrophobicContact CB-CE1 4.41Å; W146-F239 HydrophobicContact CB-CZ 4Å |
| 147 | I | 91.9 | Very high | 89.5 | Confident | 63 Ų | 63 | 55.1 Ų | 55.1 | 32% | 0.323 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -64.8 | -52.4 | 175.8 | -63.5 | -58.3 | 0 | 0 | 0 | 111.2 | I143 T144 S150 L151 Y166 L170 | I143-I147 HydrophobicContact CG2-CG1 4.44Å; I143-I147 WeakPolarHBondContact O-CG1 3.48Å; I143-I147 PolarHBondContact O-N 3.41Å; T144-I147 PolarHBondContact O-N 2.98Å; I147-S150 PolarHBondContact O-OG 2.94Å; I147-L151 WeakPolarHBondContact O-CB 3.41Å; I147-L151 PolarHBondContact O-N 3.15Å; I147-Y166 PolarHBondContact O-OH 3.37Å; I147-L170 HydrophobicContact CD1-CD1 3.8Å; I147-L170 HydrophobicContact CD1-CD2 4.32Å |
| 148 | F | 93.6 | Very high | 89.8 | Confident | 136 Ų | 136 | 53.1 Ų | 53.1 | 60% | 0.596 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -72.6 | -35.8 | -174.5 | -168.3 | -97.1 | 0 | 0 | 0 | 112.8 | T144 L151 T152 | T144-F148 VanDerWaalsContact O-CB 3.25Å; T144-F148 WeakPolarHBondContact O-CB 3.49Å; T144-F148 PolarHBondContact O-N 2.98Å; F148-L151 PolarHBondContact O-N 3.42Å; F148-T152 WeakPolarHBondContact O-CB 3.37Å; F148-T152 PolarHBondContact O-N 2.87Å; F148-T152 PolarHBondContact O-OG1 2.98Å |
| 149 | G | 92.2 | Very high | 89.9 | Confident | 9 Ų | 9 | 57.9 Ų | 57.9 | 9% | 0.093 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -67.4 | -44.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | I145 L151 T152 I153 | I145-G149 WeakPolarHBondContact O-CA 3.17Å; I145-G149 PolarHBondContact O-N 2.91Å; G149-L151 VanDerWaalsContact C-N 3.32Å; G149-L151 PolarHBondContact O-N 3.17Å; G149-T152 PolarHBondContact O-N 3.42Å; G149-I153 VanDerWaalsContact O-CG1 3.3Å; G149-I153 WeakPolarHBondContact O-CG1 3.47Å; G149-I153 PolarHBondContact O-N 3.47Å |
| 150 | S | 90.3 | Very high | 89.7 | Confident | 0 Ų | 0 | 58.9 Ų | 58.9 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -64.8 | -36.3 | 172.8 | 61.9 | 0 | 0 | 0 | 0 | 112 | W146 I147 I153 F154 Y166 V169 L170 | W146-S150 WeakPolarHBondContact O-CB 3.1Å; W146-S150 PolarHBondContact O-N 3.11Å; W146-S150 PolarHBondContact O-OG 3.46Å; I147-S150 PolarHBondContact O-OG 2.94Å; S150-I153 PolarHBondContact O-N 3.18Å; S150-F154 VanDerWaalsContact O-CB 3.25Å; S150-F154 WeakPolarHBondContact O-CB 3.47Å; S150-F154 PolarHBondContact O-N 2.85Å; S150-Y166 PolarHBondContact OG-OH 3.06Å; S150-V169 WeakPolarHBondContact O-CG1 3.5Å; S150-L170 WeakPolarHBondContact OG-CD1 3.29Å |
| 151 | L | 92.4 | Very high | 89.2 | Confident | 64 Ų | 64 | 57.9 Ų | 57.9 | 34% | 0.335 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.3 | -44.4 | 173.4 | 180 | 65.6 | 0 | 0 | 0 | 111.5 | I147 F148 G149 I153 F154 L155 Y166 | I147-L151 WeakPolarHBondContact O-CB 3.41Å; I147-L151 PolarHBondContact O-N 3.15Å; F148-L151 PolarHBondContact O-N 3.42Å; G149-L151 VanDerWaalsContact C-N 3.32Å; G149-L151 PolarHBondContact O-N 3.17Å; L151-I153 PolarHBondContact O-N 3.37Å; L151-F154 HydrophobicContact CD1-CD1 4.25Å; L151-F154 WeakPolarHBondContact O-CB 3.4Å; L151-F154 PolarHBondContact O-N 3.18Å; L151-L155 HydrophobicContact CD1-CG 4.48Å; L151-L155 HydrophobicContact CG-CD1 4.44Å; L151-L155 WeakPolarHBondContact O-CG 3.28Å; L151-L155 PolarHBondContact O-N 3.35Å; L151-Y166 HydrophobicContact CB-CE2 3.99Å; L151-Y166 HydrophobicContact CD1-CD2 4.44Å; L151-Y166 HydrophobicContact CD1-CE2 4.22Å |
| 152 | T | 92.3 | Very high | 88.5 | Confident | 68 Ų | 68 | 51.3 Ų | 51.3 | 42% | 0.417 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60.9 | -45.5 | 176.9 | -57.8 | 0 | 0 | 0 | 0 | 111.1 | F148 G149 F154 L155 L156 | F148-T152 WeakPolarHBondContact O-CB 3.37Å; F148-T152 PolarHBondContact O-N 2.87Å; F148-T152 PolarHBondContact O-OG1 2.98Å; G149-T152 PolarHBondContact O-N 3.42Å; T152-F154 VanDerWaalsContact C-N 3.34Å; T152-L155 PolarHBondContact O-N 3.17Å; T152-L156 WeakPolarHBondContact O-CB 3.49Å; T152-L156 PolarHBondContact O-N 3.38Å |
| 153 | I | 89.8 | Confident | 87.9 | Confident | 4 Ų | 4 | 59.4 Ų | 59.4 | 2% | 0.021 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -65.4 | -39.3 | 177.5 | -66.3 | 164 | 0 | 0 | 0 | 110.8 | G149 S150 L151 L156 A157 V169 I173 L216 L228 I232 L235 | G149-I153 VanDerWaalsContact O-CG1 3.3Å; G149-I153 WeakPolarHBondContact O-CG1 3.47Å; G149-I153 PolarHBondContact O-N 3.47Å; S150-I153 PolarHBondContact O-N 3.18Å; L151-I153 PolarHBondContact O-N 3.37Å; I153-L156 PolarHBondContact O-N 3.34Å; I153-A157 WeakPolarHBondContact O-CB 3.42Å; I153-A157 PolarHBondContact O-N 3.01Å; I153-V169 HydrophobicContact CB-CG1 4.14Å; I153-V169 HydrophobicContact CG2-CG1 3.88Å; I153-I173 HydrophobicContact CD1-CD1 3.76Å; I153-I173 HydrophobicContact CD1-CG1 4.3Å; I153-L216 HydrophobicContact CG2-CD1 4.03Å; I153-L228 HydrophobicContact CG2-CD2 3.87Å; I153-I232 HydrophobicContact CD1-CG1 4.04Å; I153-I232 HydrophobicContact CG1-CG1 4.43Å; I153-I232 HydrophobicContact CG2-CG1 4.19Å; I153-L235 HydrophobicContact CD1-CD2 3.77Å |
| 154 | F | 90.1 | Very high | 87.3 | Confident | 42 Ų | 42 | 57.4 Ų | 57.4 | 18% | 0.184 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -62.9 | -47.6 | 176 | 166.1 | -100.5 | 0 | 0 | 0 | 112 | S150 L151 T152 L156 A157 R158 V164 Y166 V169 | S150-F154 VanDerWaalsContact O-CB 3.25Å; S150-F154 WeakPolarHBondContact O-CB 3.47Å; S150-F154 PolarHBondContact O-N 2.85Å; L151-F154 HydrophobicContact CD1-CD1 4.25Å; L151-F154 WeakPolarHBondContact O-CB 3.4Å; L151-F154 PolarHBondContact O-N 3.18Å; T152-F154 VanDerWaalsContact C-N 3.34Å; F154-L156 VanDerWaalsContact C-N 3.28Å; F154-L156 PolarHBondContact O-N 2.87Å; F154-A157 PolarHBondContact O-N 3.39Å; F154-R158 WeakPolarHBondContact O-CB 3.47Å; F154-R158 PolarHBondContact O-N 2.85Å; F154-V164 VanDerWaalsContact CE2-O 3.28Å; F154-V164 WeakPolarHBondContact CE2-O 3.22Å; F154-Y166 HydrophobicContact CB-CD2 3.9Å; F154-Y166 HydrophobicContact CD1-CD2 4.17Å; F154-Y166 HydrophobicContact CD2-CD2 4.43Å; F154-Y166 AromaticContact CG-CD2 3.91Å; F154-Y166 HydrophobicContact CG-CD2 3.91Å; F154-V169 HydrophobicContact CB-CB 4.29Å; F154-V169 HydrophobicContact CB-CG1 4.29Å; F154-V169 HydrophobicContact CB-CG2 4.16Å; F154-V169 HydrophobicContact CD2-CG2 4.2Å |
| 155 | L | 90.6 | Very high | 86.9 | Confident | 96 Ų | 96 | 57 Ų | 57 | 50% | 0.503 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -60.1 | -41.9 | 175.8 | -70.6 | 177.7 | 0 | 0 | 0 | 110.9 | L151 T152 R158 V159 | L151-L155 HydrophobicContact CD1-CG 4.48Å; L151-L155 HydrophobicContact CG-CD1 4.44Å; L151-L155 WeakPolarHBondContact O-CG 3.28Å; L151-L155 PolarHBondContact O-N 3.35Å; T152-L155 PolarHBondContact O-N 3.17Å; L155-R158 PolarHBondContact O-N 3.39Å; L155-V159 VanDerWaalsContact O-CG2 3.27Å; L155-V159 WeakPolarHBondContact O-CG2 3.39Å; L155-V159 PolarHBondContact O-N 2.7Å |
| 156 | L | 89.3 | Confident | 86.6 | Confident | 52 Ų | 52 | 59.1 Ų | 59.1 | 27% | 0.272 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -64.7 | -44.1 | 177 | -167.9 | 66.4 | 0 | 0 | 0 | 111.7 | T152 I153 F154 R158 V159 L160 P231 | T152-L156 WeakPolarHBondContact O-CB 3.49Å; T152-L156 PolarHBondContact O-N 3.38Å; I153-L156 PolarHBondContact O-N 3.34Å; F154-L156 VanDerWaalsContact C-N 3.28Å; F154-L156 PolarHBondContact O-N 2.87Å; L156-R158 VanDerWaalsContact C-N 3.29Å; L156-R158 PolarHBondContact O-N 3.3Å; L156-V159 PolarHBondContact O-N 3.24Å; L156-L160 HydrophobicContact CD1-CD1 4.07Å; L156-L160 HydrophobicContact CG-CD1 4.24Å; L156-L160 WeakPolarHBondContact O-CB 3.49Å; L156-L160 VanDerWaalsContact O-CD1 3.28Å; L156-L160 WeakPolarHBondContact O-CD1 3.32Å; L156-L160 PolarHBondContact O-N 3.33Å; L156-P231 HydrophobicContact CD2-CG 3.46Å; L156-P231 VanDerWaalsContact CD2-CG 3.46Å |
| 157 | A | 85.3 | Confident | 86.1 | Confident | 6 Ų | 6 | 60.1 Ų | 60.1 | 5% | 0.05 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -58.7 | -42.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | I153 F154 L160 G161 G162 V164 L228 | I153-A157 WeakPolarHBondContact O-CB 3.42Å; I153-A157 PolarHBondContact O-N 3.01Å; F154-A157 PolarHBondContact O-N 3.39Å; A157-L160 PolarHBondContact O-N 3.46Å; A157-G161 PolarHBondContact O-N 3.22Å; A157-G162 WeakPolarHBondContact O-CA 3.36Å; A157-G162 PolarHBondContact O-N 3.35Å; A157-V164 HydrophobicContact CB-CG2 3.7Å; A157-L228 HydrophobicContact CB-CD1 3.85Å |
| 158 | R | 86.3 | Confident | 85.4 | Confident | 151 Ų | 151 | 58.8 Ų | 58.8 | 57% | 0.57 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -66.8 | -42.4 | 179.2 | -167.8 | 69.1 | 177.3 | 98.9 | -3.3 | 112.4 | F154 L155 L156 L160 G161 | F154-R158 WeakPolarHBondContact O-CB 3.47Å; F154-R158 PolarHBondContact O-N 2.85Å; L155-R158 PolarHBondContact O-N 3.39Å; L156-R158 VanDerWaalsContact C-N 3.29Å; L156-R158 PolarHBondContact O-N 3.3Å; R158-L160 VanDerWaalsContact C-N 3.26Å; R158-L160 PolarHBondContact O-N 2.83Å; R158-G161 PolarHBondContact O-N 2.94Å |
