| 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 | 39.1 | Very low | 36.1 | Very low | 239 Ų | 239 | 156.8 Ų | 156.8 | 100% | 1.177 | 84% | 0.842 | S | S | * | * | 0 | 122 | 0 | -85 | 171.9 | 161.4 | 0 | 0 | 104.7 | D3 | M1-D3 PolarHBondContact O-N 2.84Š| |||
| 2 | S | 36 | Very low | 35.5 | Very low | 118 Ų | 118 | 160.3 Ų | 160.3 | 83% | 0.825 | 84% | 0.844 | S | S | * | * | trans | -56.6 | 123.6 | -161.5 | 43.3 | 0 | 0 | 0 | 0 | 112.7 | D4 | S2-D4 PolarHBondContact O-N 3.04Š| ||
| 3 | D | 37.3 | Very low | 34.8 | Very low | 149 Ų | 149 | 153.7 Ų | 153.7 | 80% | 0.797 | 84% | 0.838 | S | S | * | * | trans | -71 | 109.8 | 165.3 | -68.3 | -45.8 | 0 | 0 | 0 | 108.2 | M1 | M1-D3 PolarHBondContact O-N 2.84Š| ||
| 4 | D | 35.9 | Very low | 34.3 | Very low | 131 Ų | 131 | 156.1 Ų | 156.1 | 70% | 0.701 | 84% | 0.837 | S | S | * | * | trans | -158.6 | 151.3 | 154.8 | -91.5 | -35.7 | 0 | 0 | 0 | 105.9 | S2 | S2-D4 PolarHBondContact O-N 3.04Š| ||
| 5 | I | 38.4 | Very low | 33.7 | Very low | 147 Ų | 147 | 157.1 Ų | 157.1 | 75% | 0.754 | 83% | 0.834 | S | S | * | * | trans | 91.9 | 49.1 | -174.8 | -38.3 | 156.3 | 0 | 0 | 0 | 114.8 | ||||
| 6 | W | 40.7 | Very low | 33.4 | Very low | 213 Ų | 213 | 158.4 Ų | 158.4 | 81% | 0.807 | 83% | 0.831 | S | S | * | * | trans | -136.5 | 56.7 | 153.5 | -65.4 | 103.6 | 0 | 0 | 0 | 110.4 | ||||
| 7 | E | 36.4 | Very low | 33.2 | Very low | 191 Ų | 191 | 157.2 Ų | 157.2 | 89% | 0.893 | 83% | 0.825 | S | S | * | * | trans | -102.2 | 126.1 | 163.8 | -75.7 | -154.1 | 164.6 | 0 | 0 | 111.2 | S9 | E7-S9 PolarHBondContact O-N 3.27Š| ||
| 8 | E | 32.3 | Very low | 33.2 | Very low | 194 Ų | 194 | 157.4 Ų | 157.4 | 91% | 0.907 | 83% | 0.827 | S | S | * | * | trans | -15.2 | 101.3 | 167.5 | -62.6 | 177.3 | 156.3 | 0 | 0 | 116.1 | A10 | E8-A10 PolarHBondContact O-N 3.3Š| ||
| 9 | S | 36.6 | Very low | 33.3 | Very low | 115 Ų | 115 | 159.2 Ų | 159.2 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | trans | -80.6 | 102.8 | 156.1 | 76.2 | 0 | 0 | 0 | 0 | 109 | E7 V11 | E7-S9 PolarHBondContact O-N 3.27Å; S9-V11 PolarHBondContact O-N 3.12Å; S9-V11 VanDerWaalsContact O-N 3.14Å | ||
| 10 | A | 29.7 | Very low | 33.1 | Very low | 99 Ų | 99 | 161 Ų | 161 | 82% | 0.818 | 83% | 0.834 | S | S | * | * | trans | -52.3 | 107.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | E8 | E8-A10 PolarHBondContact O-N 3.3Š| ||
| 11 | V | 34.7 | Very low | 33.2 | Very low | 129 Ų | 129 | 158.1 Ų | 158.1 | 78% | 0.782 | 83% | 0.834 | S | S | * | * | trans | -137.6 | 120.9 | 153.2 | -172.9 | 0 | 0 | 0 | 0 | 108.6 | S9 | S9-V11 PolarHBondContact O-N 3.12Å; S9-V11 VanDerWaalsContact O-N 3.14Å | ||
| 12 | K | 29.6 | Very low | 32.9 | Very low | 199 Ų | 199 | 153.3 Ų | 153.3 | 87% | 0.865 | 81% | 0.813 | S | S | * | * | trans | -28.4 | 124.8 | -173.4 | -74.9 | 169 | 172.2 | 175.9 | 0 | 116 | ||||
| 13 | G | 26 | Very low | 32.5 | Very low | 74 Ų | 74 | 153.9 Ų | 153.9 | 76% | 0.763 | 81% | 0.807 | S | S | * | * | trans | -63.6 | 151 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 14 | F | 27.5 | Very low | 32.1 | Very low | 187 Ų | 187 | 153.2 Ų | 153.2 | 82% | 0.82 | 81% | 0.808 | S | S | * | * | trans | -106.5 | 121.5 | 150.9 | -85.2 | -85.6 | 0 | 0 | 0 | 108.5 | F16 | F14-F16 HydrophobicContact CB-CE2 4.24Š| ||
| 15 | Q | 25 | Very low | 31.8 | Very low | 171 Ų | 171 | 152.7 Ų | 152.7 | 80% | 0.799 | 82% | 0.815 | S | S | * | * | trans | -81 | 111.4 | 165.6 | -172.1 | 166.2 | -21.7 | 0 | 0 | 106.1 | ||||
| 16 | F | 30.1 | Very low | 31.4 | Very low | 178 Ų | 178 | 151.9 Ų | 151.9 | 78% | 0.781 | 82% | 0.817 | S | S | * | * | trans | -87.4 | 106.2 | 166.9 | -81.8 | -84 | 0 | 0 | 0 | 107.5 | F14 L18 | F14-F16 HydrophobicContact CB-CE2 4.24Å; F16-L18 VanDerWaalsContact C-N 3.27Å; F16-L18 PolarHBondContact O-N 3.12Å | ||
| 17 | D | 29.8 | Very low | 30.9 | Very low | 138 Ų | 138 | 152.3 Ų | 152.3 | 74% | 0.738 | 82% | 0.82 | S | S | * | * | trans | -62.1 | 93.5 | 162 | -68.6 | -33.8 | 0 | 0 | 0 | 107.6 | E19 | D17-E19 PolarHBondContact O-N 3.24Š| ||
| 18 | L | 32.8 | Very low | 30.6 | Very low | 162 Ų | 162 | 147.2 Ų | 147.2 | 85% | 0.848 | 81% | 0.805 | S | S | * | * | trans | -79.6 | 107.8 | 158.7 | -82.8 | 165.4 | 0 | 0 | 0 | 106.3 | F16 E20 | F16-L18 VanDerWaalsContact C-N 3.27Å; F16-L18 PolarHBondContact O-N 3.12Å; L18-E20 PolarHBondContact O-N 3.43Å | ||
| 19 | E | 35.3 | Very low | 30.4 | Very low | 190 Ų | 190 | 144.5 Ų | 144.5 | 89% | 0.888 | 80% | 0.797 | S | S | * | * | trans | -44.4 | 134.9 | 172.4 | -71.9 | -179.4 | 155.4 | 0 | 0 | 111.3 | D17 | D17-E19 PolarHBondContact O-N 3.24Š| ||
| 20 | E | 29.4 | Very low | 30 | Very low | 196 Ų | 196 | 146 Ų | 146 | 92% | 0.916 | 80% | 0.795 | S | S | * | * | trans | -51.9 | 128.2 | -175.2 | -63.2 | 168.6 | 147.1 | 0 | 0 | 113 | L18 | L18-E20 PolarHBondContact O-N 3.43Š| ||
| 21 | A | 35.1 | Very low | 30.1 | Very low | 100 Ų | 100 | 149.2 Ų | 149.2 | 83% | 0.826 | 80% | 0.797 | S | S | * | * | trans | -139.5 | 84.3 | 152 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 22 | D | 31.6 | Very low | 29.7 | Very low | 138 Ų | 138 | 146.4 Ų | 146.4 | 74% | 0.738 | 79% | 0.794 | S | S | * | * | trans | 33.5 | 110.2 | 148.7 | -82.2 | -29.7 | 0 | 0 | 0 | 120.5 | ||||
| 23 | N | 29.2 | Very low | 29.7 | Very low | 131 Ų | 131 | 145 Ų | 145 | 70% | 0.701 | 80% | 0.796 | S | S | * | * | 77.8 | 120.3 | 122.9 | -65.1 | -34.1 | 0 | 0 | 0 | 120.8 | |||||
| 24 | T | 28 | Very low | 29.8 | Very low | 134 Ų | 134 | 146.1 Ų | 146.1 | 82% | 0.822 | 79% | 0.792 | S | S | * | * | trans | 95.7 | 91.6 | 143.1 | 65.8 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 25 | S | 30.6 | Very low | 29.9 | Very low | 121 Ų | 121 | 147 Ų | 147 | 85% | 0.846 | 80% | 0.796 | S | S | * | * | -147.1 | 101.1 | 129.2 | 66.8 | 0 | 0 | 0 | 0 | 111.1 | Y27 | S25-Y27 PolarHBondContact O-N 3.4Š| |||
| 26 | T | 28.6 | Very low | 30 | Very low | 130 Ų | 130 | 142.2 Ų | 142.2 | 80% | 0.798 | 79% | 0.793 | S | S | * | * | trans | -57.8 | 116.7 | 159.7 | -44.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 27 | Y | 31.9 | Very low | 30 | Very low | 222 Ų | 222 | 142.8 Ų | 142.8 | 87% | 0.871 | 80% | 0.798 | S | S | * | * | trans | -171 | 85 | 138.3 | -122.6 | -88.4 | 0 | 0 | 0 | 108.2 | S25 | S25-Y27 PolarHBondContact O-N 3.4Š| ||
| 28 | S | 28.3 | Very low | 29.9 | Very low | 83 Ų | 83 | 143 Ų | 143 | 58% | 0.58 | 80% | 0.804 | S | S | * | * | trans | -82.3 | 160.4 | 157.2 | 55.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 29 | D | 28.1 | Very low | 29.7 | Very low | 137 Ų | 137 | 142.5 Ų | 142.5 | 73% | 0.733 | 80% | 0.802 | S | S | * | * | trans | 100 | 140.9 | 158.3 | -50.6 | -30.9 | 0 | 0 | 0 | 116.7 | ||||
| 30 | I | 29.2 | Very low | 29.4 | Very low | 147 Ų | 147 | 139.1 Ų | 139.1 | 75% | 0.754 | 80% | 0.798 | S | S | * | * | trans | 99.4 | 79.6 | 171.6 | -46.3 | 157.9 | 0 | 0 | 0 | 112.7 | ||||
| 31 | L | 31.4 | Very low | 29.3 | Very low | 167 Ų | 167 | 137.3 Ų | 137.3 | 87% | 0.874 | 80% | 0.795 | S | S | * | * | 179.1 | 118.7 | 94.2 | -84.2 | 169.7 | 0 | 0 | 0 | 110.6 | |||||
| 32 | G | 27.2 | Very low | 29.2 | Very low | 70 Ų | 70 | 141.7 Ų | 141.7 | 72% | 0.722 | 80% | 0.798 | S | S | * | * | trans | -95.4 | 161.7 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 33 | D | 27.7 | Very low | 29.2 | Very low | 168 Ų | 168 | 139.2 Ų | 139.2 | 90% | 0.898 | 79% | 0.791 | S | S | * | * | trans | 67.2 | 128.8 | 149.9 | -74.7 | -10.6 | 0 | 0 | 0 | 122.8 | ||||
| 34 | S | 28.2 | Very low | 29.8 | Very low | 98 Ų | 98 | 140 Ų | 140 | 69% | 0.685 | 79% | 0.794 | S | S | * | * | trans | 101.4 | 110.2 | 141.9 | -143.5 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 35 | F | 30.6 | Very low | 30 | Very low | 206 Ų | 206 | 139.6 Ų | 139.6 | 90% | 0.904 | 79% | 0.791 | S | S | * | * | -173.4 | 111.1 | 118.1 | -94.5 | -71.8 | 0 | 0 | 0 | 108.6 | |||||
| 36 | G | 26.6 | Very low | 30.7 | Very low | 71 Ų | 71 | 137.4 Ų | 137.4 | 73% | 0.732 | 77% | 0.773 | S | S | * | * | trans | -91 | 130.8 | 160.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 37 | E | 30.1 | Very low | 31.3 | Very low | 189 Ų | 189 | 137.1 Ų | 137.1 | 88% | 0.883 | 77% | 0.766 | S | S | * | * | trans | -160.7 | 115.8 | 149.9 | -114.7 | 173.4 | -165.6 | 0 | 0 | 110.4 | ||||
| 38 | T | 29.1 | Very low | 32 | Very low | 142 Ų | 142 | 135 Ų | 135 | 87% | 0.871 | 76% | 0.762 | S | S | * | * | trans | -39.8 | 118.6 | 173.6 | -13.5 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 39 | L | 28.2 | Very low | 33 | Very low | 152 Ų | 152 | 136.9 Ų | 136.9 | 80% | 0.796 | 77% | 0.766 | S | S | * | * | trans | -145 | 104.3 | 159.4 | -84 | 168.5 | 0 | 0 | 0 | 112.5 | ||||
| 40 | C | 28.3 | Very low | 34.4 | Very low | 119 Ų | 119 | 135.8 Ų | 135.8 | 80% | 0.804 | 76% | 0.76 | S | S | * | * | trans | 40.1 | 98.2 | 145.9 | -60.7 | 0 | 0 | 0 | 0 | 120.7 | E42 | C40-E42 PolarHBondContact O-N 2.9Š| ||
| 41 | D | 27.6 | Very low | 36.4 | Very low | 159 Ų | 159 | 131.5 Ų | 131.5 | 85% | 0.85 | 74% | 0.738 | S | S | * | * | trans | -52.4 | 117.8 | 157.9 | -93.3 | -40.4 | 0 | 0 | 0 | 113.1 | ||||
| 42 | E | 32.8 | Very low | 38.8 | Very low | 192 Ų | 192 | 129.3 Ų | 129.3 | 90% | 0.897 | 72% | 0.722 | S | S | * | * | trans | -104 | 85.5 | 145.7 | -79 | -172.1 | 167.3 | 0 | 0 | 107.9 | C40 I44 | C40-E42 PolarHBondContact O-N 2.9Å; E42-I44 PolarHBondContact O-N 3Å | ||
| 43 | S | 32.3 | Very low | 41.6 | Very low | 85 Ų | 85 | 126 Ų | 126 | 59% | 0.594 | 69% | 0.687 | S | S | * | * | trans | -60.6 | 122.7 | 176.6 | 59.1 | 0 | 0 | 0 | 0 | 110.9 | T45 | S43-T45 PolarHBondContact O-N 3.17Š| ||
| 44 | I | 41 | Very low | 44.3 | Very low | 147 Ų | 147 | 119.4 Ų | 119.4 | 75% | 0.754 | 66% | 0.656 | S | S | * | * | trans | -64.5 | 97.8 | 165.7 | -60 | 170.6 | 0 | 0 | 0 | 107.6 | E42 V46 | E42-I44 PolarHBondContact O-N 3Å; I44-V46 HydrophobicContact CG2-CG2 3.86Å; I44-V46 PolarHBondContact O-N 3.4Å | ||
| 45 | T | 33.3 | Very low | 47 | Very low | 126 Ų | 126 | 116.6 Ų | 116.6 | 77% | 0.773 | 63% | 0.633 | S | S | * | * | trans | -80.3 | 92.1 | 172.5 | 42 | 0 | 0 | 0 | 0 | 109.3 | S43 D47 | S43-T45 PolarHBondContact O-N 3.17Å; T45-D47 PolarHBondContact O-N 2.66Å | ||
| 46 | V | 44.1 | Very low | 49.6 | Very low | 76 Ų | 76 | 108.9 Ų | 108.9 | 46% | 0.461 | 61% | 0.605 | S | S | . | * | trans | -78.3 | 115.1 | 165.9 | -174 | 0 | 0 | 0 | 0 | 107.8 | I44 F48 L51 | I44-V46 HydrophobicContact CG2-CG2 3.86Å; I44-V46 PolarHBondContact O-N 3.4Å; V46-F48 VanDerWaalsContact O-CD2 3.29Å; V46-F48 WeakPolarHBondContact O-CD2 3.25Å; V46-F48 PolarHBondContact O-N 2.67Å; V46-L51 HydrophobicContact CG1-CD1 4.39Å | ||