| 159 | V | 86.9 | Confident | 85 | Confident | 122 Ų | 122 | 52.3 Ų | 52.3 | 74% | 0.739 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -63.9 | -33.8 | 175.5 | 169.5 | 0 | 0 | 0 | 0 | 111.3 | L155 L156 G161 | L155-V159 VanDerWaalsContact O-CG2 3.27Å; L155-V159 WeakPolarHBondContact O-CG2 3.39Å; L155-V159 PolarHBondContact O-N 2.7Å; L156-V159 PolarHBondContact O-N 3.24Å; V159-G161 PolarHBondContact O-N 2.99Å |
| 160 | L | 82.4 | Confident | 84.8 | Confident | 44 Ų | 44 | 52.3 Ų | 52.3 | 23% | 0.23 | 29% | 0.286 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74 | -3.8 | 174.3 | -92.4 | 60.2 | 0 | 0 | 0 | 113.5 | L156 A157 R158 F221 L227 L228 | L156-L160 HydrophobicContact CD1-CD1 4.07Å; L156-L160 HydrophobicContact CG-CD1 4.24Å; L156-L160 WeakPolarHBondContact O-CB 3.49Å; L156-L160 VanDerWaalsContact O-CD1 3.28Å; L156-L160 WeakPolarHBondContact O-CD1 3.32Å; L156-L160 PolarHBondContact O-N 3.33Å; A157-L160 PolarHBondContact O-N 3.46Å; R158-L160 VanDerWaalsContact C-N 3.26Å; R158-L160 PolarHBondContact O-N 2.83Å; L160-F221 HydrophobicContact CB-CE1 4.43Å; L160-F221 WeakPolarHBondContact O-CE1 3.05Å; L160-L227 HydrophobicContact CD1-CD2 4.35Å; L160-L227 HydrophobicContact CD2-CB 4.24Å; L160-L228 HydrophobicContact CD2-CB 4.3Å; L160-L228 HydrophobicContact CD2-CD1 4.34Å |
| 161 | G | 75.4 | Confident | 84.4 | Confident | 51 Ų | 51 | 52.7 Ų | 52.7 | 53% | 0.526 | 29% | 0.29 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 90.8 | 19.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | A157 R158 V159 | A157-G161 PolarHBondContact O-N 3.22Å; R158-G161 PolarHBondContact O-N 2.94Å; V159-G161 PolarHBondContact O-N 2.99Å |
| 162 | G | 75.5 | Confident | 83.9 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 28% | 0.278 | C | S | . | . | trans | -79.4 | 134.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | A157 V164 F221 | A157-G162 WeakPolarHBondContact O-CA 3.36Å; A157-G162 PolarHBondContact O-N 3.35Å; G162-V164 VanDerWaalsContact C-N 3.26Å; G162-V164 PolarHBondContact O-N 2.87Å; G162-F221 VanDerWaalsContact CA-CZ 3.45Å | ||
| 163 | E | 77.2 | Confident | 83.7 | Confident | 170 Ų | 170 | 47 Ų | 47 | 79% | 0.794 | 26% | 0.258 | S | S | * | . | trans | -91.2 | 58.9 | 171.2 | -61.3 | -172.4 | 141.3 | 0 | 0 | 109.6 | ||||
| 164 | V | 75.9 | Confident | 83.6 | Confident | 26 Ų | 26 | 46.9 Ų | 46.9 | 16% | 0.158 | 26% | 0.257 | C | S | . | . | trans | -108.7 | 139.3 | 174.7 | -65.8 | 0 | 0 | 0 | 0 | 109.6 | F154 A157 G162 V169 | F154-V164 VanDerWaalsContact CE2-O 3.28Å; F154-V164 WeakPolarHBondContact CE2-O 3.22Å; A157-V164 HydrophobicContact CB-CG2 3.7Å; G162-V164 VanDerWaalsContact C-N 3.26Å; G162-V164 PolarHBondContact O-N 2.87Å; V164-V169 HydrophobicContact CB-CG2 4.36Å; V164-V169 HydrophobicContact CG2-CG2 3.94Å | ||
| 165 | S | 83.6 | Confident | 83.2 | Confident | 64 Ų | 64 | 45.1 Ų | 45.1 | 45% | 0.448 | 25% | 0.249 | S | C | . | . | trans | -81.2 | 151.1 | 173.5 | 176.6 | 0 | 0 | 0 | 0 | 110.8 | G167 Q168 V169 | S165-G167 VanDerWaalsContact C-N 3.3Å; S165-G167 PolarHBondContact O-N 3.29Å; S165-Q168 WeakPolarHBondContact O-CB 3.4Å; S165-Q168 PolarHBondContact O-N 2.69Å; S165-Q168 VanDerWaalsContact O-N 3.14Å; S165-V169 PolarHBondContact O-N 3.35Å | ||
| 166 | Y | 84.9 | Confident | 82.9 | Confident | 68 Ų | 68 | 40.6 Ų | 40.6 | 27% | 0.267 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -59.9 | -40.3 | 177.9 | 176.1 | -116.8 | 0 | 0 | 0 | 112.2 | I147 S150 L151 F154 Q168 V169 L170 | I147-Y166 PolarHBondContact O-OH 3.37Å; S150-Y166 PolarHBondContact OG-OH 3.06Å; L151-Y166 HydrophobicContact CB-CE2 3.99Å; L151-Y166 HydrophobicContact CD1-CD2 4.44Å; L151-Y166 HydrophobicContact CD1-CE2 4.22Å; F154-Y166 HydrophobicContact CB-CD2 3.9Å; F154-Y166 HydrophobicContact CD1-CD2 4.17Å; F154-Y166 HydrophobicContact CD2-CD2 4.43Å; F154-Y166 AromaticContact CG-CD2 3.91Å; F154-Y166 HydrophobicContact CG-CD2 3.91Å; Y166-Q168 PolarHBondContact O-N 2.97Å; Y166-V169 PolarHBondContact O-N 3.25Å; Y166-L170 HydrophobicContact CE1-CD2 4.3Å; Y166-L170 VanDerWaalsContact O-CB 3.3Å; Y166-L170 WeakPolarHBondContact O-CB 3.42Å; Y166-L170 PolarHBondContact O-N 2.94Å |
| 167 | G | 81.9 | Confident | 82.8 | Confident | 27 Ų | 27 | 38.1 Ų | 38.1 | 28% | 0.278 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -60.9 | -33.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | S165 G171 | S165-G167 VanDerWaalsContact C-N 3.3Å; S165-G167 PolarHBondContact O-N 3.29Å; G167-G171 PolarHBondContact O-N 2.91Å |
| 168 | Q | 78.6 | Confident | 82.6 | Confident | 34 Ų | 34 | 38.8 Ų | 38.8 | 16% | 0.159 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -68.9 | -44.6 | 176.2 | -61.8 | 166.2 | -10.6 | 0 | 0 | 111 | R112 S165 Y166 G171 V172 | R112-Q168 HydrophobicContact CG-CB 4.45Å; R112-Q168 HydrophobicContact CG-CG 3.8Å; R112-Q168 VanDerWaalsContact O-CG 3.27Å; R112-Q168 WeakPolarHBondContact O-CG 3.37Å; R112-Q168 PolarHBondContact O-NE2 2.82Å; S165-Q168 WeakPolarHBondContact O-CB 3.4Å; S165-Q168 PolarHBondContact O-N 2.69Å; S165-Q168 VanDerWaalsContact O-N 3.14Å; Y166-Q168 PolarHBondContact O-N 2.97Å; Q168-G171 PolarHBondContact O-N 2.94Å; Q168-V172 WeakPolarHBondContact O-CB 3.32Å; Q168-V172 WeakPolarHBondContact O-CG2 3.15Å; Q168-V172 PolarHBondContact O-N 3.29Å |
| 169 | V | 84.7 | Confident | 82.5 | Confident | 1 Ų | 1 | 31.7 Ų | 31.7 | 1% | 0.006 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.6 | -48.1 | 177 | -179.3 | 0 | 0 | 0 | 0 | 110.4 | S150 I153 F154 V164 S165 Y166 G171 V172 I173 L216 | S150-V169 WeakPolarHBondContact O-CG1 3.5Å; I153-V169 HydrophobicContact CB-CG1 4.14Å; I153-V169 HydrophobicContact CG2-CG1 3.88Å; F154-V169 HydrophobicContact CB-CB 4.29Å; F154-V169 HydrophobicContact CB-CG1 4.29Å; F154-V169 HydrophobicContact CB-CG2 4.16Å; F154-V169 HydrophobicContact CD2-CG2 4.2Å; V164-V169 HydrophobicContact CB-CG2 4.36Å; V164-V169 HydrophobicContact CG2-CG2 3.94Å; S165-V169 PolarHBondContact O-N 3.35Å; Y166-V169 PolarHBondContact O-N 3.25Å; V169-G171 VanDerWaalsContact C-N 3.34Å; V169-G171 PolarHBondContact O-N 3.44Å; V169-V172 PolarHBondContact O-N 3.22Å; V169-I173 HydrophobicContact CG1-CG1 4.29Å; V169-I173 WeakPolarHBondContact O-CB 3.46Å; V169-I173 WeakPolarHBondContact O-CG1 3.19Å; V169-I173 PolarHBondContact O-N 3.39Å; V169-L216 HydrophobicContact CB-CD2 4.46Å; V169-L216 HydrophobicContact CG1-CD1 4.26Å; V169-L216 HydrophobicContact CG2-CD2 4.17Å |
| 170 | L | 87.3 | Confident | 82.4 | Confident | 9 Ų | 9 | 26.6 Ų | 26.6 | 5% | 0.047 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -58.7 | -45.9 | 178.7 | -176.2 | 69.9 | 0 | 0 | 0 | 111.8 | F117 W146 I147 S150 Y166 G174 | F117-L170 HydrophobicContact CD2-CD2 4Å; F117-L170 HydrophobicContact CE2-CD2 3.78Å; W146-L170 HydrophobicContact CD2-CD1 3.87Å; W146-L170 VanDerWaalsContact CE2-CD1 3.43Å; W146-L170 HydrophobicContact CE3-CD1 4.23Å; W146-L170 HydrophobicContact CH2-CD1 3.88Å; W146-L170 HydrophobicContact CH2-CD2 4.07Å; W146-L170 HydrophobicContact CH2-CG 3.9Å; W146-L170 HydrophobicContact CZ2-CD1 3.46Å; W146-L170 VanDerWaalsContact CZ2-CD1 3.46Å; W146-L170 HydrophobicContact CZ2-CD2 4.18Å; W146-L170 HydrophobicContact CZ2-CG 3.5Å; W146-L170 HydrophobicContact CZ3-CD1 4.24Å; W146-L170 PolarHBondContact NE1-O 2.85Å; I147-L170 HydrophobicContact CD1-CD1 3.8Å; I147-L170 HydrophobicContact CD1-CD2 4.32Å; S150-L170 WeakPolarHBondContact OG-CD1 3.29Å; Y166-L170 HydrophobicContact CE1-CD2 4.3Å; Y166-L170 VanDerWaalsContact O-CB 3.3Å; Y166-L170 WeakPolarHBondContact O-CB 3.42Å; Y166-L170 PolarHBondContact O-N 2.94Å; L170-G174 PolarHBondContact O-N 3.35Å |
| 171 | G | 83.1 | Confident | 82.5 | Confident | 8 Ų | 8 | 25.6 Ų | 25.6 | 8% | 0.082 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -66 | -49.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | P120 G167 Q168 V169 I173 G174 Y175 | P120-G171 VanDerWaalsContact CG-CA 3.42Å; G167-G171 PolarHBondContact O-N 2.91Å; Q168-G171 PolarHBondContact O-N 2.94Å; V169-G171 VanDerWaalsContact C-N 3.34Å; V169-G171 PolarHBondContact O-N 3.44Å; G171-I173 VanDerWaalsContact C-N 3.31Å; G171-I173 PolarHBondContact O-N 3.07Å; G171-G174 PolarHBondContact O-N 3.31Å; G171-Y175 WeakPolarHBondContact O-CB 3.32Å; G171-Y175 WeakPolarHBondContact O-CD2 2.86Å; G171-Y175 PolarHBondContact O-N 3.21Å |