| 47 | D | 41.4 | Very low | 52.3 | Low | 123 Ų | 123 | 112.1 Ų | 112.1 | 66% | 0.658 | 60% | 0.6 | S | S | * | * | trans | -65.9 | 110.3 | 175.9 | -157.7 | -15.7 | 0 | 0 | 0 | 109 | T45 N49 | T45-D47 PolarHBondContact O-N 2.66Å; D47-N49 PolarHBondContact O-N 3.12Å; D47-N49 PolarHBondContact OD1-ND2 2.85Å | ||
| 48 | F | 47 | Very low | 54.8 | Low | 178 Ų | 178 | 107.9 Ų | 107.9 | 78% | 0.781 | 58% | 0.584 | S | S | * | * | trans | -69.4 | 17.6 | -171.1 | -76.6 | -85.8 | 0 | 0 | 0 | 115 | V46 N50 | V46-F48 VanDerWaalsContact O-CD2 3.29Å; V46-F48 WeakPolarHBondContact O-CD2 3.25Å; V46-F48 PolarHBondContact O-N 2.67Å; F48-N50 PolarHBondContact O-N 2.8Å | ||
| 49 | N | 47.8 | Very low | 57.2 | Low | 122 Ų | 122 | 106.2 Ų | 106.2 | 65% | 0.652 | 57% | 0.569 | S | S | * | * | S | Bend | trans | -86.3 | 100.8 | -175.2 | -75.8 | -47.8 | 0 | 0 | 0 | 111.4 | D47 | D47-N49 PolarHBondContact O-N 3.12Å; D47-N49 PolarHBondContact OD1-ND2 2.85Å |
| 50 | N | 58.8 | Low | 59.2 | Low | 115 Ų | 115 | 100 Ų | 100 | 62% | 0.615 | 54% | 0.538 | S | S | * | . | trans | 52.4 | 63.5 | 168 | -61.5 | -30.4 | 0 | 0 | 0 | 115.8 | F48 F52 L59 | F48-N50 PolarHBondContact O-N 2.8Å; N50-F52 HydrophobicContact CB-CE2 4.39Å; N50-F52 WeakPolarHBondContact O-CD2 3.31Å; N50-F52 PolarHBondContact O-N 2.98Å; N50-L59 HydrophobicContact CB-CD1 4.19Å | ||
| 51 | L | 71 | Confident | 61.1 | Low | 56 Ų | 56 | 96.7 Ų | 96.7 | 29% | 0.293 | 52% | 0.523 | S | S | . | . | P | Polyproline II helix | trans | -69.4 | 131.6 | 168.4 | -92.5 | 88.4 | 0 | 0 | 0 | 111.1 | V46 V60 Y66 A71 | V46-L51 HydrophobicContact CG1-CD1 4.39Å; L51-V60 HydrophobicContact CB-CB 4.33Å; L51-V60 HydrophobicContact CB-CG2 4.38Å; L51-V60 WeakPolarHBondContact O-CB 3.33Å; L51-V60 WeakPolarHBondContact O-CG2 3.49Å; L51-V60 PolarHBondContact O-N 2.8Å; L51-Y66 HydrophobicContact CD2-CE1 4.15Å; L51-A71 HydrophobicContact CD2-CB 3.47Å; L51-A71 VanDerWaalsContact CD2-CB 3.47Å |
| 52 | F | 81.9 | Confident | 62.8 | Low | 122 Ų | 122 | 97.1 Ų | 97.1 | 54% | 0.535 | 53% | 0.525 | S | S | . | . | B | Isolated β-bridge | trans | -102.3 | 143 | 172.8 | -67.2 | -80.7 | 0 | 0 | 0 | 110.1 | N50 A54 H57 N58 L59 | N50-F52 HydrophobicContact CB-CE2 4.39Å; N50-F52 WeakPolarHBondContact O-CD2 3.31Å; N50-F52 PolarHBondContact O-N 2.98Å; F52-A54 PolarHBondContact O-N 3.32Å; F52-H57 VanDerWaalsContact CD1-O 3.29Å; F52-H57 WeakPolarHBondContact CD1-O 3.38Å; F52-N58 CarbonylContact C-O 3.6Å; F52-N58 WeakPolarHBondContact CA-O 3.43Å; F52-L59 HydrophobicContact CE1-CD1 4.31Å |
| 53 | C | 84.7 | Confident | 64.1 | Low | 0 Ų | 0 | 95 Ų | 95 | 0% | 0 | 52% | 0.515 | C | S | . | . | P | Polyproline II helix | trans | -63 | 130.2 | 175.3 | 174.2 | 0 | 0 | 0 | 0 | 109.2 | I55 C56 H57 N58 V60 A71 C73 | C53-I55 PolarHBondContact O-N 3.47Å; C53-I55 VanDerWaalsContact O-N 3.09Å; C53-C56 VanDerWaalsContact SG-SG 3.65Å; C53-H57 WeakPolarHBondContact O-CA 3.42Å; C53-H57 PolarHBondContact O-N 3.4Å; C53-N58 PolarHBondContact N-O 3.18Å; C53-V60 HydrophobicContact CB-CG2 4.13Å; C53-V60 VanDerWaalsContact N-CG2 3.33Å; C53-A71 WeakPolarHBondContact CA-O 3.46Å; C53-C73 HydrophobicContact CB-CB 3.85Å |
| 54 | A | 84.6 | Confident | 65.8 | Low | 30 Ų | 30 | 92.7 Ų | 92.7 | 25% | 0.248 | 50% | 0.498 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.2 | -6 | -174.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | F52 A71 F72 W97 | F52-A54 PolarHBondContact O-N 3.32Å; A54-A71 PolarHBondContact N-O 3.03Å; A54-F72 HydrophobicContact CB-CE1 4.21Å; A54-W97 HydrophobicContact CB-CH2 3.31Å; A54-W97 HydrophobicContact CB-CZ2 3.65Å; A54-W97 HydrophobicContact CB-CZ3 4.44Å |
| 55 | I | 85.1 | Confident | 67.5 | Low | 38 Ų | 38 | 89.3 Ų | 89.3 | 20% | 0.195 | 48% | 0.476 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -107.5 | -51.1 | 178 | -65.9 | -64 | 0 | 0 | 0 | 112.2 | C53 F72 C77 K80 A81 I84 W97 | C53-I55 PolarHBondContact O-N 3.47Å; C53-I55 VanDerWaalsContact O-N 3.09Å; I55-F72 HydrophobicContact CG1-CD1 3.94Å; I55-F72 HydrophobicContact CG1-CE1 3.86Å; I55-C77 HydrophobicContact CB-CB 4.15Å; I55-C77 HydrophobicContact CG2-CB 4.46Å; I55-K80 HydrophobicContact CG2-CD 4.02Å; I55-A81 HydrophobicContact CD1-CB 3.82Å; I55-A81 HydrophobicContact CG1-CB 3.97Å; I55-I84 HydrophobicContact CD1-CD1 4.46Å; I55-W97 HydrophobicContact CD1-CZ2 4.15Å |
| 56 | C | 86.2 | Confident | 69.6 | Low | 45 Ų | 45 | 89.2 Ų | 89.2 | 30% | 0.304 | 46% | 0.462 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103 | -3.1 | -175.6 | 71.9 | 0 | 0 | 0 | 0 | 114 | C53 N58 C73 | C53-C56 VanDerWaalsContact SG-SG 3.65Å; C56-N58 PolarHBondContact O-N 3.49Å; C56-N58 PolarHBondContact SG-ND2 3Å; C56-C73 PolarHBondContact SG-SG 3.35Å |
| 57 | H | 83.3 | Confident | 71.6 | Confident | 138 Ų | 138 | 86.3 Ų | 86.3 | 64% | 0.639 | 44% | 0.443 | S | S | * | . | trans | 56.5 | 19.2 | -178.5 | -54 | -68.4 | 0 | 0 | 0 | 115.2 | F52 C53 | F52-H57 VanDerWaalsContact CD1-O 3.29Å; F52-H57 WeakPolarHBondContact CD1-O 3.38Å; C53-H57 WeakPolarHBondContact O-CA 3.42Å; C53-H57 PolarHBondContact O-N 3.4Å | ||
| 58 | N | 82.3 | Confident | 73.6 | Confident | 100 Ų | 100 | 86 Ų | 86 | 54% | 0.535 | 44% | 0.437 | S | S | . | . | P | Polyproline II helix | trans | -78.3 | 151 | 172.7 | -71.1 | -29.7 | 0 | 0 | 0 | 110 | F52 C53 C56 V60 | F52-N58 CarbonylContact C-O 3.6Å; F52-N58 WeakPolarHBondContact CA-O 3.43Å; C53-N58 PolarHBondContact N-O 3.18Å; C56-N58 PolarHBondContact O-N 3.49Å; C56-N58 PolarHBondContact SG-ND2 3Å; N58-V60 PolarHBondContact O-N 3.27Å |
| 59 | L | 78.7 | Confident | 75.2 | Confident | 107 Ų | 107 | 85.2 Ų | 85.2 | 56% | 0.56 | 44% | 0.44 | S | S | * | . | B | Isolated β-bridge | trans | -58.9 | 126.9 | 172 | -167.2 | 76.6 | 0 | 0 | 0 | 109.2 | N50 F52 G61 | N50-L59 HydrophobicContact CB-CD1 4.19Å; F52-L59 HydrophobicContact CE1-CD1 4.31Å; L59-G61 PolarHBondContact O-N 3.46Å |
| 60 | V | 71.2 | Confident | 77 | Confident | 23 Ų | 23 | 79.9 Ų | 79.9 | 14% | 0.139 | 41% | 0.413 | C | S | . | . | P | Polyproline II helix | trans | -74.8 | 117.4 | -179 | 175.4 | 0 | 0 | 0 | 0 | 108.6 | L51 C53 N58 V64 A71 C73 | L51-V60 HydrophobicContact CB-CB 4.33Å; L51-V60 HydrophobicContact CB-CG2 4.38Å; L51-V60 WeakPolarHBondContact O-CB 3.33Å; L51-V60 WeakPolarHBondContact O-CG2 3.49Å; L51-V60 PolarHBondContact O-N 2.8Å; C53-V60 HydrophobicContact CB-CG2 4.13Å; C53-V60 VanDerWaalsContact N-CG2 3.33Å; N58-V60 PolarHBondContact O-N 3.27Å; V60-V64 HydrophobicContact CG1-CB 3.98Å; V60-V64 HydrophobicContact CG1-CG1 3.54Å; V60-V64 HydrophobicContact CG1-CG2 3.31Å; V60-A71 HydrophobicContact CG2-CB 4.28Å; V60-C73 HydrophobicContact CG2-CB 4.33Å |
| 61 | G | 68.4 | Low | 78.3 | Confident | 48 Ų | 48 | 74.6 Ų | 74.6 | 50% | 0.495 | 39% | 0.385 | S | S | . | . | trans | -87 | -150 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L59 E63 V64 | L59-G61 PolarHBondContact O-N 3.46Å; G61-E63 PolarHBondContact O-N 3.02Å; G61-V64 WeakPolarHBondContact O-CG2 3.34Å | ||
| 62 | N | 62.5 | Low | 79.1 | Confident | 168 Ų | 168 | 71.9 Ų | 71.9 | 90% | 0.898 | 37% | 0.371 | S | S | * | . | S | Bend | trans | -73.1 | -22.1 | -171.7 | -67.4 | -13.2 | 0 | 0 | 0 | 115.2 | ||
| 63 | E | 59.6 | Low | 79.3 | Confident | 148 Ų | 148 | 67.7 Ų | 67.7 | 69% | 0.692 | 36% | 0.356 | S | S | * | . | trans | -99.3 | 109 | 177.3 | -72.3 | -176.8 | 178 | 0 | 0 | 109.7 | G61 C73 | G61-E63 PolarHBondContact O-N 3.02Å; E63-C73 CarbonylContact O-C 3.59Å | ||
| 64 | V | 69.3 | Low | 79.5 | Confident | 37 Ų | 37 | 69.4 Ų | 69.4 | 22% | 0.224 | 37% | 0.368 | C | S | . | . | trans | -131 | 125.4 | -171.7 | -163.4 | 0 | 0 | 0 | 0 | 110.8 | V60 G61 Y66 A71 F72 | V60-V64 HydrophobicContact CG1-CB 3.98Å; V60-V64 HydrophobicContact CG1-CG1 3.54Å; V60-V64 HydrophobicContact CG1-CG2 3.31Å; G61-V64 WeakPolarHBondContact O-CG2 3.34Å; V64-Y66 HydrophobicContact CB-CD2 4.03Å; V64-Y66 HydrophobicContact CB-CE1 4.42Å; V64-Y66 HydrophobicContact CB-CE2 3.42Å; V64-Y66 VanDerWaalsContact CB-CE2 3.42Å; V64-Y66 HydrophobicContact CG1-CD1 3.91Å; V64-Y66 HydrophobicContact CG1-CD2 3.79Å; V64-Y66 HydrophobicContact CG1-CE1 3.51Å; V64-Y66 HydrophobicContact CG1-CE2 3.38Å; V64-Y66 HydrophobicContact CG1-CG 4.04Å; V64-Y66 HydrophobicContact CG2-CE2 4.2Å; V64-A71 HydrophobicContact CG1-CB 3.94Å; V64-F72 WeakPolarHBondContact CA-O 3.4Å | ||
| 65 | Y | 76.1 | Confident | 79.7 | Confident | 76 Ų | 76 | 72.9 Ų | 72.9 | 30% | 0.298 | 38% | 0.379 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95 | 116.5 | 164.3 | -63.7 | -100.9 | 0 | 0 | 0 | 107.2 | A71 F72 E75 W78 | Y65-A71 WeakPolarHBondContact O-CA 3.43Å; Y65-F72 PolarHBondContact N-O 3.28Å; Y65-F72 VanDerWaalsContact N-O 3.13Å; Y65-F72 WeakPolarHBondContact O-CD2 3.46Å; Y65-F72 PolarHBondContact O-N 3.05Å; Y65-E75 HydrophobicContact CE2-CB 3.93Å; Y65-E75 VanDerWaalsContact CE2-N 3.34Å; Y65-E75 WeakPolarHBondContact OH-CB 3.3Å; Y65-W78 HydrophobicContact CD1-CB 4.48Å; Y65-W78 AromaticContact CD1-CD2 3.82Å; Y65-W78 HydrophobicContact CD1-CD2 3.82Å; Y65-W78 AromaticContact CD1-CE3 3.97Å; Y65-W78 HydrophobicContact CD1-CE3 3.97Å; Y65-W78 HydrophobicContact CD1-CG 4.08Å; Y65-W78 HydrophobicContact CD1-CZ3 4.44Å; Y65-W78 HydrophobicContact CD2-CB 4.42Å; Y65-W78 HydrophobicContact CE1-CD2 4.38Å; Y65-W78 HydrophobicContact CE1-CE3 4.06Å; Y65-W78 HydrophobicContact CE1-CZ3 4.31Å; Y65-W78 HydrophobicContact CG-CB 4.08Å; Y65-W78 HydrophobicContact CG-CD2 4.26Å; Y65-W78 HydrophobicContact CG-CG 4.03Å |
| 66 | Y | 76.8 | Confident | 79.8 | Confident | 124 Ų | 124 | 74.5 Ų | 74.5 | 49% | 0.486 | 40% | 0.399 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.7 | 131.2 | 176.2 | -66.3 | -79.5 | 0 | 0 | 0 | 109.8 | L51 V64 A71 | L51-Y66 HydrophobicContact CD2-CE1 4.15Å; V64-Y66 HydrophobicContact CB-CD2 4.03Å; V64-Y66 HydrophobicContact CB-CE1 4.42Å; V64-Y66 HydrophobicContact CB-CE2 3.42Å; V64-Y66 VanDerWaalsContact CB-CE2 3.42Å; V64-Y66 HydrophobicContact CG1-CD1 3.91Å; V64-Y66 HydrophobicContact CG1-CD2 3.79Å; V64-Y66 HydrophobicContact CG1-CE1 3.51Å; V64-Y66 HydrophobicContact CG1-CE2 3.38Å; V64-Y66 HydrophobicContact CG1-CG 4.04Å; V64-Y66 HydrophobicContact CG2-CE2 4.2Å; Y66-A71 HydrophobicContact CD1-CB 4.08Å; Y66-A71 HydrophobicContact CE1-CB 4.06Å |
| 67 | E | 87.3 | Confident | 79.9 | Confident | 14 Ų | 14 | 73 Ų | 73 | 7% | 0.065 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.4 | 176.6 | 169.1 | -65.7 | -63.6 | 175.2 | 0 | 0 | 107.6 | D69 A70 F72 W78 T101 F102 V103 S104 S107 | E67-D69 PolarHBondContact O-N 2.99Å; E67-A70 PolarHBondContact N-O 2.96Å; E67-A70 PolarHBondContact O-N 3.46Å; E67-A70 VanDerWaalsContact O-N 3.08Å; E67-A70 VanDerWaalsContact O-O 3.06Å; E67-F72 HydrophobicContact CB-CE2 4.14Å; E67-F72 HydrophobicContact CG-CE2 3.95Å; E67-W78 PolarHBondContact OE1-NE1 3.06Å; E67-T101 HydrophobicContact CB-CG2 4.25Å; E67-T101 WeakPolarHBondContact CB-O 3.23Å; E67-F102 HydrophobicContact CG-CD1 3.95Å; E67-F102 WeakPolarHBondContact OE2-CA 3.48Å; E67-V103 PolarHBondContact OE2-N 3.45Å; E67-S104 WeakPolarHBondContact OE1-CB 3.48Å; E67-S104 PolarHBondContact OE1-OG 3.37Å; E67-S104 PolarHBondContact OE2-N 3.37Å; E67-S104 VanDerWaalsContact OE2-N 3.1Å; E67-S107 VanDerWaalsContact OE1-CB 3.28Å; E67-S107 WeakPolarHBondContact OE1-CB 3.35Å |