| 172 | V | 81.7 | Confident | 82.8 | Confident | 13 Ų | 13 | 26.9 Ų | 26.9 | 8% | 0.079 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -60 | -42.7 | 178.6 | 171.6 | 0 | 0 | 0 | 0 | 111.4 | V111 Q168 V169 S176 L215 L216 | V111-V172 HydrophobicContact CG1-CG2 4.38Å; Q168-V172 WeakPolarHBondContact O-CB 3.32Å; Q168-V172 WeakPolarHBondContact O-CG2 3.15Å; Q168-V172 PolarHBondContact O-N 3.29Å; V169-V172 PolarHBondContact O-N 3.22Å; V172-S176 WeakPolarHBondContact O-CB 3.38Å; V172-S176 PolarHBondContact O-N 3.47Å; V172-S176 VanDerWaalsContact O-N 3.17Å; V172-S176 PolarHBondContact O-OG 3.27Å; V172-L215 HydrophobicContact CG1-CB 3.55Å; V172-L215 HydrophobicContact CG1-CD1 3.99Å; V172-L215 HydrophobicContact CG1-CG 4.42Å; V172-L215 HydrophobicContact CG2-CB 4.35Å; V172-L216 HydrophobicContact CB-CD2 3.86Å; V172-L216 HydrophobicContact CB-CG 4.2Å; V172-L216 HydrophobicContact CG1-CD1 4.4Å; V172-L216 HydrophobicContact CG1-CD2 3.92Å; V172-L216 HydrophobicContact CG1-CG 3.71Å; V172-L216 HydrophobicContact CG2-CD2 4.1Å |
| 173 | I | 88.4 | Confident | 83.2 | Confident | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64.6 | -41.6 | 177.9 | -66.2 | -66.5 | 0 | 0 | 0 | 111.1 | I153 V169 G171 S176 A212 L216 L235 Y236 | I153-I173 HydrophobicContact CD1-CD1 3.76Å; I153-I173 HydrophobicContact CD1-CG1 4.3Å; V169-I173 HydrophobicContact CG1-CG1 4.29Å; V169-I173 WeakPolarHBondContact O-CB 3.46Å; V169-I173 WeakPolarHBondContact O-CG1 3.19Å; V169-I173 PolarHBondContact O-N 3.39Å; G171-I173 VanDerWaalsContact C-N 3.31Å; G171-I173 PolarHBondContact O-N 3.07Å; I173-S176 PolarHBondContact O-OG 3.4Å; I173-S176 VanDerWaalsContact O-OG 3.05Å; I173-A212 HydrophobicContact CD1-CB 4.38Å; I173-L216 HydrophobicContact CD1-CD1 3.92Å; I173-L216 HydrophobicContact CG1-CD1 4.26Å; I173-L235 HydrophobicContact CD1-CD2 4.35Å; I173-L235 HydrophobicContact CG2-CD2 3.59Å; I173-Y236 WeakPolarHBondContact CA-OH 3.45Å; I173-Y236 HydrophobicContact CD1-CE2 4.33Å; I173-Y236 PolarHBondContact O-OH 3.23Å |
| 174 | G | 87 | Confident | 83.4 | Confident | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -69.1 | -46.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | V123 L170 G171 S176 L177 | V123-G174 VanDerWaalsContact CG1-O 3.32Å; V123-G174 WeakPolarHBondContact CG1-O 3.34Å; L170-G174 PolarHBondContact O-N 3.35Å; G171-G174 PolarHBondContact O-N 3.31Å; G174-S176 VanDerWaalsContact C-N 3.3Å; G174-S176 PolarHBondContact O-N 3.03Å; G174-L177 WeakPolarHBondContact O-CB 3.38Å; G174-L177 PolarHBondContact O-N 2.81Å |
| 175 | Y | 81.6 | Confident | 83.6 | Confident | 6 Ų | 6 | 22.7 Ų | 22.7 | 2% | 0.024 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -64 | -34.9 | 180 | -76 | -60.2 | 0 | 0 | 0 | 112.9 | I94 V97 P120 V123 G171 L177 L178 | I94-Y175 HydrophobicContact CG1-CD1 4.4Å; V97-Y175 WeakPolarHBondContact CG1-O 3.4Å; P120-Y175 HydrophobicContact CB-CD2 4.42Å; P120-Y175 HydrophobicContact CB-CE2 4.4Å; P120-Y175 VanDerWaalsContact CD-CZ 3.4Å; P120-Y175 WeakPolarHBondContact CD-OH 3.23Å; P120-Y175 HydrophobicContact CG-CD2 3.84Å; P120-Y175 HydrophobicContact CG-CE1 4.26Å; P120-Y175 HydrophobicContact CG-CE2 3.42Å; P120-Y175 VanDerWaalsContact CG-CE2 3.42Å; P120-Y175 HydrophobicContact CG-CG 4.41Å; V123-Y175 HydrophobicContact CG2-CD1 4.31Å; G171-Y175 WeakPolarHBondContact O-CB 3.32Å; G171-Y175 WeakPolarHBondContact O-CD2 2.86Å; G171-Y175 PolarHBondContact O-N 3.21Å; Y175-L177 PolarHBondContact O-N 2.91Å; Y175-L178 WeakPolarHBondContact O-CB 3.26Å; Y175-L178 PolarHBondContact O-N 3.18Å; Y175-L178 VanDerWaalsContact O-N 3.1Å |
| 176 | S | 84.6 | Confident | 83.5 | Confident | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 13% | 0.134 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.4 | 2.1 | 179.2 | 49.9 | 0 | 0 | 0 | 0 | 114.1 | V97 V172 I173 G174 L178 P179 A208 A212 Y236 | V97-S176 VanDerWaalsContact CG1-CA 3.49Å; V172-S176 WeakPolarHBondContact O-CB 3.38Å; V172-S176 PolarHBondContact O-N 3.47Å; V172-S176 VanDerWaalsContact O-N 3.17Å; V172-S176 PolarHBondContact O-OG 3.27Å; I173-S176 PolarHBondContact O-OG 3.4Å; I173-S176 VanDerWaalsContact O-OG 3.05Å; G174-S176 VanDerWaalsContact C-N 3.3Å; G174-S176 PolarHBondContact O-N 3.03Å; S176-L178 VanDerWaalsContact C-N 3.26Å; S176-P179 VanDerWaalsContact O-CD 3.27Å; S176-P179 WeakPolarHBondContact O-CD 3Å; S176-A208 WeakPolarHBondContact O-CB 3.28Å; S176-A212 WeakPolarHBondContact OG-CB 3.37Å; S176-Y236 PolarHBondContact OG-OH 2.83Å |
| 177 | L | 85.6 | Confident | 83.2 | Confident | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 12% | 0.124 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.4 | -14.8 | 163.7 | -66.8 | 170.5 | 0 | 0 | 0 | 112.9 | V123 V124 G174 Y175 P179 L180 I181 Y236 F239 | V123-L177 HydrophobicContact CG1-CB 4.27Å; V124-L177 HydrophobicContact CB-CD1 4.36Å; V124-L177 HydrophobicContact CG2-CD1 3.59Å; G174-L177 WeakPolarHBondContact O-CB 3.38Å; G174-L177 PolarHBondContact O-N 2.81Å; Y175-L177 PolarHBondContact O-N 2.91Å; L177-P179 VanDerWaalsContact C-CD 3.49Å; L177-L180 WeakPolarHBondContact O-CA 3.45Å; L177-L180 WeakPolarHBondContact O-CB 2.84Å; L177-L180 PolarHBondContact O-N 3.15Å; L177-I181 PolarHBondContact O-N 3.39Å; L177-I181 VanDerWaalsContact O-N 3.15Å; L177-Y236 HydrophobicContact CD2-CD1 4.1Å; L177-Y236 HydrophobicContact CD2-CE1 3.84Å; L177-Y236 HydrophobicContact CG-CE1 4.39Å; L177-F239 HydrophobicContact CD2-CB 4.29Å; L177-F239 HydrophobicContact CD2-CD2 3.71Å; L177-F239 HydrophobicContact CD2-CE2 4.09Å; L177-F239 HydrophobicContact CD2-CG 3.94Å |
| 178 | L | 82.7 | Confident | 83.2 | Confident | 20 Ų | 20 | 25.9 Ų | 25.9 | 11% | 0.105 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -59.4 | -39.8 | -176.2 | -162.9 | 144.7 | 0 | 0 | 0 | 114.8 | I94 L98 V123 Y175 S176 L180 I181 V182 | I94-L178 HydrophobicContact CB-CD1 3.8Å; I94-L178 HydrophobicContact CD1-CD1 3.77Å; I94-L178 HydrophobicContact CG1-CD1 3.46Å; I94-L178 VanDerWaalsContact CG1-CD1 3.46Å; I94-L178 HydrophobicContact CG2-CD1 3.24Å; I94-L178 HydrophobicContact CG2-CD2 3.92Å; I94-L178 HydrophobicContact CG2-CG 4.22Å; L98-L178 HydrophobicContact CD1-CD2 3.94Å; V123-L178 HydrophobicContact CG1-CB 4.34Å; V123-L178 HydrophobicContact CG2-CD1 4.39Å; Y175-L178 WeakPolarHBondContact O-CB 3.26Å; Y175-L178 PolarHBondContact O-N 3.18Å; Y175-L178 VanDerWaalsContact O-N 3.1Å; S176-L178 VanDerWaalsContact C-N 3.26Å; L178-L180 PolarHBondContact O-N 3.02Å; L178-I181 WeakPolarHBondContact O-CB 3.18Å; L178-I181 PolarHBondContact O-N 2.85Å; L178-I181 VanDerWaalsContact O-N 3.08Å; L178-V182 HydrophobicContact CD2-CG2 3.8Å; L178-V182 WeakPolarHBondContact O-CG2 3.32Å; L178-V182 PolarHBondContact O-N 3.26Å |
| 179 | P | 82.6 | Confident | 83.3 | Confident | 3 Ų | 3 | 30.2 Ų | 30.2 | 2% | 0.019 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -55.8 | -37.1 | 171.2 | -24.1 | 34.6 | 0 | 0 | 0 | 112.9 | L98 S176 L177 V182 I183 A208 | L98-P179 HydrophobicContact CD1-CB 4.45Å; L98-P179 HydrophobicContact CD1-CG 4.29Å; S176-P179 VanDerWaalsContact O-CD 3.27Å; S176-P179 WeakPolarHBondContact O-CD 3Å; L177-P179 VanDerWaalsContact C-CD 3.49Å; P179-V182 PolarHBondContact O-N 3.41Å; P179-I183 WeakPolarHBondContact O-CB 3.42Å; P179-I183 WeakPolarHBondContact O-CD1 3.28Å; P179-I183 WeakPolarHBondContact O-CG1 3.5Å; P179-I183 PolarHBondContact O-N 3.41Å; P179-A208 HydrophobicContact CB-CB 4.41Å; P179-A208 HydrophobicContact CG-CB 4.41Å |
| 180 | L | 84.8 | Confident | 82.9 | Confident | 15 Ų | 15 | 32.7 Ų | 32.7 | 8% | 0.079 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -67.2 | -40.8 | 175.8 | -81.3 | 69.3 | 0 | 0 | 0 | 111.1 | F127 L177 L178 V182 I183 A184 V205 A208 | F127-L180 HydrophobicContact CD2-CB 4.32Å; F127-L180 HydrophobicContact CE2-CB 4.01Å; F127-L180 HydrophobicContact CE2-CD2 3.98Å; F127-L180 HydrophobicContact CZ-CD2 4.24Å; L177-L180 WeakPolarHBondContact O-CA 3.45Å; L177-L180 WeakPolarHBondContact O-CB 2.84Å; L177-L180 PolarHBondContact O-N 3.15Å; L178-L180 PolarHBondContact O-N 3.02Å; L180-V182 VanDerWaalsContact C-N 3.33Å; L180-V182 PolarHBondContact O-N 3.22Å; L180-I183 PolarHBondContact O-N 2.98Å; L180-A184 PolarHBondContact O-N 3.49Å; L180-V205 HydrophobicContact CD2-CG2 4.49Å; L180-A208 HydrophobicContact CD1-CB 3.14Å |
| 181 | I | 84.6 | Confident | 81.8 | Confident | 23 Ų | 23 | 34.5 Ų | 34.5 | 12% | 0.118 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -61.3 | -42.5 | 176.3 | -64.1 | 173.7 | 0 | 0 | 0 | 111.1 | V123 L126 F127 I130 L177 L178 I183 A184 P185 | V123-I181 HydrophobicContact CG1-CD1 3.64Å; V123-I181 VanDerWaalsContact O-CD1 3.3Å; V123-I181 WeakPolarHBondContact O-CD1 3.47Å; L126-I181 HydrophobicContact CD2-CB 4.48Å; L126-I181 HydrophobicContact CD2-CD1 3.93Å; L126-I181 HydrophobicContact CD2-CG1 4.33Å; L126-I181 HydrophobicContact CD2-CG2 3.36Å; F127-I181 HydrophobicContact CB-CD1 3.87Å; F127-I181 HydrophobicContact CB-CG1 3.77Å; F127-I181 HydrophobicContact CD2-CG1 4.05Å; F127-I181 HydrophobicContact CG-CG1 4.41Å; I130-I181 HydrophobicContact CD1-CG2 4.37Å; L177-I181 PolarHBondContact O-N 3.39Å; L177-I181 VanDerWaalsContact O-N 3.15Å; L178-I181 WeakPolarHBondContact O-CB 3.18Å; L178-I181 PolarHBondContact O-N 2.85Å; L178-I181 VanDerWaalsContact O-N 3.08Å; I181-I183 VanDerWaalsContact C-N 3.33Å; I181-A184 PolarHBondContact O-N 2.78Å; I181-P185 WeakPolarHBondContact O-CD 3.15Å |
| 182 | V | 83 | Confident | 81.2 | Confident | 77 Ų | 77 | 37.5 Ų | 37.5 | 47% | 0.467 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -67.9 | -36.1 | 178.8 | 172.9 | 0 | 0 | 0 | 0 | 111.3 | L98 L178 P179 L180 P185 | L98-V182 HydrophobicContact CD1-CG2 4.26Å; L178-V182 HydrophobicContact CD2-CG2 3.8Å; L178-V182 WeakPolarHBondContact O-CG2 3.32Å; L178-V182 PolarHBondContact O-N 3.26Å; P179-V182 PolarHBondContact O-N 3.41Å; L180-V182 VanDerWaalsContact C-N 3.33Å; L180-V182 PolarHBondContact O-N 3.22Å; V182-P185 VanDerWaalsContact O-CD 3.32Å; V182-P185 WeakPolarHBondContact O-CD 3.44Å; V182-P185 WeakPolarHBondContact O-CG 3.44Å |
| 183 | I | 83.1 | Confident | 81.3 | Confident | 25 Ų | 25 | 43.8 Ų | 43.8 | 13% | 0.128 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -73.4 | -33 | 179.3 | -72.7 | 168.6 | 0 | 0 | 0 | 111 | P179 L180 I181 L186 L187 I200 | P179-I183 WeakPolarHBondContact O-CB 3.42Å; P179-I183 WeakPolarHBondContact O-CD1 3.28Å; P179-I183 WeakPolarHBondContact O-CG1 3.5Å; P179-I183 PolarHBondContact O-N 3.41Å; L180-I183 PolarHBondContact O-N 2.98Å; I181-I183 VanDerWaalsContact C-N 3.33Å; I183-L186 WeakPolarHBondContact O-CA 3.16Å; I183-L186 VanDerWaalsContact O-CB 3.27Å; I183-L186 WeakPolarHBondContact O-CB 3.46Å; I183-L186 PolarHBondContact O-N 3.19Å; I183-L187 HydrophobicContact CB-CD1 4.37Å; I183-L187 HydrophobicContact CG2-CD1 3.16Å; I183-L187 WeakPolarHBondContact O-CD1 3.42Å; I183-L187 PolarHBondContact O-N 3.47Å; I183-I200 HydrophobicContact CG2-CG1 4.29Å; I183-I200 HydrophobicContact CG2-CG2 4.44Å |
| 184 | A | 81.8 | Confident | 81 | Confident | 9 Ų | 9 | 50.2 Ų | 50.2 | 7% | 0.074 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -52.7 | -50.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | I130 L180 I181 L186 L187 L188 Y243 | I130-A184 HydrophobicContact CG2-CB 3.62Å; L180-A184 PolarHBondContact O-N 3.49Å; I181-A184 PolarHBondContact O-N 2.78Å; A184-L186 VanDerWaalsContact C-N 3.29Å; A184-L186 PolarHBondContact O-N 2.73Å; A184-L187 WeakPolarHBondContact O-CB 3.17Å; A184-L187 PolarHBondContact O-N 3.48Å; A184-L188 PolarHBondContact O-N 3.43Å; A184-Y243 HydrophobicContact CB-CE2 4.21Å |
| 185 | P | 80.5 | Confident | 80.9 | Confident | 74 Ų | 74 | 55.4 Ų | 55.4 | 48% | 0.481 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -68.9 | -28.1 | 174.8 | 28 | -35 | 0 | 0 | 0 | 112.3 | I181 V182 L187 L188 V189 | I181-P185 WeakPolarHBondContact O-CD 3.15Å; V182-P185 VanDerWaalsContact O-CD 3.32Å; V182-P185 WeakPolarHBondContact O-CD 3.44Å; V182-P185 WeakPolarHBondContact O-CG 3.44Å; P185-L187 VanDerWaalsContact C-N 3.35Å; P185-L188 WeakPolarHBondContact O-CB 3.37Å; P185-L188 PolarHBondContact O-N 2.95Å; P185-V189 PolarHBondContact O-N 3.01Å |
| 186 | L | 80.4 | Confident | 81.1 | Confident | 77 Ų | 77 | 58.1 Ų | 58.1 | 40% | 0.403 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -65.5 | -39 | 174.9 | -175.5 | 65.7 | 0 | 0 | 0 | 111.3 | I183 A184 L188 V189 I190 I200 | I183-L186 WeakPolarHBondContact O-CA 3.16Å; I183-L186 VanDerWaalsContact O-CB 3.27Å; I183-L186 WeakPolarHBondContact O-CB 3.46Å; I183-L186 PolarHBondContact O-N 3.19Å; A184-L186 VanDerWaalsContact C-N 3.29Å; A184-L186 PolarHBondContact O-N 2.73Å; L186-L188 VanDerWaalsContact C-N 3.31Å; L186-L188 PolarHBondContact O-N 3.4Å; L186-V189 PolarHBondContact O-N 2.93Å; L186-I190 HydrophobicContact CD1-CD1 3.75Å; L186-I190 HydrophobicContact CD2-CD1 4.41Å; L186-I190 HydrophobicContact CG-CD1 3.7Å; L186-I190 WeakPolarHBondContact O-CG1 3.32Å; L186-I190 PolarHBondContact O-N 3Å; L186-I190 VanDerWaalsContact O-N 3.12Å; L186-I200 HydrophobicContact CD2-CD1 4.35Å; L186-I200 HydrophobicContact CD2-CG1 4.36Å |
| 187 | L | 80.3 | Confident | 81 | Confident | 12 Ų | 12 | 59 Ų | 59 | 6% | 0.063 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -60.6 | -40 | 171.9 | -87.5 | 74.2 | 0 | 0 | 0 | 112.4 | I183 A184 P185 V189 I190 G191 I200 K201 Y243 | I183-L187 HydrophobicContact CB-CD1 4.37Å; I183-L187 HydrophobicContact CG2-CD1 3.16Å; I183-L187 WeakPolarHBondContact O-CD1 3.42Å; I183-L187 PolarHBondContact O-N 3.47Å; A184-L187 WeakPolarHBondContact O-CB 3.17Å; A184-L187 PolarHBondContact O-N 3.48Å; P185-L187 VanDerWaalsContact C-N 3.35Å; L187-V189 PolarHBondContact O-N 2.88Å; L187-I190 PolarHBondContact O-N 3.31Å; L187-G191 WeakPolarHBondContact O-CA 3.22Å; L187-G191 PolarHBondContact O-N 2.91Å; L187-I200 HydrophobicContact CD1-CG2 3.43Å; L187-I200 VanDerWaalsContact CD1-CG2 3.43Å; L187-I200 HydrophobicContact CG-CG2 3.81Å; L187-K201 HydrophobicContact CD2-CD 4.01Å; L187-K201 HydrophobicContact CD2-CG 3.64Å; L187-K201 HydrophobicContact CG-CG 4.48Å; L187-Y243 HydrophobicContact CD2-CE1 4.14Å |
| 188 | L | 80.3 | Confident | 81 | Confident | 138 Ų | 138 | 62.4 Ų | 62.4 | 72% | 0.723 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -58.8 | -39.8 | 179.4 | -171.1 | 83.5 | 0 | 0 | 0 | 110.8 | A184 P185 L186 | A184-L188 PolarHBondContact O-N 3.43Å; P185-L188 WeakPolarHBondContact O-CB 3.37Å; P185-L188 PolarHBondContact O-N 2.95Å; L186-L188 VanDerWaalsContact C-N 3.31Å; L186-L188 PolarHBondContact O-N 3.4Å |
| 189 | V | 81.5 | Confident | 81.3 | Confident | 124 Ų | 124 | 66.7 Ų | 66.7 | 75% | 0.752 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -73.1 | -35.3 | 179.1 | 178 | 0 | 0 | 0 | 0 | 112 | P185 L186 L187 | P185-V189 PolarHBondContact O-N 3.01Å; L186-V189 PolarHBondContact O-N 2.93Å; L187-V189 PolarHBondContact O-N 2.88Å |
| 190 | I | 76.3 | Confident | 81.4 | Confident | 53 Ų | 53 | 68.8 Ų | 68.8 | 27% | 0.272 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -93 | -1.4 | -174.3 | -61.6 | 168.5 | 0 | 0 | 0 | 112.5 | L186 L187 G192 F193 V196 | L186-I190 HydrophobicContact CD1-CD1 3.75Å; L186-I190 HydrophobicContact CD2-CD1 4.41Å; L186-I190 HydrophobicContact CG-CD1 3.7Å; L186-I190 WeakPolarHBondContact O-CG1 3.32Å; L186-I190 PolarHBondContact O-N 3Å; L186-I190 VanDerWaalsContact O-N 3.12Å; L187-I190 PolarHBondContact O-N 3.31Å; I190-G192 PolarHBondContact O-N 3.49Å; I190-F193 PolarHBondContact O-N 2.98Å; I190-V196 HydrophobicContact CG2-CB 4.45Å; I190-V196 HydrophobicContact CG2-CG1 3.79Å |
| 191 | G | 64 | Low | 81.5 | Confident | 47 Ų | 47 | 70.4 Ų | 70.4 | 49% | 0.485 | 41% | 0.414 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.2 | 1.3 | -166.9 | 0 | 0 | 0 | 0 | 0 | 118.2 | L187 F193 | L187-G191 WeakPolarHBondContact O-CA 3.22Å; L187-G191 PolarHBondContact O-N 2.91Å; G191-F193 VanDerWaalsContact C-N 3.34Å |
| 192 | G | 70.6 | Confident | 81.6 | Confident | 71 Ų | 71 | 74 Ų | 74 | 73% | 0.732 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.1 | -13.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | I190 | I190-G192 PolarHBondContact O-N 3.49Š|
| 193 | F | 82.8 | Confident | 81.9 | Confident | 145 Ų | 145 | 76 Ų | 76 | 64% | 0.636 | 44% | 0.436 | S | S | * | . | trans | -128.6 | 106.7 | -178 | -59.8 | -79.6 | 0 | 0 | 0 | 112.6 | I190 G191 V195 V196 S197 | I190-F193 PolarHBondContact O-N 2.98Å; G191-F193 VanDerWaalsContact C-N 3.34Å; F193-V195 PolarHBondContact O-N 3.1Å; F193-V196 HydrophobicContact CB-CB 3.91Å; F193-V196 HydrophobicContact CB-CG2 3.77Å; F193-V196 HydrophobicContact CG-CG2 4.44Å; F193-V196 PolarHBondContact O-N 2.99Å; F193-S197 WeakPolarHBondContact O-CB 3.33Å; F193-S197 PolarHBondContact O-N 3.43Å | ||
| 194 | D | 82.1 | Confident | 82 | Confident | 136 Ų | 136 | 74.9 Ų | 74.9 | 73% | 0.727 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -59.5 | -40.5 | -176.5 | -67.7 | -40.1 | 0 | 0 | 0 | 113.8 | T198 | D194-T198 WeakPolarHBondContact O-CB 3.27Å; D194-T198 PolarHBondContact O-N 3.14Å; D194-T198 PolarHBondContact O-OG1 3.02Å |
| 195 | V | 85.9 | Confident | 82.3 | Confident | 108 Ų | 108 | 74.7 Ų | 74.7 | 66% | 0.655 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -65.9 | -43.8 | 179.2 | 179.6 | 0 | 0 | 0 | 0 | 110.9 | F193 T198 L199 | F193-V195 PolarHBondContact O-N 3.1Å; V195-T198 PolarHBondContact O-N 3.29Å; V195-L199 HydrophobicContact CG1-CD1 4.46Å; V195-L199 WeakPolarHBondContact O-CG 3.23Å; V195-L199 PolarHBondContact O-N 3.38Å |
| 196 | V | 85.6 | Confident | 82.7 | Confident | 64 Ų | 64 | 77.3 Ų | 77.3 | 39% | 0.388 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -67.9 | -42.3 | 179.8 | -178.8 | 0 | 0 | 0 | 0 | 110.5 | I190 F193 T198 L199 I200 | I190-V196 HydrophobicContact CG2-CB 4.45Å; I190-V196 HydrophobicContact CG2-CG1 3.79Å; F193-V196 HydrophobicContact CB-CB 3.91Å; F193-V196 HydrophobicContact CB-CG2 3.77Å; F193-V196 HydrophobicContact CG-CG2 4.44Å; F193-V196 PolarHBondContact O-N 2.99Å; V196-T198 VanDerWaalsContact C-N 3.27Å; V196-T198 PolarHBondContact O-N 3.15Å; V196-L199 PolarHBondContact O-N 3.19Å; V196-I200 PolarHBondContact O-N 3.34Å |