| 68 | K | 83.8 | Confident | 80.3 | Confident | 118 Ų | 118 | 66.9 Ų | 66.9 | 51% | 0.513 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.5 | 118.1 | -176.4 | -173.2 | -178.9 | 177.7 | 179.7 | 0 | 110.5 | A70 T101 V103 | K68-A70 PolarHBondContact O-N 2.87Å; K68-A70 VanDerWaalsContact O-N 3.16Å; K68-T101 WeakPolarHBondContact CB-O 3.36Å; K68-T101 PolarHBondContact N-O 3.32Å; K68-V103 HydrophobicContact CB-CG1 3.98Å; K68-V103 HydrophobicContact CB-CG2 4.42Å |
| 69 | D | 80.6 | Confident | 80.7 | Confident | 161 Ų | 161 | 64.8 Ų | 64.8 | 86% | 0.861 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.3 | 21 | -179.7 | -50.4 | -47.1 | 0 | 0 | 0 | 114.7 | E67 | E67-D69 PolarHBondContact O-N 2.99Š|
| 70 | A | 85.3 | Confident | 81.3 | Confident | 10 Ų | 10 | 65.6 Ų | 65.6 | 8% | 0.083 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.3 | 144 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | E67 K68 F72 W97 T101 | E67-A70 PolarHBondContact N-O 2.96Å; E67-A70 PolarHBondContact O-N 3.46Å; E67-A70 VanDerWaalsContact O-N 3.08Å; E67-A70 VanDerWaalsContact O-O 3.06Å; K68-A70 PolarHBondContact O-N 2.87Å; K68-A70 VanDerWaalsContact O-N 3.16Å; A70-F72 HydrophobicContact CB-CE2 4.1Å; A70-F72 HydrophobicContact CB-CZ 4Å; A70-W97 HydrophobicContact CB-CH2 4.1Å; A70-W97 HydrophobicContact CB-CZ3 3.72Å; A70-T101 HydrophobicContact CB-CG2 4.39Å |
| 71 | A | 85.8 | Confident | 82.2 | Confident | 3 Ų | 3 | 64.5 Ų | 64.5 | 3% | 0.025 | 34% | 0.341 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.7 | 143.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | L51 C53 A54 V60 V64 Y65 Y66 | L51-A71 HydrophobicContact CD2-CB 3.47Å; L51-A71 VanDerWaalsContact CD2-CB 3.47Å; C53-A71 WeakPolarHBondContact CA-O 3.46Å; A54-A71 PolarHBondContact N-O 3.03Å; V60-A71 HydrophobicContact CG2-CB 4.28Å; V64-A71 HydrophobicContact CG1-CB 3.94Å; Y65-A71 WeakPolarHBondContact O-CA 3.43Å; Y66-A71 HydrophobicContact CD1-CB 4.08Å; Y66-A71 HydrophobicContact CE1-CB 4.06Å |
| 72 | F | 88 | Confident | 83.3 | Confident | 0 Ų | 0 | 62.2 Ų | 62.2 | 0% | 0 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.4 | 132.7 | 178 | -49 | -86.3 | 0 | 0 | 0 | 110.4 | A54 I55 V64 Y65 E67 A70 S74 C77 W78 A81 W97 F102 | A54-F72 HydrophobicContact CB-CE1 4.21Å; I55-F72 HydrophobicContact CG1-CD1 3.94Å; I55-F72 HydrophobicContact CG1-CE1 3.86Å; V64-F72 WeakPolarHBondContact CA-O 3.4Å; Y65-F72 PolarHBondContact N-O 3.28Å; Y65-F72 VanDerWaalsContact N-O 3.13Å; Y65-F72 WeakPolarHBondContact O-CD2 3.46Å; Y65-F72 PolarHBondContact O-N 3.05Å; E67-F72 HydrophobicContact CB-CE2 4.14Å; E67-F72 HydrophobicContact CG-CE2 3.95Å; A70-F72 HydrophobicContact CB-CE2 4.1Å; A70-F72 HydrophobicContact CB-CZ 4Å; F72-S74 VanDerWaalsContact C-N 3.26Å; F72-S74 PolarHBondContact O-N 2.97Å; F72-C77 HydrophobicContact CB-CB 4.19Å; F72-C77 HydrophobicContact CD1-CB 4.43Å; F72-W78 HydrophobicContact CB-CB 3.96Å; F72-W78 HydrophobicContact CD2-CB 4.1Å; F72-W78 AromaticContact CD2-CD1 3.6Å; F72-W78 HydrophobicContact CD2-CG 4.24Å; F72-W78 AromaticContact CE2-CD1 3.79Å; F72-W78 HydrophobicContact CG-CB 3.98Å; F72-A81 HydrophobicContact CD1-CB 4.32Å; F72-A81 HydrophobicContact CE1-CB 3.48Å; F72-A81 VanDerWaalsContact CE1-CB 3.48Å; F72-A81 HydrophobicContact CZ-CB 3.81Å; F72-W97 HydrophobicContact CE1-CH2 4.38Å; F72-W97 HydrophobicContact CZ-CH2 4.37Å; F72-W97 HydrophobicContact CZ-CZ3 4.19Å; F72-F102 HydrophobicContact CZ-CE1 4.46Å |
| 73 | C | 86.7 | Confident | 84.6 | Confident | 33 Ų | 33 | 57.1 Ų | 57.1 | 22% | 0.223 | 29% | 0.292 | C | S | . | . | S | Bend | trans | -80.5 | -2.8 | -176.2 | 68.7 | 0 | 0 | 0 | 0 | 114.4 | C53 C56 V60 E63 | C53-C73 HydrophobicContact CB-CB 3.85Å; C56-C73 PolarHBondContact SG-SG 3.35Å; V60-C73 HydrophobicContact CG2-CB 4.33Å; E63-C73 CarbonylContact O-C 3.59Å |
| 74 | S | 87.8 | Confident | 85.9 | Confident | 36 Ų | 36 | 52.5 Ų | 52.5 | 25% | 0.252 | 27% | 0.272 | S | S | . | . | S | Bend | trans | -163.2 | 158.4 | 179.7 | 64.5 | 0 | 0 | 0 | 0 | 110.3 | F72 A76 C77 W78 | F72-S74 VanDerWaalsContact C-N 3.26Å; F72-S74 PolarHBondContact O-N 2.97Å; S74-A76 PolarHBondContact O-N 3.41Å; S74-C77 PolarHBondContact O-N 3.41Å; S74-C77 PolarHBondContact OG-N 2.89Å; S74-C77 PolarHBondContact OG-SG 2.95Å; S74-W78 PolarHBondContact O-N 3.23Å; S74-W78 VanDerWaalsContact O-N 3.11Å |
| 75 | E | 88.1 | Confident | 86.8 | Confident | 103 Ų | 103 | 50.8 Ų | 50.8 | 48% | 0.481 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -57.6 | -39.5 | 172.3 | -167.3 | -179.6 | 178.4 | 0 | 0 | 111.4 | Y65 C77 W78 L79 | Y65-E75 HydrophobicContact CE2-CB 3.93Å; Y65-E75 VanDerWaalsContact CE2-N 3.34Å; Y65-E75 WeakPolarHBondContact OH-CB 3.3Å; E75-C77 VanDerWaalsContact C-N 3.33Å; E75-C77 PolarHBondContact O-N 3.32Å; E75-W78 HydrophobicContact CG-CE3 4.22Å; E75-W78 PolarHBondContact O-N 3Å; E75-W78 VanDerWaalsContact O-N 3.15Å; E75-L79 HydrophobicContact CG-CD1 3.93Å; E75-L79 HydrophobicContact CG-CG 4.13Å; E75-L79 WeakPolarHBondContact O-CB 3.43Å; E75-L79 WeakPolarHBondContact O-CG 3.39Å; E75-L79 PolarHBondContact O-N 2.73Å |
| 76 | A | 88.4 | Confident | 87.4 | Confident | 72 Ų | 72 | 47.9 Ų | 47.9 | 60% | 0.595 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -60.2 | -41.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | S74 K80 | S74-A76 PolarHBondContact O-N 3.41Å; A76-K80 VanDerWaalsContact O-CB 3.26Å; A76-K80 WeakPolarHBondContact O-CB 3.32Å; A76-K80 PolarHBondContact O-N 3.42Å |
| 77 | C | 88.6 | Confident | 87.8 | Confident | 14 Ų | 14 | 46.1 Ų | 46.1 | 10% | 0.095 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -66.9 | -42.5 | 174.6 | -74.6 | 0 | 0 | 0 | 0 | 111.6 | I55 F72 S74 E75 K80 A81 | I55-C77 HydrophobicContact CB-CB 4.15Å; I55-C77 HydrophobicContact CG2-CB 4.46Å; F72-C77 HydrophobicContact CB-CB 4.19Å; F72-C77 HydrophobicContact CD1-CB 4.43Å; S74-C77 PolarHBondContact O-N 3.41Å; S74-C77 PolarHBondContact OG-N 2.89Å; S74-C77 PolarHBondContact OG-SG 2.95Å; E75-C77 VanDerWaalsContact C-N 3.33Å; E75-C77 PolarHBondContact O-N 3.32Å; C77-K80 PolarHBondContact O-N 3.05Å; C77-A81 PolarHBondContact O-N 2.96Å |
| 78 | W | 91.2 | Very high | 87.6 | Confident | 9 Ų | 9 | 47.6 Ų | 47.6 | 3% | 0.034 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.6 | -47.6 | 178.5 | 176.4 | 69.5 | 0 | 0 | 0 | 112.1 | Y65 E67 F72 S74 E75 K80 A81 I82 V110 | Y65-W78 HydrophobicContact CD1-CB 4.48Å; Y65-W78 AromaticContact CD1-CD2 3.82Å; Y65-W78 HydrophobicContact CD1-CD2 3.82Å; Y65-W78 AromaticContact CD1-CE3 3.97Å; Y65-W78 HydrophobicContact CD1-CE3 3.97Å; Y65-W78 HydrophobicContact CD1-CG 4.08Å; Y65-W78 HydrophobicContact CD1-CZ3 4.44Å; Y65-W78 HydrophobicContact CD2-CB 4.42Å; Y65-W78 HydrophobicContact CE1-CD2 4.38Å; Y65-W78 HydrophobicContact CE1-CE3 4.06Å; Y65-W78 HydrophobicContact CE1-CZ3 4.31Å; Y65-W78 HydrophobicContact CG-CB 4.08Å; Y65-W78 HydrophobicContact CG-CD2 4.26Å; Y65-W78 HydrophobicContact CG-CG 4.03Å; E67-W78 PolarHBondContact OE1-NE1 3.06Å; F72-W78 HydrophobicContact CB-CB 3.96Å; F72-W78 HydrophobicContact CD2-CB 4.1Å; F72-W78 AromaticContact CD2-CD1 3.6Å; F72-W78 HydrophobicContact CD2-CG 4.24Å; F72-W78 AromaticContact CE2-CD1 3.79Å; F72-W78 HydrophobicContact CG-CB 3.98Å; S74-W78 PolarHBondContact O-N 3.23Å; S74-W78 VanDerWaalsContact O-N 3.11Å; E75-W78 HydrophobicContact CG-CE3 4.22Å; E75-W78 PolarHBondContact O-N 3Å; E75-W78 VanDerWaalsContact O-N 3.15Å; W78-K80 VanDerWaalsContact C-N 3.32Å; W78-K80 PolarHBondContact O-N 3.22Å; W78-A81 WeakPolarHBondContact O-CB 3.29Å; W78-A81 PolarHBondContact O-N 2.75Å; W78-I82 HydrophobicContact CD2-CD1 3.91Å; W78-I82 HydrophobicContact CE3-CD1 4.3Å; W78-I82 HydrophobicContact CG-CD1 4.45Å; W78-I82 HydrophobicContact CH2-CD1 4.22Å; W78-I82 HydrophobicContact CZ2-CD1 3.83Å; W78-I82 HydrophobicContact CZ3-CD1 4.44Å; W78-I82 WeakPolarHBondContact O-CG1 3.27Å; W78-I82 PolarHBondContact O-N 2.89Å; W78-V110 HydrophobicContact CH2-CB 4.33Å; W78-V110 HydrophobicContact CH2-CG2 3.75Å; W78-V110 HydrophobicContact CZ3-CG2 4.01Å |
| 79 | L | 91.2 | Very high | 87.6 | Confident | 56 Ų | 56 | 44.8 Ų | 44.8 | 29% | 0.293 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -61.8 | -38.3 | 175.2 | -71.3 | 176.7 | 0 | 0 | 0 | 112.3 | E75 A81 I82 T83 V110 | E75-L79 HydrophobicContact CG-CD1 3.93Å; E75-L79 HydrophobicContact CG-CG 4.13Å; E75-L79 WeakPolarHBondContact O-CB 3.43Å; E75-L79 WeakPolarHBondContact O-CG 3.39Å; E75-L79 PolarHBondContact O-N 2.73Å; L79-A81 VanDerWaalsContact C-N 3.35Å; L79-I82 PolarHBondContact O-N 3.28Å; L79-T83 WeakPolarHBondContact O-CB 3.43Å; L79-T83 PolarHBondContact O-N 2.91Å; L79-T83 PolarHBondContact O-OG1 2.86Å; L79-V110 HydrophobicContact CD2-CG1 3.57Å |
| 80 | K | 89.7 | Confident | 87.6 | Confident | 124 Ų | 124 | 40.8 Ų | 40.8 | 54% | 0.539 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -62.8 | -42.1 | 175.2 | -172.6 | 172.1 | -177.6 | 179.9 | 0 | 111.5 | I55 A76 C77 W78 T83 I84 | I55-K80 HydrophobicContact CG2-CD 4.02Å; A76-K80 VanDerWaalsContact O-CB 3.26Å; A76-K80 WeakPolarHBondContact O-CB 3.32Å; A76-K80 PolarHBondContact O-N 3.42Å; C77-K80 PolarHBondContact O-N 3.05Å; W78-K80 VanDerWaalsContact C-N 3.32Å; W78-K80 PolarHBondContact O-N 3.22Å; K80-T83 PolarHBondContact O-N 2.68Å; K80-I84 HydrophobicContact CG-CD1 4.15Å; K80-I84 VanDerWaalsContact O-CG1 3.29Å; K80-I84 WeakPolarHBondContact O-CG1 3.37Å; K80-I84 PolarHBondContact O-N 3.47Å |
| 81 | A | 90.7 | Very high | 87.1 | Confident | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.9 | -44.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I55 F72 C77 W78 L79 T83 I84 A85 W97 F102 | I55-A81 HydrophobicContact CD1-CB 3.82Å; I55-A81 HydrophobicContact CG1-CB 3.97Å; F72-A81 HydrophobicContact CD1-CB 4.32Å; F72-A81 HydrophobicContact CE1-CB 3.48Å; F72-A81 VanDerWaalsContact CE1-CB 3.48Å; F72-A81 HydrophobicContact CZ-CB 3.81Å; C77-A81 PolarHBondContact O-N 2.96Å; W78-A81 WeakPolarHBondContact O-CB 3.29Å; W78-A81 PolarHBondContact O-N 2.75Å; L79-A81 VanDerWaalsContact C-N 3.35Å; A81-T83 VanDerWaalsContact C-N 3.31Å; A81-T83 PolarHBondContact O-N 2.66Å; A81-I84 PolarHBondContact O-N 3.2Å; A81-A85 WeakPolarHBondContact O-CB 3.12Å; A81-A85 PolarHBondContact O-N 3.33Å; A81-W97 HydrophobicContact CB-CD2 4.35Å; A81-W97 HydrophobicContact CB-CG 4.45Å; A81-F102 HydrophobicContact CB-CE1 4.21Å; A81-F102 HydrophobicContact CB-CZ 3.94Å |
| 82 | I | 91.4 | Very high | 86.4 | Confident | 1 Ų | 1 | 49.3 Ų | 49.3 | 1% | 0.005 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -61 | -41.8 | 176.1 | -68.1 | 171.9 | 0 | 0 | 0 | 111.2 | W78 L79 A85 L86 F102 V110 I111 L114 | W78-I82 HydrophobicContact CD2-CD1 3.91Å; W78-I82 HydrophobicContact CE3-CD1 4.3Å; W78-I82 HydrophobicContact CG-CD1 4.45Å; W78-I82 HydrophobicContact CH2-CD1 4.22Å; W78-I82 HydrophobicContact CZ2-CD1 3.83Å; W78-I82 HydrophobicContact CZ3-CD1 4.44Å; W78-I82 WeakPolarHBondContact O-CG1 3.27Å; W78-I82 PolarHBondContact O-N 2.89Å; L79-I82 PolarHBondContact O-N 3.28Å; I82-A85 WeakPolarHBondContact O-CB 3.35Å; I82-A85 PolarHBondContact O-N 2.98Å; I82-L86 HydrophobicContact CG2-CD1 4.34Å; I82-L86 PolarHBondContact O-N 2.96Å; I82-F102 HydrophobicContact CB-CE1 4.42Å; I82-F102 HydrophobicContact CB-CZ 4.45Å; I82-F102 HydrophobicContact CD1-CD1 4.22Å; I82-F102 HydrophobicContact CD1-CE1 4.33Å; I82-F102 HydrophobicContact CG1-CD1 3.58Å; I82-F102 HydrophobicContact CG1-CE1 3.35Å; I82-F102 HydrophobicContact CG1-CE2 4.41Å; I82-F102 HydrophobicContact CG1-CG 4.21Å; I82-F102 HydrophobicContact CG1-CZ 3.82Å; I82-V110 HydrophobicContact CD1-CB 4.36Å; I82-V110 HydrophobicContact CD1-CG1 3.92Å; I82-V110 HydrophobicContact CG2-CG1 4.37Å; I82-I111 HydrophobicContact CG2-CG1 3.61Å; I82-L114 HydrophobicContact CG2-CD1 3.73Å |
| 83 | T | 89.6 | Confident | 85.2 | Confident | 61 Ų | 61 | 51.5 Ų | 51.5 | 37% | 0.374 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -64.2 | -45.1 | 179.7 | -54.1 | 0 | 0 | 0 | 0 | 111 | L79 K80 A81 A85 L86 D87 | L79-T83 WeakPolarHBondContact O-CB 3.43Å; L79-T83 PolarHBondContact O-N 2.91Å; L79-T83 PolarHBondContact O-OG1 2.86Å; K80-T83 PolarHBondContact O-N 2.68Å; A81-T83 VanDerWaalsContact C-N 3.31Å; A81-T83 PolarHBondContact O-N 2.66Å; T83-A85 VanDerWaalsContact C-N 3.31Å; T83-A85 PolarHBondContact O-N 2.83Å; T83-L86 PolarHBondContact O-N 3.01Å; T83-D87 PolarHBondContact O-N 3.01Å |
| 84 | I | 87.9 | Confident | 84.2 | Confident | 50 Ų | 50 | 57.1 Ų | 57.1 | 26% | 0.256 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -60 | -43 | 174.9 | -67.3 | 164.2 | 0 | 0 | 0 | 110.8 | I55 K80 A81 L86 D87 D88 | I55-I84 HydrophobicContact CD1-CD1 4.46Å; K80-I84 HydrophobicContact CG-CD1 4.15Å; K80-I84 VanDerWaalsContact O-CG1 3.29Å; K80-I84 WeakPolarHBondContact O-CG1 3.37Å; K80-I84 PolarHBondContact O-N 3.47Å; A81-I84 PolarHBondContact O-N 3.2Å; I84-L86 VanDerWaalsContact C-N 3.33Å; I84-L86 PolarHBondContact O-N 2.97Å; I84-D87 PolarHBondContact O-N 3.34Å; I84-D88 WeakPolarHBondContact O-CB 3.26Å; I84-D88 PolarHBondContact O-N 3.38Å |
| 85 | A | 88.9 | Confident | 83.3 | Confident | 2 Ų | 2 | 56.5 Ų | 56.5 | 2% | 0.017 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60.2 | -41.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | A81 I82 T83 F89 W97 L99 F102 | A81-A85 WeakPolarHBondContact O-CB 3.12Å; A81-A85 PolarHBondContact O-N 3.33Å; I82-A85 WeakPolarHBondContact O-CB 3.35Å; I82-A85 PolarHBondContact O-N 2.98Å; T83-A85 VanDerWaalsContact C-N 3.31Å; T83-A85 PolarHBondContact O-N 2.83Å; A85-F89 VanDerWaalsContact O-CB 3.28Å; A85-F89 WeakPolarHBondContact O-CB 3.39Å; A85-F89 PolarHBondContact O-N 2.96Å; A85-W97 HydrophobicContact CB-CB 3.86Å; A85-W97 WeakPolarHBondContact CB-O 3.25Å; A85-L99 HydrophobicContact CB-CD2 4.23Å; A85-F102 HydrophobicContact CB-CD2 4.4Å; A85-F102 HydrophobicContact CB-CE2 3.56Å; A85-F102 HydrophobicContact CB-CZ 4.3Å |
| 86 | L | 87.9 | Confident | 82.7 | Confident | 15 Ų | 15 | 56.6 Ų | 56.6 | 8% | 0.079 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -66.4 | -44.7 | 175.8 | -77.2 | 174.2 | 0 | 0 | 0 | 111.7 | I82 T83 I84 D88 F89 V90 L99 I111 L114 T115 I127 | I82-L86 HydrophobicContact CG2-CD1 4.34Å; I82-L86 PolarHBondContact O-N 2.96Å; T83-L86 PolarHBondContact O-N 3.01Å; I84-L86 VanDerWaalsContact C-N 3.33Å; I84-L86 PolarHBondContact O-N 2.97Å; L86-D88 PolarHBondContact O-N 3.15Å; L86-F89 PolarHBondContact O-N 2.97Å; L86-V90 VanDerWaalsContact O-CG2 3.27Å; L86-V90 WeakPolarHBondContact O-CG2 3.39Å; L86-V90 PolarHBondContact O-N 3.32Å; L86-L99 HydrophobicContact CD2-CD2 4.45Å; L86-I111 HydrophobicContact CD2-CG2 4.17Å; L86-L114 HydrophobicContact CD1-CB 3.68Å; L86-L114 HydrophobicContact CD1-CD1 4.15Å; L86-T115 WeakPolarHBondContact CD2-OG1 3.38Å; L86-I127 HydrophobicContact CD2-CD1 3.96Å; L86-I127 HydrophobicContact CD2-CG1 4.38Å |
| 87 | D | 84.1 | Confident | 82.5 | Confident | 87 Ų | 87 | 55 Ų | 55 | 47% | 0.465 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -60 | -45.5 | 176.6 | -74.6 | -15.2 | 0 | 0 | 0 | 111.4 | T83 I84 F89 V90 V91 | T83-D87 PolarHBondContact O-N 3.01Å; I84-D87 PolarHBondContact O-N 3.34Å; D87-F89 VanDerWaalsContact C-N 3.35Å; D87-F89 PolarHBondContact O-N 2.82Å; D87-V90 PolarHBondContact O-N 3.24Å; D87-V91 WeakPolarHBondContact O-CG2 3.41Å; D87-V91 PolarHBondContact O-N 3.27Å |
| 88 | D | 83.5 | Confident | 82.3 | Confident | 44 Ų | 44 | 57.2 Ų | 57.2 | 24% | 0.235 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -62.9 | -41.3 | 177.1 | -73.5 | -17.8 | 0 | 0 | 0 | 111.8 | I84 L86 V90 V91 G92 G93 S95 T96 | I84-D88 WeakPolarHBondContact O-CB 3.26Å; I84-D88 PolarHBondContact O-N 3.38Å; L86-D88 PolarHBondContact O-N 3.15Å; D88-V90 VanDerWaalsContact C-N 3.35Å; D88-V91 PolarHBondContact O-N 2.7Å; D88-G92 PolarHBondContact O-N 3.48Å; D88-G93 PolarHBondContact O-N 2.91Å; D88-S95 VanDerWaalsContact CB-CB 3.5Å; D88-S95 WeakPolarHBondContact CB-OG 3.24Å; D88-S95 VanDerWaalsContact OD2-CA 3.23Å; D88-S95 WeakPolarHBondContact OD2-CA 3.46Å; D88-S95 VanDerWaalsContact OD2-CB 3.27Å; D88-S95 WeakPolarHBondContact OD2-CB 3.13Å; D88-S95 PolarHBondContact OD2-OG 2.99Å; D88-T96 PolarHBondContact OD2-N 3.35Å |
| 89 | F | 84.1 | Confident | 82.1 | Confident | 60 Ų | 60 | 58.1 Ų | 58.1 | 26% | 0.263 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.8 | -39.5 | 178.4 | -176.7 | -95.7 | 0 | 0 | 0 | 112 | A85 L86 D87 V91 G92 L99 L123 K126 I127 E130 | A85-F89 VanDerWaalsContact O-CB 3.28Å; A85-F89 WeakPolarHBondContact O-CB 3.39Å; A85-F89 PolarHBondContact O-N 2.96Å; L86-F89 PolarHBondContact O-N 2.97Å; D87-F89 VanDerWaalsContact C-N 3.35Å; D87-F89 PolarHBondContact O-N 2.82Å; F89-V91 VanDerWaalsContact C-N 3.33Å; F89-G92 PolarHBondContact O-N 3.34Å; F89-L99 HydrophobicContact CB-CD1 4.37Å; F89-L99 HydrophobicContact CD1-CD1 4.37Å; F89-L99 HydrophobicContact CD2-CD1 3.49Å; F89-L99 VanDerWaalsContact CD2-CD1 3.49Å; F89-L99 HydrophobicContact CD2-CG 4.25Å; F89-L99 HydrophobicContact CE2-CD1 3.75Å; F89-L99 HydrophobicContact CG-CD1 3.83Å; F89-L99 HydrophobicContact CZ-CD1 4.29Å; F89-L123 HydrophobicContact CD1-CD1 3.78Å; F89-L123 HydrophobicContact CE1-CD1 4Å; F89-K126 HydrophobicContact CE1-CB 3.95Å; F89-K126 HydrophobicContact CE1-CD 4.34Å; F89-K126 HydrophobicContact CZ-CB 4.2Å; F89-I127 HydrophobicContact CD1-CD1 3.79Å; F89-I127 HydrophobicContact CE1-CD1 3.66Å; F89-I127 HydrophobicContact CE1-CG1 4.23Å; F89-I127 HydrophobicContact CG-CD1 4.41Å; F89-I127 HydrophobicContact CZ-CD1 4.19Å; F89-E130 HydrophobicContact CE2-CG 4.29Å; F89-E130 HydrophobicContact CZ-CG 4.06Å |
| 90 | V | 80.3 | Confident | 81.8 | Confident | 77 Ų | 77 | 59.2 Ų | 59.2 | 47% | 0.467 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.1 | -42.1 | 175.4 | 171 | 0 | 0 | 0 | 0 | 111.1 | L86 D87 D88 G92 L123 | L86-V90 VanDerWaalsContact O-CG2 3.27Å; L86-V90 WeakPolarHBondContact O-CG2 3.39Å; L86-V90 PolarHBondContact O-N 3.32Å; D87-V90 PolarHBondContact O-N 3.24Å; D88-V90 VanDerWaalsContact C-N 3.35Å; V90-G92 VanDerWaalsContact C-N 3.32Å; V90-L123 HydrophobicContact CG2-CD1 3.56Å; V90-L123 HydrophobicContact CG2-CD2 3.5Å; V90-L123 VanDerWaalsContact CG2-CD2 3.5Å; V90-L123 HydrophobicContact CG2-CG 4.11Å |
| 91 | V | 75.5 | Confident | 81.7 | Confident | 123 Ų | 123 | 54.2 Ų | 54.2 | 75% | 0.745 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -78.3 | -16.6 | -177.4 | -179.6 | 0 | 0 | 0 | 0 | 112.4 | D87 D88 F89 G93 | D87-V91 WeakPolarHBondContact O-CG2 3.41Å; D87-V91 PolarHBondContact O-N 3.27Å; D88-V91 PolarHBondContact O-N 2.7Å; F89-V91 VanDerWaalsContact C-N 3.33Å; V91-G93 VanDerWaalsContact C-N 3.32Å |
| 92 | G | 70.1 | Confident | 81.6 | Confident | 69 Ų | 69 | 54.2 Ų | 54.2 | 71% | 0.711 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74 | 22.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | D88 F89 V90 | D88-G92 PolarHBondContact O-N 3.48Å; F89-G92 PolarHBondContact O-N 3.34Å; V90-G92 VanDerWaalsContact C-N 3.32Å |
| 93 | G | 62.8 | Low | 81.4 | Confident | 46 Ų | 46 | 57.7 Ų | 57.7 | 47% | 0.474 | 36% | 0.362 | S | S | . | . | trans | -83.4 | 169.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | D88 V91 S95 | D88-G93 PolarHBondContact O-N 2.91Å; V91-G93 VanDerWaalsContact C-N 3.32Å; G93-S95 PolarHBondContact O-N 2.97Å; G93-S95 VanDerWaalsContact O-N 3.13Å | ||
| 94 | V | 65.9 | Low | 81.2 | Confident | 150 Ų | 150 | 56.1 Ų | 56.1 | 91% | 0.909 | 35% | 0.353 | S | S | * | . | trans | -70.9 | 105.7 | 165.9 | 178.8 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 95 | S | 70.1 | Confident | 81.1 | Confident | 24 Ų | 24 | 57.8 Ų | 57.8 | 17% | 0.168 | 36% | 0.36 | C | S | . | . | trans | -75.5 | 141.8 | -179.4 | -173.3 | 0 | 0 | 0 | 0 | 111.8 | D88 G93 W97 | D88-S95 VanDerWaalsContact CB-CB 3.5Å; D88-S95 WeakPolarHBondContact CB-OG 3.24Å; D88-S95 VanDerWaalsContact OD2-CA 3.23Å; D88-S95 WeakPolarHBondContact OD2-CA 3.46Å; D88-S95 VanDerWaalsContact OD2-CB 3.27Å; D88-S95 WeakPolarHBondContact OD2-CB 3.13Å; D88-S95 PolarHBondContact OD2-OG 2.99Å; G93-S95 PolarHBondContact O-N 2.97Å; G93-S95 VanDerWaalsContact O-N 3.13Å; S95-W97 PolarHBondContact O-N 3.34Å; S95-W97 WeakPolarHBondContact OG-CA 3.36Å; S95-W97 PolarHBondContact OG-N 3.42Å; S95-W97 PolarHBondContact OG-O 2.94Å; S95-W97 VanDerWaalsContact OG-O 3.1Å | ||
| 96 | T | 75.8 | Confident | 80.9 | Confident | 104 Ų | 104 | 61.4 Ų | 61.4 | 64% | 0.638 | 39% | 0.385 | S | S | * | . | S | Bend | trans | -66.8 | -23.1 | 164.1 | 48.7 | 0 | 0 | 0 | 0 | 112.1 | D88 | D88-T96 PolarHBondContact OD2-N 3.35Š|
| 97 | W | 83.3 | Confident | 81.1 | Confident | 40 Ų | 40 | 60.7 Ų | 60.7 | 15% | 0.152 | 38% | 0.382 | C | S | . | . | S | Bend | trans | -130.1 | 74.3 | -178.9 | -63.9 | 107.8 | 0 | 0 | 0 | 109.9 | A54 I55 A70 F72 A81 A85 S95 L99 T101 F102 | A54-W97 HydrophobicContact CB-CH2 3.31Å; A54-W97 HydrophobicContact CB-CZ2 3.65Å; A54-W97 HydrophobicContact CB-CZ3 4.44Å; I55-W97 HydrophobicContact CD1-CZ2 4.15Å; A70-W97 HydrophobicContact CB-CH2 4.1Å; A70-W97 HydrophobicContact CB-CZ3 3.72Å; F72-W97 HydrophobicContact CE1-CH2 4.38Å; F72-W97 HydrophobicContact CZ-CH2 4.37Å; F72-W97 HydrophobicContact CZ-CZ3 4.19Å; A81-W97 HydrophobicContact CB-CD2 4.35Å; A81-W97 HydrophobicContact CB-CG 4.45Å; A85-W97 HydrophobicContact CB-CB 3.86Å; A85-W97 WeakPolarHBondContact CB-O 3.25Å; S95-W97 PolarHBondContact O-N 3.34Å; S95-W97 WeakPolarHBondContact OG-CA 3.36Å; S95-W97 PolarHBondContact OG-N 3.42Å; S95-W97 PolarHBondContact OG-O 2.94Å; S95-W97 VanDerWaalsContact OG-O 3.1Å; W97-L99 PolarHBondContact O-N 3.49Å; W97-T101 HydrophobicContact CE3-CG2 3.84Å; W97-T101 HydrophobicContact CZ3-CG2 3.99Å; W97-F102 HydrophobicContact CB-CE2 4.06Å; W97-F102 HydrophobicContact CB-CZ 4.2Å |