| 197 | S | 83.8 | Confident | 82.9 | Confident | 17 Ų | 17 | 77.7 Ų | 77.7 | 12% | 0.119 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -60 | -37.2 | 173.7 | -175.2 | 0 | 0 | 0 | 0 | 111.9 | F193 I200 K201 | F193-S197 WeakPolarHBondContact O-CB 3.33Å; F193-S197 PolarHBondContact O-N 3.43Å; S197-I200 VanDerWaalsContact O-CG2 3.31Å; S197-I200 WeakPolarHBondContact O-CG2 3.37Å; S197-K201 WeakPolarHBondContact O-CD 3.29Å; S197-K201 WeakPolarHBondContact O-CG 3.48Å; S197-K201 PolarHBondContact O-N 2.68Å |
| 198 | T | 84.5 | Confident | 83.2 | Confident | 73 Ų | 73 | 77.1 Ų | 77.1 | 45% | 0.448 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -70.9 | -42.1 | 176.4 | -56.7 | 0 | 0 | 0 | 0 | 112 | D194 V195 V196 K201 L202 | D194-T198 WeakPolarHBondContact O-CB 3.27Å; D194-T198 PolarHBondContact O-N 3.14Å; D194-T198 PolarHBondContact O-OG1 3.02Å; V195-T198 PolarHBondContact O-N 3.29Å; V196-T198 VanDerWaalsContact C-N 3.27Å; V196-T198 PolarHBondContact O-N 3.15Å; T198-K201 WeakPolarHBondContact O-CB 3.39Å; T198-K201 PolarHBondContact O-N 3.08Å; T198-L202 HydrophobicContact CG2-CD1 4.41Å; T198-L202 WeakPolarHBondContact O-CG 3.44Å; T198-L202 PolarHBondContact O-N 3.34Å |
| 199 | L | 88.3 | Confident | 83.5 | Confident | 110 Ų | 110 | 70.8 Ų | 70.8 | 58% | 0.576 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -63.6 | -42.8 | 177.4 | -72.3 | 177.4 | 0 | 0 | 0 | 112.4 | V195 V196 K201 L202 F203 | V195-L199 HydrophobicContact CG1-CD1 4.46Å; V195-L199 WeakPolarHBondContact O-CG 3.23Å; V195-L199 PolarHBondContact O-N 3.38Å; V196-L199 PolarHBondContact O-N 3.19Å; L199-K201 VanDerWaalsContact C-N 3.33Å; L199-K201 PolarHBondContact O-N 3.01Å; L199-L202 PolarHBondContact O-N 3.25Å; L199-F203 WeakPolarHBondContact O-CB 3.2Å; L199-F203 PolarHBondContact O-N 3.42Å |
| 200 | I | 86.2 | Confident | 83.6 | Confident | 46 Ų | 46 | 70.8 Ų | 70.8 | 24% | 0.236 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -67 | -35.6 | 179.4 | -154.2 | 90.8 | 0 | 0 | 0 | 111.2 | I183 L186 L187 V196 S197 G204 | I183-I200 HydrophobicContact CG2-CG1 4.29Å; I183-I200 HydrophobicContact CG2-CG2 4.44Å; L186-I200 HydrophobicContact CD2-CD1 4.35Å; L186-I200 HydrophobicContact CD2-CG1 4.36Å; L187-I200 HydrophobicContact CD1-CG2 3.43Å; L187-I200 VanDerWaalsContact CD1-CG2 3.43Å; L187-I200 HydrophobicContact CG-CG2 3.81Å; V196-I200 PolarHBondContact O-N 3.34Å; S197-I200 VanDerWaalsContact O-CG2 3.31Å; S197-I200 WeakPolarHBondContact O-CG2 3.37Å; I200-G204 PolarHBondContact O-N 3.23Å |
| 201 | K | 86.2 | Confident | 83.9 | Confident | 50 Ų | 50 | 68.3 Ų | 68.3 | 22% | 0.217 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -60.8 | -50.9 | 172.3 | -75 | 169.3 | -169.8 | 179.2 | 0 | 111.6 | L187 S197 T198 L199 F203 G204 V205 L240 T244 | L187-K201 HydrophobicContact CD2-CD 4.01Å; L187-K201 HydrophobicContact CD2-CG 3.64Å; L187-K201 HydrophobicContact CG-CG 4.48Å; S197-K201 WeakPolarHBondContact O-CD 3.29Å; S197-K201 WeakPolarHBondContact O-CG 3.48Å; S197-K201 PolarHBondContact O-N 2.68Å; T198-K201 WeakPolarHBondContact O-CB 3.39Å; T198-K201 PolarHBondContact O-N 3.08Å; L199-K201 VanDerWaalsContact C-N 3.33Å; L199-K201 PolarHBondContact O-N 3.01Å; K201-F203 VanDerWaalsContact C-N 3.33Å; K201-F203 PolarHBondContact O-N 2.96Å; K201-G204 PolarHBondContact O-N 2.91Å; K201-V205 PolarHBondContact O-N 3.22Å; K201-L240 HydrophobicContact CB-CD1 4.01Å; K201-L240 HydrophobicContact CB-CD2 4.34Å; K201-L240 HydrophobicContact CD-CD1 4.37Å; K201-L240 HydrophobicContact CG-CD1 4.15Å; K201-T244 HydrophobicContact CD-CG2 4.36Å |
| 202 | L | 87.7 | Confident | 84.8 | Confident | 99 Ų | 99 | 66 Ų | 66 | 52% | 0.518 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -61.8 | -42.9 | 179.8 | -71.3 | 176 | 0 | 0 | 0 | 111.5 | T198 L199 G204 V205 F206 | T198-L202 HydrophobicContact CG2-CD1 4.41Å; T198-L202 WeakPolarHBondContact O-CG 3.44Å; T198-L202 PolarHBondContact O-N 3.34Å; L199-L202 PolarHBondContact O-N 3.25Å; L202-G204 VanDerWaalsContact C-N 3.32Å; L202-G204 PolarHBondContact O-N 3.26Å; L202-V205 PolarHBondContact O-N 3.36Å; L202-F206 WeakPolarHBondContact O-CB 3.22Å; L202-F206 PolarHBondContact O-N 2.82Å |
| 203 | F | 88.4 | Confident | 85.3 | Confident | 119 Ų | 119 | 63.1 Ų | 63.1 | 52% | 0.522 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -60.9 | -43.3 | 175 | -175.2 | -99.2 | 0 | 0 | 0 | 111.4 | L199 K201 F206 W207 | L199-F203 WeakPolarHBondContact O-CB 3.2Å; L199-F203 PolarHBondContact O-N 3.42Å; K201-F203 VanDerWaalsContact C-N 3.33Å; K201-F203 PolarHBondContact O-N 2.96Å; F203-F206 PolarHBondContact O-N 2.96Å; F203-W207 HydrophobicContact CE1-CE3 4.1Å; F203-W207 AromaticContact CZ-CE3 3.83Å; F203-W207 HydrophobicContact CZ-CE3 3.83Å; F203-W207 HydrophobicContact CZ-CZ3 4.17Å; F203-W207 VanDerWaalsContact O-CB 3.3Å; F203-W207 WeakPolarHBondContact O-CB 3.39Å; F203-W207 PolarHBondContact O-N 2.99Å |
| 204 | G | 85.4 | Confident | 85 | Confident | 1 Ų | 1 | 57.5 Ų | 57.5 | 1% | 0.01 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -61.8 | -44.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | I200 K201 L202 W207 A208 | I200-G204 PolarHBondContact O-N 3.23Å; K201-G204 PolarHBondContact O-N 2.91Å; L202-G204 VanDerWaalsContact C-N 3.32Å; L202-G204 PolarHBondContact O-N 3.26Å; G204-W207 PolarHBondContact O-N 3.36Å; G204-A208 WeakPolarHBondContact O-CB 3.48Å; G204-A208 PolarHBondContact O-N 3.29Å |
| 205 | V | 88.1 | Confident | 84.5 | Confident | 4 Ų | 4 | 52.7 Ų | 52.7 | 2% | 0.024 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.8 | -45.6 | 174.7 | 168.8 | 0 | 0 | 0 | 0 | 111.1 | L180 K201 L202 W207 A208 A209 I237 L240 | L180-V205 HydrophobicContact CD2-CG2 4.49Å; K201-V205 PolarHBondContact O-N 3.22Å; L202-V205 PolarHBondContact O-N 3.36Å; V205-W207 VanDerWaalsContact C-N 3.29Å; V205-W207 PolarHBondContact O-N 3.48Å; V205-A208 PolarHBondContact O-N 3.48Å; V205-A209 WeakPolarHBondContact O-CB 3.48Å; V205-A209 PolarHBondContact O-N 3.29Å; V205-I237 HydrophobicContact CG1-CG1 4.25Å; V205-L240 HydrophobicContact CG2-CB 3.55Å; V205-L240 HydrophobicContact CG2-CD1 4.11Å; V205-L240 HydrophobicContact CG2-CD2 3.54Å; V205-L240 HydrophobicContact CG2-CG 3.9Å |
| 206 | F | 87.6 | Confident | 83.9 | Confident | 130 Ų | 130 | 48.8 Ų | 48.8 | 57% | 0.57 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -61.9 | -41.6 | 178.4 | -169.7 | -94.1 | 0 | 0 | 0 | 111.2 | L202 F203 Y210 F233 | L202-F206 WeakPolarHBondContact O-CB 3.22Å; L202-F206 PolarHBondContact O-N 2.82Å; F203-F206 PolarHBondContact O-N 2.96Å; F206-Y210 WeakPolarHBondContact O-CB 3.21Å; F206-Y210 PolarHBondContact O-N 3.26Å; F206-F233 HydrophobicContact CD2-CE2 4.24Å |
| 207 | W | 86.3 | Confident | 83.2 | Confident | 85 Ų | 85 | 46.4 Ų | 46.4 | 32% | 0.322 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -63 | -47.6 | 176.7 | -170.7 | -84.6 | 0 | 0 | 0 | 112.5 | L98 P100 F203 G204 V205 Y210 S211 | L98-W207 VanDerWaalsContact O-CZ2 3.29Å; L98-W207 WeakPolarHBondContact O-CZ2 3.14Å; L98-W207 PolarHBondContact O-NE1 2.94Å; P100-W207 HydrophobicContact CG-CZ2 4.1Å; F203-W207 HydrophobicContact CE1-CE3 4.1Å; F203-W207 AromaticContact CZ-CE3 3.83Å; F203-W207 HydrophobicContact CZ-CE3 3.83Å; F203-W207 HydrophobicContact CZ-CZ3 4.17Å; F203-W207 VanDerWaalsContact O-CB 3.3Å; F203-W207 WeakPolarHBondContact O-CB 3.39Å; F203-W207 PolarHBondContact O-N 2.99Å; G204-W207 PolarHBondContact O-N 3.36Å; V205-W207 VanDerWaalsContact C-N 3.29Å; V205-W207 PolarHBondContact O-N 3.48Å; W207-Y210 PolarHBondContact O-N 2.98Å; W207-S211 WeakPolarHBondContact O-CB 3.49Å; W207-S211 PolarHBondContact O-N 3.19Å |
| 208 | A | 86.2 | Confident | 82.3 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.2 | -47.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | S176 P179 L180 G204 V205 Y210 S211 A212 Y236 | S176-A208 WeakPolarHBondContact O-CB 3.28Å; P179-A208 HydrophobicContact CB-CB 4.41Å; P179-A208 HydrophobicContact CG-CB 4.41Å; L180-A208 HydrophobicContact CD1-CB 3.14Å; G204-A208 WeakPolarHBondContact O-CB 3.48Å; G204-A208 PolarHBondContact O-N 3.29Å; V205-A208 PolarHBondContact O-N 3.48Å; A208-Y210 VanDerWaalsContact C-N 3.33Å; A208-Y210 PolarHBondContact O-N 2.87Å; A208-S211 WeakPolarHBondContact O-CB 3.29Å; A208-S211 PolarHBondContact O-N 3.21Å; A208-A212 WeakPolarHBondContact O-CB 3.49Å; A208-A212 PolarHBondContact O-N 3.14Å; A208-Y236 HydrophobicContact CB-CD1 3.9Å; A208-Y236 HydrophobicContact CB-CE1 4.12Å |