| 98 | P | 85.1 | Confident | 81.4 | Confident | 59 Ų | 59 | 57.3 Ų | 57.3 | 38% | 0.383 | 36% | 0.363 | S | S | . | . | trans | -51.7 | 144.2 | 174 | -24.4 | 34.1 | 0 | 0 | 0 | 110.9 | S100 T101 | P98-S100 PolarHBondContact O-N 3.08Å; P98-T101 VanDerWaalsContact O-CB 3.24Å; P98-T101 WeakPolarHBondContact O-CB 3.48Å; P98-T101 PolarHBondContact O-N 3.1Å; P98-T101 PolarHBondContact O-OG1 3.3Å | ||
| 99 | L | 86.4 | Confident | 81.7 | Confident | 28 Ų | 28 | 56.8 Ų | 56.8 | 15% | 0.147 | 36% | 0.363 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.5 | -20.7 | 178.7 | -68.3 | 177 | 0 | 0 | 0 | 113.3 | A85 L86 F89 W97 T101 F102 K108 I111 I127 | A85-L99 HydrophobicContact CB-CD2 4.23Å; L86-L99 HydrophobicContact CD2-CD2 4.45Å; F89-L99 HydrophobicContact CB-CD1 4.37Å; F89-L99 HydrophobicContact CD1-CD1 4.37Å; F89-L99 HydrophobicContact CD2-CD1 3.49Å; F89-L99 VanDerWaalsContact CD2-CD1 3.49Å; F89-L99 HydrophobicContact CD2-CG 4.25Å; F89-L99 HydrophobicContact CE2-CD1 3.75Å; F89-L99 HydrophobicContact CG-CD1 3.83Å; F89-L99 HydrophobicContact CZ-CD1 4.29Å; W97-L99 PolarHBondContact O-N 3.49Å; L99-T101 PolarHBondContact O-N 3.39Å; L99-F102 PolarHBondContact O-N 3.49Å; L99-K108 PolarHBondContact O-NZ 3.24Å; L99-I111 HydrophobicContact CD2-CD1 4.27Å; L99-I127 HydrophobicContact CD1-CD1 3.48Å; L99-I127 VanDerWaalsContact CD1-CD1 3.48Å |
| 100 | S | 85 | Confident | 82.1 | Confident | 80 Ų | 80 | 55.4 Ų | 55.4 | 56% | 0.559 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.4 | -15.8 | 173 | 59 | 0 | 0 | 0 | 0 | 114.5 | P98 F102 | P98-S100 PolarHBondContact O-N 3.08Å; S100-F102 VanDerWaalsContact C-N 3.33Å |
| 101 | T | 87 | Confident | 82.7 | Confident | 18 Ų | 18 | 51.9 Ų | 51.9 | 11% | 0.11 | 34% | 0.338 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.2 | -40.5 | 173.7 | -63.4 | 0 | 0 | 0 | 0 | 110.6 | E67 K68 A70 W97 P98 L99 V103 | E67-T101 HydrophobicContact CB-CG2 4.25Å; E67-T101 WeakPolarHBondContact CB-O 3.23Å; K68-T101 WeakPolarHBondContact CB-O 3.36Å; K68-T101 PolarHBondContact N-O 3.32Å; A70-T101 HydrophobicContact CB-CG2 4.39Å; W97-T101 HydrophobicContact CE3-CG2 3.84Å; W97-T101 HydrophobicContact CZ3-CG2 3.99Å; P98-T101 VanDerWaalsContact O-CB 3.24Å; P98-T101 WeakPolarHBondContact O-CB 3.48Å; P98-T101 PolarHBondContact O-N 3.1Å; P98-T101 PolarHBondContact O-OG1 3.3Å; L99-T101 PolarHBondContact O-N 3.39Å; T101-V103 PolarHBondContact O-N 3.07Å |
| 102 | F | 89.6 | Confident | 83.5 | Confident | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 30% | 0.303 | C | S | . | . | trans | -83.2 | 94.5 | -176.9 | -58.6 | -73.8 | 0 | 0 | 0 | 110.2 | E67 F72 A81 I82 A85 W97 L99 S100 S107 K108 I111 | E67-F102 HydrophobicContact CG-CD1 3.95Å; E67-F102 WeakPolarHBondContact OE2-CA 3.48Å; F72-F102 HydrophobicContact CZ-CE1 4.46Å; A81-F102 HydrophobicContact CB-CE1 4.21Å; A81-F102 HydrophobicContact CB-CZ 3.94Å; I82-F102 HydrophobicContact CB-CE1 4.42Å; I82-F102 HydrophobicContact CB-CZ 4.45Å; I82-F102 HydrophobicContact CD1-CD1 4.22Å; I82-F102 HydrophobicContact CD1-CE1 4.33Å; I82-F102 HydrophobicContact CG1-CD1 3.58Å; I82-F102 HydrophobicContact CG1-CE1 3.35Å; I82-F102 HydrophobicContact CG1-CE2 4.41Å; I82-F102 HydrophobicContact CG1-CG 4.21Å; I82-F102 HydrophobicContact CG1-CZ 3.82Å; A85-F102 HydrophobicContact CB-CD2 4.4Å; A85-F102 HydrophobicContact CB-CE2 3.56Å; A85-F102 HydrophobicContact CB-CZ 4.3Å; W97-F102 HydrophobicContact CB-CE2 4.06Å; W97-F102 HydrophobicContact CB-CZ 4.2Å; L99-F102 PolarHBondContact O-N 3.49Å; S100-F102 VanDerWaalsContact C-N 3.33Å; F102-S107 WeakPolarHBondContact CB-OG 3.45Å; F102-K108 WeakPolarHBondContact O-CD 3.41Å; F102-K108 WeakPolarHBondContact O-CE 3.32Å; F102-K108 PolarHBondContact O-NZ 3.16Å; F102-I111 HydrophobicContact CB-CD1 3.76Å; F102-I111 HydrophobicContact CD2-CD1 4.25Å; F102-I111 HydrophobicContact CG-CD1 4.13Å | ||
| 103 | V | 86.4 | Confident | 84.6 | Confident | 75 Ų | 75 | 47 Ų | 47 | 46% | 0.455 | 29% | 0.291 | S | S | . | . | trans | -101 | -22.3 | -173.2 | -66 | 0 | 0 | 0 | 0 | 112.5 | E67 K68 T101 | E67-V103 PolarHBondContact OE2-N 3.45Å; K68-V103 HydrophobicContact CB-CG1 3.98Å; K68-V103 HydrophobicContact CB-CG2 4.42Å; T101-V103 PolarHBondContact O-N 3.07Å | ||
| 104 | S | 85.9 | Confident | 85.9 | Confident | 27 Ų | 27 | 47.4 Ų | 47.4 | 19% | 0.189 | 28% | 0.282 | C | S | . | . | S | Bend | trans | -66.3 | 145.5 | -178.1 | 71.1 | 0 | 0 | 0 | 0 | 112.6 | E67 S106 S107 K108 | E67-S104 WeakPolarHBondContact OE1-CB 3.48Å; E67-S104 PolarHBondContact OE1-OG 3.37Å; E67-S104 PolarHBondContact OE2-N 3.37Å; E67-S104 VanDerWaalsContact OE2-N 3.1Å; S104-S106 PolarHBondContact O-N 3.42Å; S104-S107 PolarHBondContact N-OG 3.46Å; S104-S107 PolarHBondContact O-N 3.11Å; S104-S107 VanDerWaalsContact O-N 3.11Å; S104-S107 PolarHBondContact O-OG 3.17Å; S104-S107 WeakPolarHBondContact OG-CB 3.35Å; S104-S107 PolarHBondContact OG-N 2.93Å; S104-S107 PolarHBondContact OG-OG 2.8Å; S104-S107 VanDerWaalsContact OG-OG 3.05Å; S104-K108 PolarHBondContact O-N 3.11Å; S104-K108 VanDerWaalsContact O-N 3.1Å |
| 105 | Q | 84.6 | Confident | 87.2 | Confident | 85 Ų | 85 | 40.2 Ų | 40.2 | 40% | 0.397 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -58.5 | -35.9 | 174.3 | -173.6 | 179.9 | 8.4 | 0 | 0 | 112 | K108 S109 | Q105-K108 PolarHBondContact O-N 2.96Å; Q105-S109 PolarHBondContact O-N 3.17Å; Q105-S109 PolarHBondContact O-OG 3.39Å |
| 106 | S | 86.6 | Confident | 88.2 | Confident | 78 Ų | 78 | 40 Ų | 40 | 55% | 0.545 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -59.8 | -47.7 | 174.5 | -57 | 0 | 0 | 0 | 0 | 111.3 | S104 K108 S109 V110 | S104-S106 PolarHBondContact O-N 3.42Å; S106-K108 PolarHBondContact O-N 3.33Å; S106-S109 PolarHBondContact O-N 2.69Å; S106-V110 WeakPolarHBondContact O-CG2 3.48Å; S106-V110 PolarHBondContact O-N 3.11Å |
| 107 | S | 90.5 | Very high | 88.8 | Confident | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.8 | -41.2 | 178.2 | 68.4 | 0 | 0 | 0 | 0 | 112.5 | E67 F102 S104 S109 V110 I111 | E67-S107 VanDerWaalsContact OE1-CB 3.28Å; E67-S107 WeakPolarHBondContact OE1-CB 3.35Å; F102-S107 WeakPolarHBondContact CB-OG 3.45Å; S104-S107 PolarHBondContact N-OG 3.46Å; S104-S107 PolarHBondContact O-N 3.11Å; S104-S107 VanDerWaalsContact O-N 3.11Å; S104-S107 PolarHBondContact O-OG 3.17Å; S104-S107 WeakPolarHBondContact OG-CB 3.35Å; S104-S107 PolarHBondContact OG-N 2.93Å; S104-S107 PolarHBondContact OG-OG 2.8Å; S104-S107 VanDerWaalsContact OG-OG 3.05Å; S107-S109 VanDerWaalsContact C-N 3.31Å; S107-S109 PolarHBondContact O-N 3.41Å; S107-V110 PolarHBondContact O-N 2.84Å; S107-I111 WeakPolarHBondContact O-CB 3.4Å; S107-I111 VanDerWaalsContact O-CG1 3.23Å; S107-I111 WeakPolarHBondContact O-CG1 3.39Å; S107-I111 PolarHBondContact O-N 3.39Å |
| 108 | K | 91.2 | Very high | 88.7 | Confident | 16 Ų | 16 | 39.4 Ų | 39.4 | 7% | 0.07 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61 | -40.9 | 176.4 | -60.8 | -43.4 | -158.1 | -177.1 | 0 | 112.1 | L99 F102 S104 Q105 S106 L112 L131 L135 I143 | L99-K108 PolarHBondContact O-NZ 3.24Å; F102-K108 WeakPolarHBondContact O-CD 3.41Å; F102-K108 WeakPolarHBondContact O-CE 3.32Å; F102-K108 PolarHBondContact O-NZ 3.16Å; S104-K108 PolarHBondContact O-N 3.11Å; S104-K108 VanDerWaalsContact O-N 3.1Å; Q105-K108 PolarHBondContact O-N 2.96Å; S106-K108 PolarHBondContact O-N 3.33Å; K108-L112 PolarHBondContact O-N 2.97Å; K108-L131 HydrophobicContact CB-CD2 4.02Å; K108-L131 HydrophobicContact CD-CD2 3.59Å; K108-L131 HydrophobicContact CG-CD2 4.04Å; K108-L135 HydrophobicContact CG-CD2 4.29Å; K108-I143 HydrophobicContact CB-CD1 3.91Å |
| 109 | S | 90.2 | Very high | 88.5 | Confident | 33 Ų | 33 | 41.9 Ų | 41.9 | 23% | 0.231 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -65.8 | -42.6 | 177.1 | -56.1 | 0 | 0 | 0 | 0 | 111.5 | Q105 S106 S107 L112 N113 | Q105-S109 PolarHBondContact O-N 3.17Å; Q105-S109 PolarHBondContact O-OG 3.39Å; S106-S109 PolarHBondContact O-N 2.69Å; S107-S109 VanDerWaalsContact C-N 3.31Å; S107-S109 PolarHBondContact O-N 3.41Å; S109-L112 PolarHBondContact O-N 3.41Å; S109-N113 WeakPolarHBondContact O-CB 3.47Å; S109-N113 VanDerWaalsContact O-CG 3.23Å; S109-N113 PolarHBondContact O-N 2.71Å; S109-N113 PolarHBondContact O-ND2 3.36Å |
| 110 | V | 92.1 | Very high | 88.3 | Confident | 32 Ų | 32 | 43.7 Ų | 43.7 | 19% | 0.194 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -65.5 | -46.3 | 176.4 | 170 | 0 | 0 | 0 | 0 | 111.6 | W78 L79 I82 S106 S107 L112 N113 L114 | W78-V110 HydrophobicContact CH2-CB 4.33Å; W78-V110 HydrophobicContact CH2-CG2 3.75Å; W78-V110 HydrophobicContact CZ3-CG2 4.01Å; L79-V110 HydrophobicContact CD2-CG1 3.57Å; I82-V110 HydrophobicContact CD1-CB 4.36Å; I82-V110 HydrophobicContact CD1-CG1 3.92Å; I82-V110 HydrophobicContact CG2-CG1 4.37Å; S106-V110 WeakPolarHBondContact O-CG2 3.48Å; S106-V110 PolarHBondContact O-N 3.11Å; S107-V110 PolarHBondContact O-N 2.84Å; V110-L112 VanDerWaalsContact C-N 3.28Å; V110-L112 PolarHBondContact O-N 3.32Å; V110-N113 PolarHBondContact O-N 3.21Å; V110-L114 HydrophobicContact CG1-CD1 3.78Å; V110-L114 HydrophobicContact CG1-CG 4.2Å; V110-L114 WeakPolarHBondContact O-CB 3.22Å; V110-L114 WeakPolarHBondContact O-CG 3.22Å; V110-L114 PolarHBondContact O-N 3.31Å |
| 111 | I | 93.3 | Very high | 88.4 | Confident | 3 Ų | 3 | 40.9 Ų | 40.9 | 2% | 0.015 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -53.3 | -48 | 174.9 | -76.4 | 164.7 | 0 | 0 | 0 | 110.2 | I82 L86 L99 F102 S107 T115 I127 | I82-I111 HydrophobicContact CG2-CG1 3.61Å; L86-I111 HydrophobicContact CD2-CG2 4.17Å; L99-I111 HydrophobicContact CD2-CD1 4.27Å; F102-I111 HydrophobicContact CB-CD1 3.76Å; F102-I111 HydrophobicContact CD2-CD1 4.25Å; F102-I111 HydrophobicContact CG-CD1 4.13Å; S107-I111 WeakPolarHBondContact O-CB 3.4Å; S107-I111 VanDerWaalsContact O-CG1 3.23Å; S107-I111 WeakPolarHBondContact O-CG1 3.39Å; S107-I111 PolarHBondContact O-N 3.39Å; I111-T115 VanDerWaalsContact O-CB 3.3Å; I111-T115 WeakPolarHBondContact O-CB 3.43Å; I111-T115 PolarHBondContact O-N 2.79Å; I111-T115 PolarHBondContact O-OG1 2.96Å; I111-I127 HydrophobicContact CG2-CG2 3.83Å |