| 209 | A | 86.5 | Confident | 80.8 | Confident | 5 Ų | 5 | 49.6 Ų | 49.6 | 4% | 0.041 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -63.6 | -40.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | V205 A213 F233 Y236 | V205-A209 WeakPolarHBondContact O-CB 3.48Å; V205-A209 PolarHBondContact O-N 3.29Å; A209-A213 WeakPolarHBondContact O-CB 3.3Å; A209-A213 PolarHBondContact O-N 3.39Å; A209-F233 HydrophobicContact CB-CD2 3.76Å; A209-Y236 HydrophobicContact CB-CD2 3.74Å; A209-Y236 HydrophobicContact CB-CG 4.12Å |
| 210 | Y | 83.5 | Confident | 79.2 | Confident | 123 Ų | 123 | 50 Ų | 50 | 48% | 0.482 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -63.5 | -43.1 | 174.3 | -179.5 | -99.8 | 0 | 0 | 0 | 111.3 | P100 F206 W207 A208 S214 | P100-Y210 HydrophobicContact CB-CD1 4.06Å; P100-Y210 HydrophobicContact CB-CE1 3.96Å; P100-Y210 HydrophobicContact CG-CD1 3.84Å; P100-Y210 HydrophobicContact CG-CE1 3.97Å; F206-Y210 WeakPolarHBondContact O-CB 3.21Å; F206-Y210 PolarHBondContact O-N 3.26Å; W207-Y210 PolarHBondContact O-N 2.98Å; A208-Y210 VanDerWaalsContact C-N 3.33Å; A208-Y210 PolarHBondContact O-N 2.87Å; Y210-S214 WeakPolarHBondContact O-CB 3.25Å; Y210-S214 PolarHBondContact O-N 3.43Å; Y210-S214 PolarHBondContact O-OG 2.86Å |
| 211 | S | 82.1 | Confident | 77.7 | Confident | 1 Ų | 1 | 49.3 Ų | 49.3 | 1% | 0.007 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60.7 | -51.9 | 176.4 | -171.2 | 0 | 0 | 0 | 0 | 111.1 | V97 W207 A208 A213 S214 L215 | V97-S211 PolarHBondContact O-OG 3.3Å; W207-S211 WeakPolarHBondContact O-CB 3.49Å; W207-S211 PolarHBondContact O-N 3.19Å; A208-S211 WeakPolarHBondContact O-CB 3.29Å; A208-S211 PolarHBondContact O-N 3.21Å; S211-A213 PolarHBondContact O-N 2.97Å; S211-S214 PolarHBondContact O-N 2.9Å; S211-S214 PolarHBondContact O-OG 3.2Å; S211-L215 VanDerWaalsContact O-CG 3.29Å; S211-L215 WeakPolarHBondContact O-CG 3.18Å; S211-L215 PolarHBondContact O-N 2.95Å |
| 212 | A | 83.2 | Confident | 76.2 | Confident | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -58.4 | -49.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | I173 S176 A208 S214 L215 L216 I232 Y236 | I173-A212 HydrophobicContact CD1-CB 4.38Å; S176-A212 WeakPolarHBondContact OG-CB 3.37Å; A208-A212 WeakPolarHBondContact O-CB 3.49Å; A208-A212 PolarHBondContact O-N 3.14Å; A212-S214 VanDerWaalsContact C-N 3.33Å; A212-S214 PolarHBondContact O-N 2.73Å; A212-L215 PolarHBondContact O-N 3.46Å; A212-L216 PolarHBondContact O-N 3.37Å; A212-I232 HydrophobicContact CB-CG2 3.91Å; A212-Y236 HydrophobicContact CB-CE2 3.53Å; A212-Y236 VanDerWaalsContact CB-OH 3.28Å; A212-Y236 WeakPolarHBondContact CB-OH 3.28Å |
| 213 | A | 81.6 | Confident | 74.7 | Confident | 10 Ų | 10 | 56.1 Ų | 56.1 | 8% | 0.083 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.6 | -44 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | A209 S211 L215 V217 I229 I232 | A209-A213 WeakPolarHBondContact O-CB 3.3Å; A209-A213 PolarHBondContact O-N 3.39Å; S211-A213 PolarHBondContact O-N 2.97Å; A213-L215 VanDerWaalsContact C-N 3.31Å; A213-L215 PolarHBondContact O-N 3.18Å; A213-V217 WeakPolarHBondContact O-CA 3.38Å; A213-V217 WeakPolarHBondContact O-CB 3.3Å; A213-V217 VanDerWaalsContact O-CG2 3.32Å; A213-V217 WeakPolarHBondContact O-CG2 3.1Å; A213-V217 PolarHBondContact O-N 2.92Å; A213-I229 HydrophobicContact CB-CG1 4.02Å; A213-I232 HydrophobicContact CB-CD1 4.42Å; A213-I232 HydrophobicContact CB-CG2 4.44Å |
| 214 | S | 75.2 | Confident | 73.4 | Confident | 27 Ų | 27 | 56.9 Ų | 56.9 | 19% | 0.189 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61.4 | -44.4 | 179.2 | 79.7 | 0 | 0 | 0 | 0 | 110.1 | R108 Y210 S211 A212 | R108-S214 PolarHBondContact NH1-O 3.03Å; R108-S214 PolarHBondContact NH2-O 2.73Å; Y210-S214 WeakPolarHBondContact O-CB 3.25Å; Y210-S214 PolarHBondContact O-N 3.43Å; Y210-S214 PolarHBondContact O-OG 2.86Å; S211-S214 PolarHBondContact O-N 2.9Å; S211-S214 PolarHBondContact O-OG 3.2Å; A212-S214 VanDerWaalsContact C-N 3.33Å; A212-S214 PolarHBondContact O-N 2.73Å |
| 215 | L | 73.3 | Confident | 72.5 | Confident | 35 Ų | 35 | 59.9 Ų | 59.9 | 18% | 0.183 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -69.4 | -43.6 | -176.4 | -70.9 | 171.5 | 0 | 0 | 0 | 112.8 | V97 R108 V172 S211 A212 A213 | V97-L215 HydrophobicContact CG2-CD1 3.78Å; R108-L215 HydrophobicContact CG-CD2 3.4Å; R108-L215 VanDerWaalsContact CG-CD2 3.4Å; V172-L215 HydrophobicContact CG1-CB 3.55Å; V172-L215 HydrophobicContact CG1-CD1 3.99Å; V172-L215 HydrophobicContact CG1-CG 4.42Å; V172-L215 HydrophobicContact CG2-CB 4.35Å; S211-L215 VanDerWaalsContact O-CG 3.29Å; S211-L215 WeakPolarHBondContact O-CG 3.18Å; S211-L215 PolarHBondContact O-N 2.95Å; A212-L215 PolarHBondContact O-N 3.46Å; A213-L215 VanDerWaalsContact C-N 3.31Å; A213-L215 PolarHBondContact O-N 3.18Å |
| 216 | L | 73.1 | Confident | 71.7 | Confident | 26 Ų | 26 | 64.2 Ų | 64.2 | 14% | 0.136 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -74.7 | -39.5 | 177.7 | -69.4 | -179.7 | 0 | 0 | 0 | 112.8 | I153 V169 V172 I173 A212 G218 I232 | I153-L216 HydrophobicContact CG2-CD1 4.03Å; V169-L216 HydrophobicContact CB-CD2 4.46Å; V169-L216 HydrophobicContact CG1-CD1 4.26Å; V169-L216 HydrophobicContact CG2-CD2 4.17Å; V172-L216 HydrophobicContact CB-CD2 3.86Å; V172-L216 HydrophobicContact CB-CG 4.2Å; V172-L216 HydrophobicContact CG1-CD1 4.4Å; V172-L216 HydrophobicContact CG1-CD2 3.92Å; V172-L216 HydrophobicContact CG1-CG 3.71Å; V172-L216 HydrophobicContact CG2-CD2 4.1Å; I173-L216 HydrophobicContact CD1-CD1 3.92Å; I173-L216 HydrophobicContact CG1-CD1 4.26Å; A212-L216 PolarHBondContact O-N 3.37Å; L216-G218 VanDerWaalsContact C-N 3.33Å; L216-G218 PolarHBondContact O-N 3.41Å; L216-I232 HydrophobicContact CB-CD1 4.4Å; L216-I232 HydrophobicContact CD1-CD1 3.88Å; L216-I232 HydrophobicContact CD1-CG1 4.48Å |
| 217 | V | 70.5 | Confident | 71.3 | Confident | 14 Ų | 14 | 63 Ų | 63 | 9% | 0.085 | 32% | 0.318 | C | S | . | . | S | Bend | trans | -94.9 | 65.9 | -176.5 | -168.2 | 0 | 0 | 0 | 0 | 109.4 | A213 F221 K225 L228 I229 | A213-V217 WeakPolarHBondContact O-CA 3.38Å; A213-V217 WeakPolarHBondContact O-CB 3.3Å; A213-V217 VanDerWaalsContact O-CG2 3.32Å; A213-V217 WeakPolarHBondContact O-CG2 3.1Å; A213-V217 PolarHBondContact O-N 2.92Å; V217-F221 HydrophobicContact CG1-CB 4.43Å; V217-K225 HydrophobicContact CG1-CB 3.95Å; V217-K225 HydrophobicContact CG1-CD 3.94Å; V217-K225 HydrophobicContact CG1-CG 3.74Å; V217-L228 HydrophobicContact CG2-CB 4.43Å; V217-L228 HydrophobicContact CG2-CD2 4.29Å; V217-I229 HydrophobicContact CG2-CG1 4.32Å |
| 218 | G | 63.9 | Low | 71 | Confident | 20 Ų | 20 | 59.3 Ų | 59.3 | 21% | 0.206 | 31% | 0.305 | C | S | . | . | trans | -62.1 | -178.7 | 167.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | R108 L216 E220 | R108-G218 VanDerWaalsContact NH2-CA 3.35Å; L216-G218 VanDerWaalsContact C-N 3.33Å; L216-G218 PolarHBondContact O-N 3.41Å; G218-E220 PolarHBondContact O-N 3.29Å | ||
| 219 | N | 53.8 | Low | 70.9 | Confident | 137 Ų | 137 | 62.7 Ų | 62.7 | 73% | 0.733 | 32% | 0.322 | S | S | * | . | G | 310 helix | trans | -59.1 | -1.7 | -172.6 | -82.2 | -28.9 | 0 | 0 | 0 | 116.2 | ||
| 220 | E | 55 | Low | 70.9 | Confident | 119 Ų | 119 | 70.1 Ų | 70.1 | 56% | 0.556 | 35% | 0.35 | S | S | * | . | G | 310 helix | trans | -78.8 | -21.2 | -172.7 | -59.6 | -172.5 | 170.2 | 0 | 0 | 113.9 | G218 | G218-E220 PolarHBondContact O-N 3.29Š|
| 221 | F | 54.8 | Low | 71.2 | Confident | 31 Ų | 31 | 65.7 Ų | 65.7 | 14% | 0.136 | 34% | 0.337 | C | S | . | . | G | 310 helix | trans | -116.6 | 40.5 | -170.3 | -64.1 | -72.8 | 0 | 0 | 0 | 116 | L160 G162 V217 T223 K224 K225 | L160-F221 HydrophobicContact CB-CE1 4.43Å; L160-F221 WeakPolarHBondContact O-CE1 3.05Å; G162-F221 VanDerWaalsContact CA-CZ 3.45Å; V217-F221 HydrophobicContact CG1-CB 4.43Å; F221-T223 PolarHBondContact O-N 2.74Å; F221-K224 PolarHBondContact O-N 2.94Å; F221-K225 HydrophobicContact CB-CG 4.32Å; F221-K225 WeakPolarHBondContact O-CG 3.36Å; F221-K225 PolarHBondContact O-N 3.45Å |
| 222 | K | 53.3 | Low | 71.5 | Confident | 161 Ų | 161 | 65.7 Ų | 65.7 | 70% | 0.7 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.6 | -28.8 | -172.5 | -71.5 | -175.7 | 178.3 | 179.9 | 0 | 116.3 | ||
| 223 | T | 56.4 | Low | 71.8 | Confident | 130 Ų | 130 | 69.6 Ų | 69.6 | 80% | 0.798 | 35% | 0.354 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.6 | -11.6 | -173.9 | -1.8 | 0 | 0 | 0 | 0 | 115.4 | F221 | F221-T223 PolarHBondContact O-N 2.74Š|
| 224 | K | 62.3 | Low | 72.1 | Confident | 135 Ų | 135 | 73.3 Ų | 73.3 | 59% | 0.587 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -129.3 | 10.9 | -175.4 | -59.1 | -69 | -176.7 | 177.2 | 0 | 114.3 | F221 L227 | F221-K224 PolarHBondContact O-N 2.94Å; K224-L227 WeakPolarHBondContact O-CB 3.21Å; K224-L227 PolarHBondContact O-N 3.32Å |
| 225 | K | 66.3 | Low | 72.9 | Confident | 65 Ų | 65 | 72.7 Ų | 72.7 | 28% | 0.283 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -44.8 | -47 | 177.7 | -55.9 | -164 | 165 | 172.3 | 0 | 116.1 | V217 F221 L227 L228 I229 | V217-K225 HydrophobicContact CG1-CB 3.95Å; V217-K225 HydrophobicContact CG1-CD 3.94Å; V217-K225 HydrophobicContact CG1-CG 3.74Å; F221-K225 HydrophobicContact CB-CG 4.32Å; F221-K225 WeakPolarHBondContact O-CG 3.36Å; F221-K225 PolarHBondContact O-N 3.45Å; K225-L227 PolarHBondContact O-N 3.01Å; K225-L228 PolarHBondContact O-N 3.19Å; K225-I229 HydrophobicContact CB-CD1 4.41Å; K225-I229 WeakPolarHBondContact O-CG1 3.44Å; K225-I229 PolarHBondContact O-N 3.1Å |
| 226 | P | 71 | Confident | 73.7 | Confident | 95 Ų | 95 | 71 Ų | 71 | 62% | 0.617 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -66.6 | -23.9 | -172.7 | 24.7 | -34.1 | 0 | 0 | 0 | 113.3 | L228 I229 Y230 | P226-L228 VanDerWaalsContact C-N 3.27Å; P226-L228 PolarHBondContact O-N 3.43Å; P226-I229 PolarHBondContact O-N 3.32Å; P226-Y230 PolarHBondContact O-N 3.15Å |
| 227 | L | 79.2 | Confident | 74.5 | Confident | 104 Ų | 104 | 73.6 Ų | 73.6 | 55% | 0.545 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -65.9 | -31.4 | -178.9 | -125.6 | 72.5 | 0 | 0 | 0 | 112.6 | L160 K224 K225 P231 | L160-L227 HydrophobicContact CD1-CD2 4.35Å; L160-L227 HydrophobicContact CD2-CB 4.24Å; K224-L227 WeakPolarHBondContact O-CB 3.21Å; K224-L227 PolarHBondContact O-N 3.32Å; K225-L227 PolarHBondContact O-N 3.01Å; L227-P231 WeakPolarHBondContact O-CD 3.44Å |
| 228 | L | 80.8 | Confident | 75.3 | Confident | 7 Ų | 7 | 78 Ų | 78 | 4% | 0.037 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -92.4 | -32.1 | -179.4 | -150.5 | 163.5 | 0 | 0 | 0 | 111.3 | I153 A157 L160 V217 K225 P226 Y230 P231 I232 | I153-L228 HydrophobicContact CG2-CD2 3.87Å; A157-L228 HydrophobicContact CB-CD1 3.85Å; L160-L228 HydrophobicContact CD2-CB 4.3Å; L160-L228 HydrophobicContact CD2-CD1 4.34Å; V217-L228 HydrophobicContact CG2-CB 4.43Å; V217-L228 HydrophobicContact CG2-CD2 4.29Å; K225-L228 PolarHBondContact O-N 3.19Å; P226-L228 VanDerWaalsContact C-N 3.27Å; P226-L228 PolarHBondContact O-N 3.43Å; L228-Y230 VanDerWaalsContact C-N 3.3Å; L228-Y230 PolarHBondContact O-N 3.28Å; L228-P231 WeakPolarHBondContact O-CD 3.32Å; L228-P231 VanDerWaalsContact O-CG 3.29Å; L228-P231 WeakPolarHBondContact O-CG 3.42Å; L228-I232 HydrophobicContact CD2-CD1 3.33Å; L228-I232 HydrophobicContact CD2-CG1 3.94Å; L228-I232 WeakPolarHBondContact O-CD1 3.37Å; L228-I232 VanDerWaalsContact O-CG1 3.28Å; L228-I232 WeakPolarHBondContact O-CG1 3.33Å; L228-I232 PolarHBondContact O-N 2.86Å |
| 229 | I | 83 | Confident | 76.5 | Confident | 71 Ų | 71 | 77.1 Ų | 77.1 | 36% | 0.364 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.9 | -37.8 | 175.7 | -72.3 | 171.1 | 0 | 0 | 0 | 111.9 | A213 V217 K225 P226 I232 F233 | A213-I229 HydrophobicContact CB-CG1 4.02Å; V217-I229 HydrophobicContact CG2-CG1 4.32Å; K225-I229 HydrophobicContact CB-CD1 4.41Å; K225-I229 WeakPolarHBondContact O-CG1 3.44Å; K225-I229 PolarHBondContact O-N 3.1Å; P226-I229 PolarHBondContact O-N 3.32Å; I229-I232 PolarHBondContact O-N 3.01Å; I229-F233 WeakPolarHBondContact O-CB 3.45Å; I229-F233 PolarHBondContact O-N 3.39Å |
| 230 | Y | 87.7 | Confident | 78.1 | Confident | 162 Ų | 162 | 71.9 Ų | 71.9 | 64% | 0.635 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -57.3 | -56.3 | -179 | 179.5 | -99.8 | 0 | 0 | 0 | 113.8 | P226 L228 I232 F233 L234 | P226-Y230 PolarHBondContact O-N 3.15Å; L228-Y230 VanDerWaalsContact C-N 3.3Å; L228-Y230 PolarHBondContact O-N 3.28Å; Y230-I232 VanDerWaalsContact C-N 3.31Å; Y230-I232 PolarHBondContact O-N 3.26Å; Y230-F233 PolarHBondContact O-N 3.12Å; Y230-L234 HydrophobicContact CE1-CD1 4.26Å; Y230-L234 PolarHBondContact O-N 3.29Å |
| 231 | P | 89.4 | Confident | 79.6 | Confident | 30 Ų | 30 | 68.8 Ų | 68.8 | 20% | 0.195 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -66.4 | -30.4 | 178 | 24 | -33.2 | 0 | 0 | 0 | 113.3 | L156 L227 L228 L235 | L156-P231 HydrophobicContact CD2-CG 3.46Å; L156-P231 VanDerWaalsContact CD2-CG 3.46Å; L227-P231 WeakPolarHBondContact O-CD 3.44Å; L228-P231 WeakPolarHBondContact O-CD 3.32Å; L228-P231 VanDerWaalsContact O-CG 3.29Å; L228-P231 WeakPolarHBondContact O-CG 3.42Å; P231-L235 WeakPolarHBondContact O-CB 3.25Å; P231-L235 PolarHBondContact O-N 3.3Å |
| 232 | I | 88.7 | Confident | 81 | Confident | 0 Ų | 0 | 68.7 Ų | 68.7 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.4 | -52.5 | 172.4 | -67.9 | 172.3 | 0 | 0 | 0 | 109.5 | I153 A212 A213 L216 L228 I229 Y230 L234 L235 Y236 | I153-I232 HydrophobicContact CD1-CG1 4.04Å; I153-I232 HydrophobicContact CG1-CG1 4.43Å; I153-I232 HydrophobicContact CG2-CG1 4.19Å; A212-I232 HydrophobicContact CB-CG2 3.91Å; A213-I232 HydrophobicContact CB-CD1 4.42Å; A213-I232 HydrophobicContact CB-CG2 4.44Å; L216-I232 HydrophobicContact CB-CD1 4.4Å; L216-I232 HydrophobicContact CD1-CD1 3.88Å; L216-I232 HydrophobicContact CD1-CG1 4.48Å; L228-I232 HydrophobicContact CD2-CD1 3.33Å; L228-I232 HydrophobicContact CD2-CG1 3.94Å; L228-I232 WeakPolarHBondContact O-CD1 3.37Å; L228-I232 VanDerWaalsContact O-CG1 3.28Å; L228-I232 WeakPolarHBondContact O-CG1 3.33Å; L228-I232 PolarHBondContact O-N 2.86Å; I229-I232 PolarHBondContact O-N 3.01Å; Y230-I232 VanDerWaalsContact C-N 3.31Å; Y230-I232 PolarHBondContact O-N 3.26Å; I232-L234 VanDerWaalsContact C-N 3.32Å; I232-L234 PolarHBondContact O-N 3.34Å; I232-L235 WeakPolarHBondContact O-CB 3.46Å; I232-L235 PolarHBondContact O-N 3Å; I232-L235 VanDerWaalsContact O-N 3.15Å; I232-Y236 HydrophobicContact CG2-CD2 4.02Å; I232-Y236 HydrophobicContact CG2-CE2 3.67Å; I232-Y236 WeakPolarHBondContact O-CD2 3.39Å; I232-Y236 PolarHBondContact O-N 3.02Å |
| 233 | F | 88.3 | Confident | 82.3 | Confident | 83 Ų | 83 | 63.4 Ų | 63.4 | 36% | 0.364 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -60.3 | -42.2 | -179.1 | -175.3 | -109.8 | 0 | 0 | 0 | 112.3 | F206 A209 I229 Y230 L235 Y236 I237 | F206-F233 HydrophobicContact CD2-CE2 4.24Å; A209-F233 HydrophobicContact CB-CD2 3.76Å; I229-F233 WeakPolarHBondContact O-CB 3.45Å; I229-F233 PolarHBondContact O-N 3.39Å; Y230-F233 PolarHBondContact O-N 3.12Å; F233-L235 VanDerWaalsContact C-N 3.3Å; F233-L235 PolarHBondContact O-N 3.43Å; F233-Y236 PolarHBondContact O-N 3.29Å; F233-I237 HydrophobicContact CD1-CD1 3.63Å; F233-I237 HydrophobicContact CD1-CG1 4.45Å; F233-I237 HydrophobicContact CE1-CD1 3.24Å; F233-I237 HydrophobicContact CE1-CG1 4.18Å; F233-I237 HydrophobicContact CG-CD1 4.46Å; F233-I237 HydrophobicContact CZ-CD1 3.76Å; F233-I237 HydrophobicContact CZ-CG1 4.3Å; F233-I237 PolarHBondContact O-N 3.35Å |
| 234 | L | 89.1 | Confident | 83.3 | Confident | 87 Ų | 87 | 59.9 Ų | 59.9 | 46% | 0.455 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -61 | -39.5 | 176.5 | -166.7 | 151.1 | 0 | 0 | 0 | 111.8 | Y230 I232 I237 Y238 | Y230-L234 HydrophobicContact CE1-CD1 4.26Å; Y230-L234 PolarHBondContact O-N 3.29Å; I232-L234 VanDerWaalsContact C-N 3.32Å; I232-L234 PolarHBondContact O-N 3.34Å; L234-I237 PolarHBondContact O-N 3.39Å; L234-Y238 PolarHBondContact O-N 3Å |
| 235 | L | 91.3 | Very high | 83.4 | Confident | 14 Ų | 14 | 56.1 Ų | 56.1 | 7% | 0.073 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.1 | -44.6 | 176.2 | -168.1 | 76.1 | 0 | 0 | 0 | 112 | I145 I153 I173 P231 I232 F233 Y238 F239 | I145-L235 HydrophobicContact CG2-CD1 3.81Å; I153-L235 HydrophobicContact CD1-CD2 3.77Å; I173-L235 HydrophobicContact CD1-CD2 4.35Å; I173-L235 HydrophobicContact CG2-CD2 3.59Å; P231-L235 WeakPolarHBondContact O-CB 3.25Å; P231-L235 PolarHBondContact O-N 3.3Å; I232-L235 WeakPolarHBondContact O-CB 3.46Å; I232-L235 PolarHBondContact O-N 3Å; I232-L235 VanDerWaalsContact O-N 3.15Å; F233-L235 VanDerWaalsContact C-N 3.3Å; F233-L235 PolarHBondContact O-N 3.43Å; L235-Y238 WeakPolarHBondContact O-CB 3.46Å; L235-Y238 PolarHBondContact O-N 3.35Å; L235-F239 HydrophobicContact CD1-CE2 4.33Å; L235-F239 HydrophobicContact CD2-CE2 3.8Å; L235-F239 HydrophobicContact CG-CD2 4.14Å; L235-F239 HydrophobicContact CG-CE2 3.63Å; L235-F239 HydrophobicContact CG-CZ 4.4Å; L235-F239 VanDerWaalsContact O-CD2 3.22Å; L235-F239 WeakPolarHBondContact O-CD2 3.27Å; L235-F239 PolarHBondContact O-N 2.87Å |