| 112 | L | 92.9 | Very high | 88.4 | Confident | 3 Ų | 3 | 45.8 Ų | 45.8 | 2% | 0.016 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -64.9 | -45.7 | -180 | -169.5 | 66.1 | 0 | 0 | 0 | 111.7 | K108 S109 V110 T115 T116 I127 V128 L131 I143 N147 A150 | K108-L112 PolarHBondContact O-N 2.97Å; S109-L112 PolarHBondContact O-N 3.41Å; V110-L112 VanDerWaalsContact C-N 3.28Å; V110-L112 PolarHBondContact O-N 3.32Å; L112-T115 PolarHBondContact O-N 2.65Å; L112-T116 WeakPolarHBondContact O-CG2 3.47Å; L112-T116 PolarHBondContact O-N 3.26Å; L112-T116 PolarHBondContact O-OG1 3.44Å; L112-I127 HydrophobicContact CD1-CG2 4.3Å; L112-V128 HydrophobicContact CD1-CG2 3.74Å; L112-L131 HydrophobicContact CB-CD1 4.27Å; L112-L131 HydrophobicContact CD1-CD1 4.12Å; L112-I143 HydrophobicContact CD2-CG2 3.57Å; L112-N147 HydrophobicContact CD2-CB 3.82Å; L112-N147 HydrophobicContact CG-CB 4.47Å; L112-A150 HydrophobicContact CD1-CB 3.71Å; L112-A150 HydrophobicContact CD2-CB 3.83Å; L112-A150 HydrophobicContact CG-CB 3.94Å |
| 113 | N | 91.8 | Very high | 88.3 | Confident | 85 Ų | 85 | 46.3 Ų | 46.3 | 46% | 0.455 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.6 | -46.7 | 179.8 | -72.4 | -16.1 | 0 | 0 | 0 | 112.1 | S109 V110 T115 T116 S117 N147 | S109-N113 WeakPolarHBondContact O-CB 3.47Å; S109-N113 VanDerWaalsContact O-CG 3.23Å; S109-N113 PolarHBondContact O-N 2.71Å; S109-N113 PolarHBondContact O-ND2 3.36Å; V110-N113 PolarHBondContact O-N 3.21Å; N113-T115 VanDerWaalsContact C-N 3.32Å; N113-T115 PolarHBondContact O-N 2.52Å; N113-T116 WeakPolarHBondContact CA-OG1 3.4Å; N113-T116 PolarHBondContact O-N 3.37Å; N113-T116 PolarHBondContact O-OG1 2.87Å; N113-S117 PolarHBondContact O-N 3.22Å; N113-N147 PolarHBondContact OD1-ND2 3.44Å |
| 114 | L | 90.9 | Very high | 88.7 | Confident | 55 Ų | 55 | 42.7 Ų | 42.7 | 29% | 0.288 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -59.7 | -45.1 | 174.6 | -71.8 | 175 | 0 | 0 | 0 | 110.9 | I82 L86 V110 T116 S117 T118 | I82-L114 HydrophobicContact CG2-CD1 3.73Å; L86-L114 HydrophobicContact CD1-CB 3.68Å; L86-L114 HydrophobicContact CD1-CD1 4.15Å; V110-L114 HydrophobicContact CG1-CD1 3.78Å; V110-L114 HydrophobicContact CG1-CG 4.2Å; V110-L114 WeakPolarHBondContact O-CB 3.22Å; V110-L114 WeakPolarHBondContact O-CG 3.22Å; V110-L114 PolarHBondContact O-N 3.31Å; L114-T116 PolarHBondContact O-N 3.29Å; L114-S117 WeakPolarHBondContact O-CB 3.23Å; L114-S117 PolarHBondContact O-N 3.42Å; L114-S117 VanDerWaalsContact O-N 3.13Å; L114-S117 PolarHBondContact O-OG 2.94Å; L114-T118 PolarHBondContact O-N 3.17Å |
| 115 | T | 91.8 | Very high | 89 | Confident | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -59.9 | -45.5 | 177.1 | -57.6 | 0 | 0 | 0 | 0 | 111.5 | L86 I111 L112 N113 S117 T118 L123 I124 I127 | L86-T115 WeakPolarHBondContact CD2-OG1 3.38Å; I111-T115 VanDerWaalsContact O-CB 3.3Å; I111-T115 WeakPolarHBondContact O-CB 3.43Å; I111-T115 PolarHBondContact O-N 2.79Å; I111-T115 PolarHBondContact O-OG1 2.96Å; L112-T115 PolarHBondContact O-N 2.65Å; N113-T115 VanDerWaalsContact C-N 3.32Å; N113-T115 PolarHBondContact O-N 2.52Å; T115-S117 PolarHBondContact O-N 2.9Å; T115-T118 WeakPolarHBondContact O-CB 3.42Å; T115-T118 PolarHBondContact O-N 3.03Å; T115-T118 PolarHBondContact O-OG1 3.25Å; T115-L123 HydrophobicContact CG2-CB 4.45Å; T115-L123 HydrophobicContact CG2-CD2 4.03Å; T115-L123 HydrophobicContact CG2-CG 3.75Å; T115-I124 HydrophobicContact CG2-CB 4.35Å; T115-I124 HydrophobicContact CG2-CG1 3.85Å; T115-I127 HydrophobicContact CG2-CB 4.14Å; T115-I127 HydrophobicContact CG2-CG1 3.89Å |
| 116 | T | 91.2 | Very high | 89.3 | Confident | 20 Ų | 20 | 44.4 Ų | 44.4 | 12% | 0.123 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -64.2 | -28.4 | 178 | 51.5 | 0 | 0 | 0 | 0 | 113.3 | L112 N113 L114 T118 C119 I124 N147 V149 A150 | L112-T116 WeakPolarHBondContact O-CG2 3.47Å; L112-T116 PolarHBondContact O-N 3.26Å; L112-T116 PolarHBondContact O-OG1 3.44Å; N113-T116 WeakPolarHBondContact CA-OG1 3.4Å; N113-T116 PolarHBondContact O-N 3.37Å; N113-T116 PolarHBondContact O-OG1 2.87Å; L114-T116 PolarHBondContact O-N 3.29Å; T116-T118 PolarHBondContact O-N 3.12Å; T116-C119 PolarHBondContact O-N 2.77Å; T116-I124 HydrophobicContact CG2-CD1 4.41Å; T116-I124 HydrophobicContact CG2-CG1 4.33Å; T116-I124 HydrophobicContact CG2-CG2 4.35Å; T116-N147 PolarHBondContact OG1-ND2 3.19Å; T116-V149 HydrophobicContact CG2-CB 4.11Å; T116-V149 HydrophobicContact CG2-CG1 4.02Å; T116-A150 HydrophobicContact CG2-CB 4Å |
| 117 | S | 88.5 | Confident | 89.6 | Confident | 76 Ų | 76 | 40.8 Ų | 40.8 | 53% | 0.531 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -69.1 | -18.4 | 174.8 | 80.4 | 0 | 0 | 0 | 0 | 113.7 | N113 L114 T115 C119 | N113-S117 PolarHBondContact O-N 3.22Å; L114-S117 WeakPolarHBondContact O-CB 3.23Å; L114-S117 PolarHBondContact O-N 3.42Å; L114-S117 VanDerWaalsContact O-N 3.13Å; L114-S117 PolarHBondContact O-OG 2.94Å; T115-S117 PolarHBondContact O-N 2.9Å; S117-C119 VanDerWaalsContact C-N 3.26Å; S117-C119 PolarHBondContact O-N 3.11Å |
| 118 | T | 82.7 | Confident | 89.8 | Confident | 55 Ų | 55 | 40.8 Ų | 40.8 | 34% | 0.337 | 24% | 0.237 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.6 | -19.4 | 176.9 | 70 | 0 | 0 | 0 | 0 | 113.1 | L114 T115 T116 D120 L123 | L114-T118 PolarHBondContact O-N 3.17Å; T115-T118 WeakPolarHBondContact O-CB 3.42Å; T115-T118 PolarHBondContact O-N 3.03Å; T115-T118 PolarHBondContact O-OG1 3.25Å; T116-T118 PolarHBondContact O-N 3.12Å; T118-D120 PolarHBondContact O-N 3.47Å; T118-D120 VanDerWaalsContact O-N 3.1Å; T118-D120 PolarHBondContact OG1-N 3.23Å; T118-L123 HydrophobicContact CG2-CD2 4.2Å |
| 119 | C | 80.4 | Confident | 89.8 | Confident | 111 Ų | 111 | 41.6 Ų | 41.6 | 75% | 0.75 | 24% | 0.242 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 56.5 | 14.7 | -171.5 | -57 | 0 | 0 | 0 | 0 | 114.5 | T116 S117 G121 | T116-C119 PolarHBondContact O-N 2.77Å; S117-C119 VanDerWaalsContact C-N 3.26Å; S117-C119 PolarHBondContact O-N 3.11Å; C119-G121 PolarHBondContact O-N 3.26Å |
| 120 | D | 82.7 | Confident | 89.7 | Confident | 65 Ų | 65 | 44.5 Ų | 44.5 | 35% | 0.348 | 25% | 0.252 | S | S | . | . | trans | -86.3 | 100.7 | 173.8 | -179.6 | -16.1 | 0 | 0 | 0 | 109.8 | T118 N122 L123 I124 | T118-D120 PolarHBondContact O-N 3.47Å; T118-D120 VanDerWaalsContact O-N 3.1Å; T118-D120 PolarHBondContact OG1-N 3.23Å; D120-N122 PolarHBondContact O-N 3.43Å; D120-N122 WeakPolarHBondContact OD1-CA 3.49Å; D120-N122 WeakPolarHBondContact OD1-CB 2.86Å; D120-N122 PolarHBondContact OD1-N 3.31Å; D120-L123 HydrophobicContact CB-CB 3.83Å; D120-L123 PolarHBondContact O-N 3.22Å; D120-L123 PolarHBondContact OD1-N 3.41Å; D120-I124 VanDerWaalsContact O-CG1 3.23Å; D120-I124 WeakPolarHBondContact O-CG1 3.05Å; D120-I124 PolarHBondContact O-N 3.08Å | ||
| 121 | G | 86.4 | Confident | 89.7 | Confident | 21 Ų | 21 | 43.3 Ų | 43.3 | 22% | 0.216 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -60.6 | -28.4 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | C119 T125 H153 | C119-G121 PolarHBondContact O-N 3.26Å; G121-T125 WeakPolarHBondContact O-CB 3.3Å; G121-T125 PolarHBondContact O-N 2.86Å; G121-T125 VanDerWaalsContact O-N 3.12Å; G121-T125 PolarHBondContact O-OG1 3.36Å; G121-H153 WeakPolarHBondContact CA-CE1 3.5Å |
| 122 | N | 86.3 | Confident | 89.6 | Confident | 122 Ų | 122 | 46.3 Ų | 46.3 | 65% | 0.652 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -73.8 | -44.7 | 176.6 | -71.4 | -35.3 | 0 | 0 | 0 | 110.5 | D120 T125 K126 | D120-N122 PolarHBondContact O-N 3.43Å; D120-N122 WeakPolarHBondContact OD1-CA 3.49Å; D120-N122 WeakPolarHBondContact OD1-CB 2.86Å; D120-N122 PolarHBondContact OD1-N 3.31Å; N122-T125 PolarHBondContact O-N 3.3Å; N122-K126 WeakPolarHBondContact O-CG 3.47Å; N122-K126 PolarHBondContact O-N 3.37Å |
| 123 | L | 89.3 | Confident | 89.5 | Confident | 10 Ų | 10 | 52.2 Ų | 52.2 | 5% | 0.052 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.8 | -46.2 | 176 | -177.6 | 61.9 | 0 | 0 | 0 | 111.5 | F89 V90 T115 T118 D120 T125 K126 I127 | F89-L123 HydrophobicContact CD1-CD1 3.78Å; F89-L123 HydrophobicContact CE1-CD1 4Å; V90-L123 HydrophobicContact CG2-CD1 3.56Å; V90-L123 HydrophobicContact CG2-CD2 3.5Å; V90-L123 VanDerWaalsContact CG2-CD2 3.5Å; V90-L123 HydrophobicContact CG2-CG 4.11Å; T115-L123 HydrophobicContact CG2-CB 4.45Å; T115-L123 HydrophobicContact CG2-CD2 4.03Å; T115-L123 HydrophobicContact CG2-CG 3.75Å; T118-L123 HydrophobicContact CG2-CD2 4.2Å; D120-L123 HydrophobicContact CB-CB 3.83Å; D120-L123 PolarHBondContact O-N 3.22Å; D120-L123 PolarHBondContact OD1-N 3.41Å; L123-T125 VanDerWaalsContact C-N 3.29Å; L123-T125 PolarHBondContact O-N 2.97Å; L123-K126 PolarHBondContact O-N 3.03Å; L123-K126 VanDerWaalsContact O-N 3.17Å; L123-I127 HydrophobicContact CD1-CG1 4.18Å; L123-I127 HydrophobicContact CG-CG1 4.45Å; L123-I127 WeakPolarHBondContact O-CG1 3.46Å; L123-I127 PolarHBondContact O-N 3.05Å |
| 124 | I | 92.9 | Very high | 89.2 | Confident | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -54.4 | -49 | 175.6 | -65.7 | 162.9 | 0 | 0 | 0 | 109.9 | T115 T116 D120 K126 I127 V128 V149 A150 H153 | T115-I124 HydrophobicContact CG2-CB 4.35Å; T115-I124 HydrophobicContact CG2-CG1 3.85Å; T116-I124 HydrophobicContact CG2-CD1 4.41Å; T116-I124 HydrophobicContact CG2-CG1 4.33Å; T116-I124 HydrophobicContact CG2-CG2 4.35Å; D120-I124 VanDerWaalsContact O-CG1 3.23Å; D120-I124 WeakPolarHBondContact O-CG1 3.05Å; D120-I124 PolarHBondContact O-N 3.08Å; I124-K126 PolarHBondContact O-N 2.88Å; I124-I127 PolarHBondContact O-N 2.87Å; I124-V128 HydrophobicContact CG2-CG2 4.27Å; I124-V128 WeakPolarHBondContact O-CB 3.1Å; I124-V128 VanDerWaalsContact O-CG2 3.23Å; I124-V128 WeakPolarHBondContact O-CG2 2.99Å; I124-V128 PolarHBondContact O-N 3.35Å; I124-V149 HydrophobicContact CD1-CG1 4.39Å; I124-A150 HydrophobicContact CG2-CB 4.45Å; I124-H153 HydrophobicContact CB-CB 4.44Å; I124-H153 HydrophobicContact CG2-CB 3.66Å |
| 125 | T | 92.3 | Very high | 89.1 | Confident | 25 Ų | 25 | 50.8 Ų | 50.8 | 15% | 0.153 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -62 | -41.4 | 179.8 | -57.5 | 0 | 0 | 0 | 0 | 112.4 | G121 N122 L123 N129 F157 | G121-T125 WeakPolarHBondContact O-CB 3.3Å; G121-T125 PolarHBondContact O-N 2.86Å; G121-T125 VanDerWaalsContact O-N 3.12Å; G121-T125 PolarHBondContact O-OG1 3.36Å; N122-T125 PolarHBondContact O-N 3.3Å; L123-T125 VanDerWaalsContact C-N 3.29Å; L123-T125 PolarHBondContact O-N 2.97Å; T125-N129 WeakPolarHBondContact O-CB 3.49Å; T125-N129 PolarHBondContact O-N 2.81Å; T125-N129 PolarHBondContact O-ND2 2.88Å; T125-F157 HydrophobicContact CG2-CB 3.7Å; T125-F157 HydrophobicContact CG2-CD2 3.47Å; T125-F157 VanDerWaalsContact CG2-CD2 3.47Å; T125-F157 HydrophobicContact CG2-CE2 4.22Å; T125-F157 HydrophobicContact CG2-CG 3.64Å |