| 236 | Y | 89.4 | Confident | 82.5 | Confident | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -69.8 | -33.5 | 177.6 | -71.1 | -80 | 0 | 0 | 0 | 113.5 | I173 S176 L177 A208 A209 A212 I232 F233 Y238 F239 L240 | I173-Y236 WeakPolarHBondContact CA-OH 3.45Å; I173-Y236 HydrophobicContact CD1-CE2 4.33Å; I173-Y236 PolarHBondContact O-OH 3.23Å; S176-Y236 PolarHBondContact OG-OH 2.83Å; L177-Y236 HydrophobicContact CD2-CD1 4.1Å; L177-Y236 HydrophobicContact CD2-CE1 3.84Å; L177-Y236 HydrophobicContact CG-CE1 4.39Å; A208-Y236 HydrophobicContact CB-CD1 3.9Å; A208-Y236 HydrophobicContact CB-CE1 4.12Å; A209-Y236 HydrophobicContact CB-CD2 3.74Å; A209-Y236 HydrophobicContact CB-CG 4.12Å; A212-Y236 HydrophobicContact CB-CE2 3.53Å; A212-Y236 VanDerWaalsContact CB-OH 3.28Å; A212-Y236 WeakPolarHBondContact CB-OH 3.28Å; I232-Y236 HydrophobicContact CG2-CD2 4.02Å; I232-Y236 HydrophobicContact CG2-CE2 3.67Å; I232-Y236 WeakPolarHBondContact O-CD2 3.39Å; I232-Y236 PolarHBondContact O-N 3.02Å; F233-Y236 PolarHBondContact O-N 3.29Å; Y236-Y238 VanDerWaalsContact C-N 3.27Å; Y236-Y238 PolarHBondContact O-N 3.4Å; Y236-F239 HydrophobicContact CD1-CD2 4.39Å; Y236-F239 PolarHBondContact O-N 3.43Å; Y236-L240 PolarHBondContact O-N 2.9Å |
| 237 | I | 89.6 | Confident | 83.1 | Confident | 81 Ų | 81 | 59.3 Ų | 59.3 | 42% | 0.415 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.4 | -43 | 169.8 | -72.2 | 173.1 | 0 | 0 | 0 | 109.9 | V205 F233 L234 L240 S241 | V205-I237 HydrophobicContact CG1-CG1 4.25Å; F233-I237 HydrophobicContact CD1-CD1 3.63Å; F233-I237 HydrophobicContact CD1-CG1 4.45Å; F233-I237 HydrophobicContact CE1-CD1 3.24Å; F233-I237 HydrophobicContact CE1-CG1 4.18Å; F233-I237 HydrophobicContact CG-CD1 4.46Å; F233-I237 HydrophobicContact CZ-CD1 3.76Å; F233-I237 HydrophobicContact CZ-CG1 4.3Å; F233-I237 PolarHBondContact O-N 3.35Å; L234-I237 PolarHBondContact O-N 3.39Å; I237-L240 WeakPolarHBondContact O-CB 3.47Å; I237-L240 PolarHBondContact O-N 2.92Å; I237-S241 PolarHBondContact O-N 3.3Å |
| 238 | Y | 88.9 | Confident | 83.3 | Confident | 107 Ų | 107 | 56.9 Ų | 56.9 | 42% | 0.42 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -64.1 | -42.1 | 178.6 | -161.7 | -77.2 | 0 | 0 | 0 | 111.9 | I145 L234 L235 Y236 L240 S241 L242 | I145-Y238 HydrophobicContact CD1-CD1 3.66Å; I145-Y238 HydrophobicContact CD1-CE1 3.07Å; I145-Y238 HydrophobicContact CG1-CE1 4.26Å; I145-Y238 HydrophobicContact CG2-CD1 4.23Å; L234-Y238 PolarHBondContact O-N 3Å; L235-Y238 WeakPolarHBondContact O-CB 3.46Å; L235-Y238 PolarHBondContact O-N 3.35Å; Y236-Y238 VanDerWaalsContact C-N 3.27Å; Y236-Y238 PolarHBondContact O-N 3.4Å; Y238-L240 VanDerWaalsContact C-N 3.3Å; Y238-L240 PolarHBondContact O-N 2.83Å; Y238-S241 WeakPolarHBondContact O-CB 3.43Å; Y238-S241 PolarHBondContact O-N 3.38Å; Y238-S241 VanDerWaalsContact O-N 3.15Å; Y238-L242 HydrophobicContact CD1-CD1 3.73Å; Y238-L242 HydrophobicContact CD1-CG 3.99Å; Y238-L242 HydrophobicContact CE1-CD1 3.54Å; Y238-L242 HydrophobicContact CE1-CD2 4.31Å; Y238-L242 HydrophobicContact CE1-CG 3.65Å; Y238-L242 PolarHBondContact O-N 3Å |
| 239 | F | 88.8 | Confident | 83.5 | Confident | 0 Ų | 0 | 59.7 Ų | 59.7 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.7 | -39.3 | 172.7 | -74.6 | -57.1 | 0 | 0 | 0 | 112.4 | F127 I142 I145 W146 L177 L235 Y236 Y243 | F127-F239 HydrophobicContact CE1-CB 4.33Å; F127-F239 HydrophobicContact CE1-CD1 4.2Å; F127-F239 HydrophobicContact CZ-CB 4.32Å; I142-F239 HydrophobicContact CG2-CD1 4.44Å; I142-F239 HydrophobicContact CG2-CE1 4.13Å; I145-F239 HydrophobicContact CG2-CE1 4.26Å; I145-F239 HydrophobicContact CG2-CZ 4.3Å; W146-F239 HydrophobicContact CB-CE1 4.41Å; W146-F239 HydrophobicContact CB-CZ 4Å; L177-F239 HydrophobicContact CD2-CB 4.29Å; L177-F239 HydrophobicContact CD2-CD2 3.71Å; L177-F239 HydrophobicContact CD2-CE2 4.09Å; L177-F239 HydrophobicContact CD2-CG 3.94Å; L235-F239 HydrophobicContact CD1-CE2 4.33Å; L235-F239 HydrophobicContact CD2-CE2 3.8Å; L235-F239 HydrophobicContact CG-CD2 4.14Å; L235-F239 HydrophobicContact CG-CE2 3.63Å; L235-F239 HydrophobicContact CG-CZ 4.4Å; L235-F239 VanDerWaalsContact O-CD2 3.22Å; L235-F239 WeakPolarHBondContact O-CD2 3.27Å; L235-F239 PolarHBondContact O-N 2.87Å; Y236-F239 HydrophobicContact CD1-CD2 4.39Å; Y236-F239 PolarHBondContact O-N 3.43Å; F239-Y243 WeakPolarHBondContact O-CB 3.35Å; F239-Y243 PolarHBondContact O-N 2.87Å |
| 240 | L | 87.1 | Confident | 83.5 | Confident | 28 Ų | 28 | 59.1 Ų | 59.1 | 15% | 0.147 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -65.5 | -41.8 | 173.1 | 178.6 | 67.5 | 0 | 0 | 0 | 112 | K201 V205 Y236 I237 Y238 L242 Y243 T244 | K201-L240 HydrophobicContact CB-CD1 4.01Å; K201-L240 HydrophobicContact CB-CD2 4.34Å; K201-L240 HydrophobicContact CD-CD1 4.37Å; K201-L240 HydrophobicContact CG-CD1 4.15Å; V205-L240 HydrophobicContact CG2-CB 3.55Å; V205-L240 HydrophobicContact CG2-CD1 4.11Å; V205-L240 HydrophobicContact CG2-CD2 3.54Å; V205-L240 HydrophobicContact CG2-CG 3.9Å; Y236-L240 PolarHBondContact O-N 2.9Å; I237-L240 WeakPolarHBondContact O-CB 3.47Å; I237-L240 PolarHBondContact O-N 2.92Å; Y238-L240 VanDerWaalsContact C-N 3.3Å; Y238-L240 PolarHBondContact O-N 2.83Å; L240-L242 VanDerWaalsContact C-N 3.33Å; L240-L242 PolarHBondContact O-N 3.48Å; L240-Y243 HydrophobicContact CD1-CD1 4.21Å; L240-Y243 WeakPolarHBondContact O-CA 3.45Å; L240-Y243 WeakPolarHBondContact O-CB 3.49Å; L240-Y243 PolarHBondContact O-N 3.37Å; L240-Y243 VanDerWaalsContact O-N 3.11Å; L240-T244 HydrophobicContact CD1-CG2 4.35Å; L240-T244 PolarHBondContact O-N 3.27Å; L240-T244 PolarHBondContact O-OG1 2.98Å |
| 241 | S | 86.4 | Confident | 83.2 | Confident | 53 Ų | 53 | 52.6 Ų | 52.6 | 37% | 0.371 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -59.1 | -46.4 | 177.6 | -160 | 0 | 0 | 0 | 0 | 110.9 | I237 Y238 Y243 T244 G245 | I237-S241 PolarHBondContact O-N 3.3Å; Y238-S241 WeakPolarHBondContact O-CB 3.43Å; Y238-S241 PolarHBondContact O-N 3.38Å; Y238-S241 VanDerWaalsContact O-N 3.15Å; S241-Y243 VanDerWaalsContact C-N 3.3Å; S241-Y243 PolarHBondContact O-N 3.47Å; S241-T244 WeakPolarHBondContact CA-OG1 3.47Å; S241-T244 PolarHBondContact O-N 3.32Å; S241-T244 VanDerWaalsContact O-N 3.13Å; S241-T244 PolarHBondContact O-OG1 2.9Å; S241-G245 PolarHBondContact O-N 3.19Å |
| 242 | L | 84.3 | Confident | 82.8 | Confident | 29 Ų | 29 | 54.1 Ų | 54.1 | 15% | 0.152 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -61 | -37.1 | 174 | -83.6 | 173 | 0 | 0 | 0 | 112.6 | I142 I145 Y238 L240 T244 G245 | I142-L242 HydrophobicContact CG1-CD1 3.84Å; I145-L242 HydrophobicContact CD1-CD1 3.8Å; Y238-L242 HydrophobicContact CD1-CD1 3.73Å; Y238-L242 HydrophobicContact CD1-CG 3.99Å; Y238-L242 HydrophobicContact CE1-CD1 3.54Å; Y238-L242 HydrophobicContact CE1-CD2 4.31Å; Y238-L242 HydrophobicContact CE1-CG 3.65Å; Y238-L242 PolarHBondContact O-N 3Å; L240-L242 VanDerWaalsContact C-N 3.33Å; L240-L242 PolarHBondContact O-N 3.48Å; L242-T244 VanDerWaalsContact C-N 3.35Å; L242-G245 PolarHBondContact O-N 3.05Å |
| 243 | Y | 81.1 | Confident | 82.4 | Confident | 51 Ų | 51 | 58 Ų | 58 | 20% | 0.2 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -64.3 | -38.6 | 173.3 | 175.1 | -95.1 | 0 | 0 | 0 | 112.7 | F127 I130 S131 A184 L187 F239 L240 S241 G245 | F127-Y243 HydrophobicContact CE2-CD2 4.31Å; I130-Y243 HydrophobicContact CG2-CE2 3.95Å; S131-Y243 WeakPolarHBondContact OG-CA 3.48Å; A184-Y243 HydrophobicContact CB-CE2 4.21Å; L187-Y243 HydrophobicContact CD2-CE1 4.14Å; F239-Y243 WeakPolarHBondContact O-CB 3.35Å; F239-Y243 PolarHBondContact O-N 2.87Å; L240-Y243 HydrophobicContact CD1-CD1 4.21Å; L240-Y243 WeakPolarHBondContact O-CA 3.45Å; L240-Y243 WeakPolarHBondContact O-CB 3.49Å; L240-Y243 PolarHBondContact O-N 3.37Å; L240-Y243 VanDerWaalsContact O-N 3.11Å; S241-Y243 VanDerWaalsContact C-N 3.3Å; S241-Y243 PolarHBondContact O-N 3.47Å; Y243-G245 VanDerWaalsContact C-N 3.32Å |
| 244 | T | 76.3 | Confident | 82 | Confident | 56 Ų | 56 | 56.1 Ų | 56.1 | 34% | 0.344 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -81.2 | -10.6 | 179.4 | 53.3 | 0 | 0 | 0 | 0 | 114.2 | K201 L240 S241 L242 V246 | K201-T244 HydrophobicContact CD-CG2 4.36Å; L240-T244 HydrophobicContact CD1-CG2 4.35Å; L240-T244 PolarHBondContact O-N 3.27Å; L240-T244 PolarHBondContact O-OG1 2.98Å; S241-T244 WeakPolarHBondContact CA-OG1 3.47Å; S241-T244 PolarHBondContact O-N 3.32Å; S241-T244 VanDerWaalsContact O-N 3.13Å; S241-T244 PolarHBondContact O-OG1 2.9Å; L242-T244 VanDerWaalsContact C-N 3.35Å; T244-V246 VanDerWaalsContact C-N 3.27Å; T244-V246 WeakPolarHBondContact O-CG2 3.28Å; T244-V246 PolarHBondContact O-N 3.4Å |
| 245 | G | 64.9 | Low | 81.4 | Confident | 55 Ų | 55 | 53.5 Ų | 53.5 | 57% | 0.567 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.6 | 22.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | S241 L242 Y243 | S241-G245 PolarHBondContact O-N 3.19Å; L242-G245 PolarHBondContact O-N 3.05Å; Y243-G245 VanDerWaalsContact C-N 3.32Å |
| 246 | V | 48.3 | Very low | 80.4 | Confident | 168 Ų | 168 | 57.1 Ų | 57.1 | 100% | 1.018 | 33% | 0.33 | S | S | * | . | trans | -101.9 | 0 | -179.4 | -152.7 | 0 | 0 | 0 | 0 | 110.8 | T244 | T244-V246 VanDerWaalsContact C-N 3.27Å; T244-V246 WeakPolarHBondContact O-CG2 3.28Å; T244-V246 PolarHBondContact O-N 3.4Å |
Retrieved 246 of 246 residues in 120.1 ms
(Link to these results)