| 126 | K | 91.5 | Very high | 89 | Confident | 122 Ų | 122 | 53.6 Ų | 53.6 | 53% | 0.53 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -62.2 | -51 | 176.5 | -74.3 | 175.7 | -178.9 | 178.2 | 0 | 111.5 | F89 N122 L123 I124 V128 N129 E130 | F89-K126 HydrophobicContact CE1-CB 3.95Å; F89-K126 HydrophobicContact CE1-CD 4.34Å; F89-K126 HydrophobicContact CZ-CB 4.2Å; N122-K126 WeakPolarHBondContact O-CG 3.47Å; N122-K126 PolarHBondContact O-N 3.37Å; L123-K126 PolarHBondContact O-N 3.03Å; L123-K126 VanDerWaalsContact O-N 3.17Å; I124-K126 PolarHBondContact O-N 2.88Å; K126-V128 PolarHBondContact O-N 3.27Å; K126-N129 PolarHBondContact O-N 3.21Å; K126-E130 WeakPolarHBondContact O-CG 3.44Å; K126-E130 PolarHBondContact O-N 3.1Å |
| 127 | I | 93 | Very high | 88.9 | Confident | 2 Ų | 2 | 57.4 Ų | 57.4 | 1% | 0.01 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -62.6 | -42.9 | -179.6 | -67.8 | -64.1 | 0 | 0 | 0 | 111.2 | L86 F89 L99 I111 L112 T115 L123 I124 N129 E130 L131 | L86-I127 HydrophobicContact CD2-CD1 3.96Å; L86-I127 HydrophobicContact CD2-CG1 4.38Å; F89-I127 HydrophobicContact CD1-CD1 3.79Å; F89-I127 HydrophobicContact CE1-CD1 3.66Å; F89-I127 HydrophobicContact CE1-CG1 4.23Å; F89-I127 HydrophobicContact CG-CD1 4.41Å; F89-I127 HydrophobicContact CZ-CD1 4.19Å; L99-I127 HydrophobicContact CD1-CD1 3.48Å; L99-I127 VanDerWaalsContact CD1-CD1 3.48Å; I111-I127 HydrophobicContact CG2-CG2 3.83Å; L112-I127 HydrophobicContact CD1-CG2 4.3Å; T115-I127 HydrophobicContact CG2-CB 4.14Å; T115-I127 HydrophobicContact CG2-CG1 3.89Å; L123-I127 HydrophobicContact CD1-CG1 4.18Å; L123-I127 HydrophobicContact CG-CG1 4.45Å; L123-I127 WeakPolarHBondContact O-CG1 3.46Å; L123-I127 PolarHBondContact O-N 3.05Å; I124-I127 PolarHBondContact O-N 2.87Å; I127-N129 VanDerWaalsContact C-N 3.3Å; I127-N129 PolarHBondContact O-N 3.27Å; I127-E130 PolarHBondContact O-N 2.72Å; I127-L131 HydrophobicContact CG2-CD1 4.25Å; I127-L131 HydrophobicContact CG2-CG 4.39Å; I127-L131 WeakPolarHBondContact O-CG 2.97Å; I127-L131 PolarHBondContact O-N 3.37Å |
| 128 | V | 93.8 | Very high | 88.9 | Confident | 1 Ų | 1 | 57 Ų | 57 | 1% | 0.006 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -60.1 | -42.1 | 176.4 | 172.6 | 0 | 0 | 0 | 0 | 111.3 | L112 I124 K126 L131 R132 F140 L144 A150 F154 | L112-V128 HydrophobicContact CD1-CG2 3.74Å; I124-V128 HydrophobicContact CG2-CG2 4.27Å; I124-V128 WeakPolarHBondContact O-CB 3.1Å; I124-V128 VanDerWaalsContact O-CG2 3.23Å; I124-V128 WeakPolarHBondContact O-CG2 2.99Å; I124-V128 PolarHBondContact O-N 3.35Å; K126-V128 PolarHBondContact O-N 3.27Å; V128-L131 PolarHBondContact O-N 3.32Å; V128-R132 WeakPolarHBondContact O-CB 3.39Å; V128-R132 PolarHBondContact O-N 3.32Å; V128-F140 HydrophobicContact CG1-CE2 3.84Å; V128-F140 HydrophobicContact CG1-CZ 3.74Å; V128-F140 WeakPolarHBondContact O-CE2 3.5Å; V128-L144 HydrophobicContact CG1-CD1 4.34Å; V128-A150 HydrophobicContact CG2-CB 3.93Å; V128-F154 HydrophobicContact CG1-CB 3.91Å; V128-F154 HydrophobicContact CG1-CD2 3.49Å; V128-F154 VanDerWaalsContact CG1-CD2 3.49Å; V128-F154 HydrophobicContact CG1-CE2 4.21Å; V128-F154 HydrophobicContact CG1-CG 3.79Å |
| 129 | N | 91.2 | Very high | 89.2 | Confident | 32 Ų | 32 | 56.2 Ų | 56.2 | 17% | 0.171 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -66.5 | -38.8 | 175.9 | -79.2 | -33.2 | 0 | 0 | 0 | 112.7 | T125 K126 I127 R132 N133 F157 | T125-N129 WeakPolarHBondContact O-CB 3.49Å; T125-N129 PolarHBondContact O-N 2.81Å; T125-N129 PolarHBondContact O-ND2 2.88Å; K126-N129 PolarHBondContact O-N 3.21Å; I127-N129 VanDerWaalsContact C-N 3.3Å; I127-N129 PolarHBondContact O-N 3.27Å; N129-R132 WeakPolarHBondContact O-CB 3.48Å; N129-R132 PolarHBondContact O-N 3.42Å; N129-N133 VanDerWaalsContact O-CG 3.22Å; N129-N133 PolarHBondContact O-N 2.92Å; N129-N133 PolarHBondContact O-ND2 3.09Å; N129-F157 WeakPolarHBondContact ND2-CE1 3.38Å; N129-F157 VanDerWaalsContact ND2-CZ 3.28Å; N129-F157 WeakPolarHBondContact ND2-CZ 3.48Å; N129-F157 WeakPolarHBondContact OD1-CE1 3.36Å |
| 130 | E | 90 | Very high | 89.8 | Confident | 94 Ų | 94 | 51.1 Ų | 51.1 | 44% | 0.439 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.8 | -42.2 | 173.4 | -73.4 | -59.6 | 137.4 | 0 | 0 | 112.1 | F89 K126 I127 N133 S134 | F89-E130 HydrophobicContact CE2-CG 4.29Å; F89-E130 HydrophobicContact CZ-CG 4.06Å; K126-E130 WeakPolarHBondContact O-CG 3.44Å; K126-E130 PolarHBondContact O-N 3.1Å; I127-E130 PolarHBondContact O-N 2.72Å; E130-N133 PolarHBondContact O-N 2.68Å; E130-S134 WeakPolarHBondContact O-CB 3.41Å; E130-S134 PolarHBondContact O-N 3.47Å; E130-S134 VanDerWaalsContact O-N 3.1Å; E130-S134 PolarHBondContact O-OG 3.47Å |
| 131 | L | 91.9 | Very high | 90.2 | Very high | 7 Ų | 7 | 49.5 Ų | 49.5 | 4% | 0.037 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65.1 | -42.3 | 174.6 | -67 | -179.5 | 0 | 0 | 0 | 111.6 | K108 L112 I127 V128 N133 S134 L135 F140 | K108-L131 HydrophobicContact CB-CD2 4.02Å; K108-L131 HydrophobicContact CD-CD2 3.59Å; K108-L131 HydrophobicContact CG-CD2 4.04Å; L112-L131 HydrophobicContact CB-CD1 4.27Å; L112-L131 HydrophobicContact CD1-CD1 4.12Å; I127-L131 HydrophobicContact CG2-CD1 4.25Å; I127-L131 HydrophobicContact CG2-CG 4.39Å; I127-L131 WeakPolarHBondContact O-CG 2.97Å; I127-L131 PolarHBondContact O-N 3.37Å; V128-L131 PolarHBondContact O-N 3.32Å; L131-N133 VanDerWaalsContact C-N 3.26Å; L131-N133 PolarHBondContact O-N 3.22Å; L131-S134 PolarHBondContact O-N 2.94Å; L131-S134 PolarHBondContact O-OG 2.89Å; L131-L135 HydrophobicContact CB-CD1 4.12Å; L131-L135 HydrophobicContact CD2-CD1 4.29Å; L131-L135 VanDerWaalsContact O-CB 3.28Å; L131-L135 WeakPolarHBondContact O-CB 3.45Å; L131-L135 VanDerWaalsContact O-CG 3.26Å; L131-L135 WeakPolarHBondContact O-CG 3.32Å; L131-L135 PolarHBondContact O-N 3.4Å; L131-F140 HydrophobicContact CB-CD2 4.21Å; L131-F140 HydrophobicContact CB-CE2 4.35Å |
| 132 | R | 91.4 | Very high | 90.3 | Very high | 67 Ų | 67 | 52.5 Ų | 52.5 | 25% | 0.253 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -57.4 | -40.4 | 176 | -174.7 | -173.4 | 179 | -168.8 | 0.5 | 111.9 | V128 N129 F140 D166 | V128-R132 WeakPolarHBondContact O-CB 3.39Å; V128-R132 PolarHBondContact O-N 3.32Å; N129-R132 WeakPolarHBondContact O-CB 3.48Å; N129-R132 PolarHBondContact O-N 3.42Å; R132-F140 HydrophobicContact CB-CD1 4.48Å; R132-F140 HydrophobicContact CB-CD2 4.03Å; R132-F140 HydrophobicContact CB-CE1 4.21Å; R132-F140 HydrophobicContact CB-CE2 3.73Å; R132-F140 HydrophobicContact CB-CG 4.4Å; R132-F140 HydrophobicContact CB-CZ 3.82Å; R132-F140 HydrophobicContact CG-CD1 4.31Å; R132-F140 HydrophobicContact CG-CE1 4.1Å; R132-F140 HydrophobicContact CG-CE2 4.49Å; R132-F140 HydrophobicContact CG-CZ 4.2Å; R132-D166 IonicContact CZ-OD2 3.39Å; R132-D166 IonicContact NH1-OD2 2.72Å; R132-D166 IonicContact NH2-OD2 2.78Å; R132-D166 PolarHBondContact NH2-OD2 2.88Å |
| 133 | N | 89.2 | Confident | 90.4 | Very high | 126 Ų | 126 | 47 Ų | 47 | 67% | 0.674 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -78.5 | -24.6 | -177.4 | -67.9 | -23.1 | 0 | 0 | 0 | 113.5 | N129 E130 L131 | N129-N133 VanDerWaalsContact O-CG 3.22Å; N129-N133 PolarHBondContact O-N 2.92Å; N129-N133 PolarHBondContact O-ND2 3.09Å; E130-N133 PolarHBondContact O-N 2.68Å; L131-N133 VanDerWaalsContact C-N 3.26Å; L131-N133 PolarHBondContact O-N 3.22Å |
| 134 | S | 86.4 | Confident | 90.5 | Very high | 71 Ų | 71 | 46.7 Ų | 46.7 | 50% | 0.497 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -100.2 | -15.2 | -174.7 | 55.9 | 0 | 0 | 0 | 0 | 114.5 | E130 L131 | E130-S134 WeakPolarHBondContact O-CB 3.41Å; E130-S134 PolarHBondContact O-N 3.47Å; E130-S134 VanDerWaalsContact O-N 3.1Å; E130-S134 PolarHBondContact O-OG 3.47Å; L131-S134 PolarHBondContact O-N 2.94Å; L131-S134 PolarHBondContact O-OG 2.89Å |
| 135 | L | 88.1 | Confident | 90.2 | Very high | 39 Ų | 39 | 50.5 Ų | 50.5 | 20% | 0.204 | 27% | 0.269 | C | S | . | . | S | Bend | trans | -110.6 | 157 | -175.3 | -60.9 | 176.5 | 0 | 0 | 0 | 112 | K108 L131 T139 F140 I143 | K108-L135 HydrophobicContact CG-CD2 4.29Å; L131-L135 HydrophobicContact CB-CD1 4.12Å; L131-L135 HydrophobicContact CD2-CD1 4.29Å; L131-L135 VanDerWaalsContact O-CB 3.28Å; L131-L135 WeakPolarHBondContact O-CB 3.45Å; L131-L135 VanDerWaalsContact O-CG 3.26Å; L131-L135 WeakPolarHBondContact O-CG 3.32Å; L131-L135 PolarHBondContact O-N 3.4Å; L135-T139 HydrophobicContact CD1-CG2 4.26Å; L135-T139 HydrophobicContact CD2-CG2 4.28Å; L135-F140 HydrophobicContact CB-CB 4.31Å; L135-I143 HydrophobicContact CD1-CD1 3.62Å |
| 136 | S | 89.3 | Confident | 90 | Very high | 60 Ų | 60 | 57.1 Ų | 57.1 | 42% | 0.42 | 30% | 0.296 | S | S | . | . | trans | -63.5 | 152.1 | 165 | 70.2 | 0 | 0 | 0 | 0 | 110.1 | S138 T139 F140 | S136-S138 VanDerWaalsContact C-N 3.3Å; S136-S138 PolarHBondContact O-N 2.83Å; S136-S138 PolarHBondContact OG-OG 2.84Å; S136-T139 PolarHBondContact O-N 3.4Å; S136-T139 VanDerWaalsContact O-N 3.09Å; S136-T139 WeakPolarHBondContact OG-CB 3.36Å; S136-T139 PolarHBondContact OG-N 3.07Å; S136-T139 PolarHBondContact OG-OG1 2.73Å; S136-F140 PolarHBondContact O-N 3.46Å | ||
| 137 | E | 89.9 | Confident | 89.8 | Confident | 99 Ų | 99 | 51.9 Ų | 51.9 | 46% | 0.463 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -58 | -42.8 | -175.6 | -170.7 | 167.9 | -127.2 | 0 | 0 | 112.4 | T139 F140 E141 R169 | E137-T139 PolarHBondContact O-N 3.35Å; E137-F140 PolarHBondContact O-N 2.85Å; E137-E141 WeakPolarHBondContact O-CB 3.29Å; E137-E141 VanDerWaalsContact O-CG 3.23Å; E137-E141 WeakPolarHBondContact O-CG 3.48Å; E137-E141 PolarHBondContact O-N 3.12Å; E137-R169 IonicContact OE1-CZ 2.68Å; E137-R169 IonicContact OE1-NH1 3.75Å; E137-R169 PolarHBondContact OE1-NH1 2.97Å; E137-R169 IonicContact OE1-NH2 3.48Å; E137-R169 PolarHBondContact OE1-NH2 3.02Å; E137-R169 VanDerWaalsContact OE1-NH2 3.16Å; E137-R169 IonicContact OE2-CZ 3.04Å; E137-R169 IonicContact OE2-NH1 3.97Å; E137-R169 PolarHBondContact OE2-NH1 3.3Å; E137-R169 VanDerWaalsContact OE2-NH1 3.15Å; E137-R169 IonicContact OE2-NH2 3.57Å; E137-R169 PolarHBondContact OE2-NH2 3.4Å |
| 138 | S | 89.5 | Confident | 89.6 | Confident | 69 Ų | 69 | 55.4 Ų | 55.4 | 48% | 0.483 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.8 | -39.9 | 176.3 | 55.1 | 0 | 0 | 0 | 0 | 112.8 | S136 N142 | S136-S138 VanDerWaalsContact C-N 3.3Å; S136-S138 PolarHBondContact O-N 2.83Å; S136-S138 PolarHBondContact OG-OG 2.84Å; S138-N142 WeakPolarHBondContact O-CB 3.32Å; S138-N142 VanDerWaalsContact O-CG 3.29Å; S138-N142 PolarHBondContact O-N 3.03Å; S138-N142 PolarHBondContact O-ND2 3.13Å |
| 139 | T | 88.2 | Confident | 89.3 | Confident | 37 Ų | 37 | 58.4 Ų | 58.4 | 23% | 0.227 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -68.5 | -43.8 | 178.6 | -54.7 | 0 | 0 | 0 | 0 | 110.9 | L135 S136 E137 N142 I143 | L135-T139 HydrophobicContact CD1-CG2 4.26Å; L135-T139 HydrophobicContact CD2-CG2 4.28Å; S136-T139 PolarHBondContact O-N 3.4Å; S136-T139 VanDerWaalsContact O-N 3.09Å; S136-T139 WeakPolarHBondContact OG-CB 3.36Å; S136-T139 PolarHBondContact OG-N 3.07Å; S136-T139 PolarHBondContact OG-OG1 2.73Å; E137-T139 PolarHBondContact O-N 3.35Å; T139-N142 PolarHBondContact O-N 3Å; T139-I143 HydrophobicContact CG2-CD1 4.13Å; T139-I143 WeakPolarHBondContact O-CG1 3.23Å; T139-I143 PolarHBondContact O-N 3.1Å |
| 140 | F | 92.4 | Very high | 89.3 | Confident | 4 Ų | 4 | 56.9 Ų | 56.9 | 2% | 0.018 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.7 | -47.1 | 175.6 | 175.9 | -106.8 | 0 | 0 | 0 | 111.6 | V128 L131 R132 L135 S136 E137 N142 I143 L144 F154 Y170 | V128-F140 HydrophobicContact CG1-CE2 3.84Å; V128-F140 HydrophobicContact CG1-CZ 3.74Å; V128-F140 WeakPolarHBondContact O-CE2 3.5Å; L131-F140 HydrophobicContact CB-CD2 4.21Å; L131-F140 HydrophobicContact CB-CE2 4.35Å; R132-F140 HydrophobicContact CB-CD1 4.48Å; R132-F140 HydrophobicContact CB-CD2 4.03Å; R132-F140 HydrophobicContact CB-CE1 4.21Å; R132-F140 HydrophobicContact CB-CE2 3.73Å; R132-F140 HydrophobicContact CB-CG 4.4Å; R132-F140 HydrophobicContact CB-CZ 3.82Å; R132-F140 HydrophobicContact CG-CD1 4.31Å; R132-F140 HydrophobicContact CG-CE1 4.1Å; R132-F140 HydrophobicContact CG-CE2 4.49Å; R132-F140 HydrophobicContact CG-CZ 4.2Å; L135-F140 HydrophobicContact CB-CB 4.31Å; S136-F140 PolarHBondContact O-N 3.46Å; E137-F140 PolarHBondContact O-N 2.85Å; F140-N142 PolarHBondContact O-N 3.12Å; F140-I143 PolarHBondContact O-N 2.88Å; F140-L144 HydrophobicContact CE1-CD2 4.2Å; F140-L144 HydrophobicContact CZ-CD1 4.45Å; F140-L144 HydrophobicContact CZ-CD2 4.29Å; F140-L144 WeakPolarHBondContact O-CB 3.26Å; F140-L144 PolarHBondContact O-N 3.37Å; F140-F154 HydrophobicContact CE1-CD1 4.48Å; F140-F154 AromaticContact CE1-CE1 3.87Å; F140-F154 HydrophobicContact CE1-CE1 3.87Å; F140-F154 AromaticContact CE1-CZ 3.99Å; F140-F154 HydrophobicContact CE1-CZ 3.99Å; F140-F154 HydrophobicContact CZ-CD1 4.35Å; F140-F154 HydrophobicContact CZ-CE1 4.05Å; F140-F154 HydrophobicContact CZ-CE2 4.26Å; F140-F154 HydrophobicContact CZ-CZ 4.02Å; F140-Y170 HydrophobicContact CD1-CE1 4.1Å; F140-Y170 WeakPolarHBondContact CD1-OH 3.44Å; F140-Y170 AromaticContact CE1-CE1 3.81Å; F140-Y170 HydrophobicContact CE1-CE1 3.81Å; F140-Y170 AromaticContact CE1-CZ 3.79Å; F140-Y170 WeakPolarHBondContact CE1-OH 3.18Å |
| 141 | E | 90.7 | Very high | 89.3 | Confident | 31 Ų | 31 | 52.5 Ų | 52.5 | 15% | 0.145 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -57.2 | -46.2 | 176.4 | -77 | -177.9 | 172.7 | 0 | 0 | 112 | E137 I143 L144 L145 R169 Y170 L173 | E137-E141 WeakPolarHBondContact O-CB 3.29Å; E137-E141 VanDerWaalsContact O-CG 3.23Å; E137-E141 WeakPolarHBondContact O-CG 3.48Å; E137-E141 PolarHBondContact O-N 3.12Å; E141-I143 PolarHBondContact O-N 3.39Å; E141-L144 PolarHBondContact O-N 3.4Å; E141-L145 WeakPolarHBondContact O-CB 3.39Å; E141-L145 WeakPolarHBondContact O-CG 3.15Å; E141-L145 PolarHBondContact O-N 2.74Å; E141-R169 IonicContact OE1-CZ 2.66Å; E141-R169 VanDerWaalsContact OE1-CZ 3.32Å; E141-R169 IonicContact OE1-NE 3.79Å; E141-R169 PolarHBondContact OE1-NE 3.19Å; E141-R169 IonicContact OE1-NH2 2.69Å; E141-R169 PolarHBondContact OE1-NH2 2.82Å; E141-Y170 HydrophobicContact CG-CE1 3.87Å; E141-L173 HydrophobicContact CB-CD2 3.75Å; E141-L173 HydrophobicContact CG-CD2 3.47Å; E141-L173 VanDerWaalsContact CG-CD2 3.47Å |
| 142 | N | 89 | Confident | 89.1 | Confident | 85 Ų | 85 | 57.5 Ų | 57.5 | 46% | 0.455 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -63.6 | -38.6 | 178 | -78.1 | -31 | 0 | 0 | 0 | 113.4 | S138 T139 F140 K146 | S138-N142 WeakPolarHBondContact O-CB 3.32Å; S138-N142 VanDerWaalsContact O-CG 3.29Å; S138-N142 PolarHBondContact O-N 3.03Å; S138-N142 PolarHBondContact O-ND2 3.13Å; T139-N142 PolarHBondContact O-N 3Å; F140-N142 PolarHBondContact O-N 3.12Å; N142-K146 WeakPolarHBondContact O-CG 3.45Å |
| 143 | I | 89.2 | Confident | 89 | Confident | 7 Ų | 7 | 57 Ų | 57 | 4% | 0.036 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -68.7 | -43 | 176.1 | -71.3 | 171.5 | 0 | 0 | 0 | 110.2 | K108 L112 L135 T139 F140 E141 K146 | K108-I143 HydrophobicContact CB-CD1 3.91Å; L112-I143 HydrophobicContact CD2-CG2 3.57Å; L135-I143 HydrophobicContact CD1-CD1 3.62Å; T139-I143 HydrophobicContact CG2-CD1 4.13Å; T139-I143 WeakPolarHBondContact O-CG1 3.23Å; T139-I143 PolarHBondContact O-N 3.1Å; F140-I143 PolarHBondContact O-N 2.88Å; E141-I143 PolarHBondContact O-N 3.39Å; I143-K146 PolarHBondContact O-N 3.14Å |
| 144 | L | 90.6 | Very high | 89.1 | Confident | 3 Ų | 3 | 51 Ų | 51 | 2% | 0.016 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -65.6 | -40.7 | -178.9 | -162.8 | 69.6 | 0 | 0 | 0 | 112 | V128 F140 E141 K146 N147 A150 A151 F154 Y170 | V128-L144 HydrophobicContact CG1-CD1 4.34Å; F140-L144 HydrophobicContact CE1-CD2 4.2Å; F140-L144 HydrophobicContact CZ-CD1 4.45Å; F140-L144 HydrophobicContact CZ-CD2 4.29Å; F140-L144 WeakPolarHBondContact O-CB 3.26Å; F140-L144 PolarHBondContact O-N 3.37Å; E141-L144 PolarHBondContact O-N 3.4Å; L144-K146 PolarHBondContact O-N 2.89Å; L144-N147 CarbonylContact O-C 3.44Å; L144-N147 PolarHBondContact O-N 3.07Å; L144-N147 VanDerWaalsContact O-N 3.09Å; L144-N147 VanDerWaalsContact O-O 3.09Å; L144-A150 HydrophobicContact CD1-CB 4.24Å; L144-A151 HydrophobicContact CD1-CB 4.13Å; L144-A151 HydrophobicContact CD2-CB 4.45Å; L144-A151 HydrophobicContact CG-CB 3.86Å; L144-F154 HydrophobicContact CD1-CB 4.41Å; L144-F154 HydrophobicContact CD2-CD1 3.7Å; L144-F154 HydrophobicContact CD2-CE1 4.27Å; L144-F154 HydrophobicContact CD2-CG 4.46Å; L144-Y170 HydrophobicContact CD2-CD1 3.92Å; L144-Y170 HydrophobicContact CD2-CE1 4.17Å |
| 145 | L | 86.9 | Confident | 89.3 | Confident | 80 Ų | 80 | 48.3 Ų | 48.3 | 42% | 0.419 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -60.2 | -29.5 | 176.7 | -80.7 | 164.6 | 0 | 0 | 0 | 113.1 | E141 L173 L174 | E141-L145 WeakPolarHBondContact O-CB 3.39Å; E141-L145 WeakPolarHBondContact O-CG 3.15Å; E141-L145 PolarHBondContact O-N 2.74Å; L145-L173 HydrophobicContact CD1-CD1 4.26Å; L145-L173 HydrophobicContact CD1-CD2 4.48Å; L145-L173 HydrophobicContact CD1-CG 4.28Å; L145-L173 HydrophobicContact CD2-CG 4.37Å; L145-L173 HydrophobicContact CG-CG 4.45Å; L145-L174 HydrophobicContact CD2-CD2 3.87Å; L145-L174 HydrophobicContact CG-CD2 4.42Å |
| 146 | K | 87.8 | Confident | 89.2 | Confident | 163 Ų | 163 | 49.2 Ų | 49.2 | 71% | 0.709 | 26% | 0.264 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.5 | -11.4 | 178.7 | -68.8 | 177.1 | -178.2 | -176.9 | 0 | 113.5 | N142 I143 L144 | N142-K146 WeakPolarHBondContact O-CG 3.45Å; I143-K146 PolarHBondContact O-N 3.14Å; L144-K146 PolarHBondContact O-N 2.89Å |
| 147 | N | 88.2 | Confident | 89.2 | Confident | 12 Ų | 12 | 48.8 Ų | 48.8 | 6% | 0.064 | 25% | 0.254 | C | S | . | . | trans | -132.2 | 93.7 | -178.8 | -170 | -46.3 | 0 | 0 | 0 | 110.8 | L112 N113 T116 L144 V149 A150 A151 | L112-N147 HydrophobicContact CD2-CB 3.82Å; L112-N147 HydrophobicContact CG-CB 4.47Å; N113-N147 PolarHBondContact OD1-ND2 3.44Å; T116-N147 PolarHBondContact OG1-ND2 3.19Å; L144-N147 CarbonylContact O-C 3.44Å; L144-N147 PolarHBondContact O-N 3.07Å; L144-N147 VanDerWaalsContact O-N 3.09Å; L144-N147 VanDerWaalsContact O-O 3.09Å; N147-V149 VanDerWaalsContact C-N 3.32Å; N147-V149 PolarHBondContact O-N 2.95Å; N147-V149 PolarHBondContact OD1-N 3.02Å; N147-A150 HydrophobicContact CB-CB 4.16Å; N147-A150 PolarHBondContact O-N 3.29Å; N147-A150 WeakPolarHBondContact OD1-CB 3.34Å; N147-A150 PolarHBondContact OD1-N 3.43Å; N147-A151 PolarHBondContact O-N 3.45Å | ||
| 148 | S | 87.1 | Confident | 89.1 | Confident | 76 Ų | 76 | 44.1 Ų | 44.1 | 53% | 0.531 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -60.5 | -38.3 | -177.2 | 57.4 | 0 | 0 | 0 | 0 | 113 | A151 F152 | S148-A151 WeakPolarHBondContact O-CB 3.25Å; S148-A151 PolarHBondContact O-N 3.27Å; S148-F152 WeakPolarHBondContact O-CD2 3.33Å; S148-F152 PolarHBondContact O-N 2.97Å |
| 149 | V | 87.6 | Confident | 88.9 | Confident | 64 Ų | 64 | 48 Ų | 48 | 39% | 0.388 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.2 | -51.3 | 179.5 | 178.3 | 0 | 0 | 0 | 0 | 110.4 | T116 I124 N147 A151 F152 H153 | T116-V149 HydrophobicContact CG2-CB 4.11Å; T116-V149 HydrophobicContact CG2-CG1 4.02Å; I124-V149 HydrophobicContact CD1-CG1 4.39Å; N147-V149 VanDerWaalsContact C-N 3.32Å; N147-V149 PolarHBondContact O-N 2.95Å; N147-V149 PolarHBondContact OD1-N 3.02Å; V149-A151 VanDerWaalsContact C-N 3.29Å; V149-A151 PolarHBondContact O-N 3.39Å; V149-F152 PolarHBondContact O-N 2.98Å; V149-H153 PolarHBondContact O-CD2 3.43Å; V149-H153 VanDerWaalsContact O-CD2 3.28Å; V149-H153 PolarHBondContact O-N 3.15Å; V149-H153 VanDerWaalsContact O-N 3.1Å |
| 150 | A | 92 | Very high | 88.6 | Confident | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59.3 | -41.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | L112 T116 I124 V128 L144 N147 F152 H153 F154 | L112-A150 HydrophobicContact CD1-CB 3.71Å; L112-A150 HydrophobicContact CD2-CB 3.83Å; L112-A150 HydrophobicContact CG-CB 3.94Å; T116-A150 HydrophobicContact CG2-CB 4Å; I124-A150 HydrophobicContact CG2-CB 4.45Å; V128-A150 HydrophobicContact CG2-CB 3.93Å; L144-A150 HydrophobicContact CD1-CB 4.24Å; N147-A150 HydrophobicContact CB-CB 4.16Å; N147-A150 PolarHBondContact O-N 3.29Å; N147-A150 WeakPolarHBondContact OD1-CB 3.34Å; N147-A150 PolarHBondContact OD1-N 3.43Å; A150-F152 PolarHBondContact O-N 3.46Å; A150-H153 PolarHBondContact O-N 2.78Å; A150-F154 WeakPolarHBondContact O-CB 3.21Å; A150-F154 PolarHBondContact O-N 3.4Å |
| 151 | A | 90.7 | Very high | 88.3 | Confident | 3 Ų | 3 | 55 Ų | 55 | 3% | 0.025 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -58.2 | -45.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L144 N147 S148 V149 F154 L155 L174 | L144-A151 HydrophobicContact CD1-CB 4.13Å; L144-A151 HydrophobicContact CD2-CB 4.45Å; L144-A151 HydrophobicContact CG-CB 3.86Å; N147-A151 PolarHBondContact O-N 3.45Å; S148-A151 WeakPolarHBondContact O-CB 3.25Å; S148-A151 PolarHBondContact O-N 3.27Å; V149-A151 VanDerWaalsContact C-N 3.29Å; V149-A151 PolarHBondContact O-N 3.39Å; A151-F154 WeakPolarHBondContact O-CB 3.35Å; A151-F154 PolarHBondContact O-N 2.96Å; A151-L155 WeakPolarHBondContact O-CG 3.4Å; A151-L155 PolarHBondContact O-N 3.39Å; A151-L174 HydrophobicContact CB-CD1 3.79Å; A151-L174 HydrophobicContact CB-CD2 3.77Å; A151-L174 HydrophobicContact CB-CG 4.46Å |
| 152 | F | 87.7 | Confident | 87.9 | Confident | 112 Ų | 112 | 55.9 Ų | 55.9 | 49% | 0.491 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -64.4 | -43.4 | 177.6 | -75.3 | -63.5 | 0 | 0 | 0 | 113.1 | S148 V149 A150 F154 L155 N156 F176 | S148-F152 WeakPolarHBondContact O-CD2 3.33Å; S148-F152 PolarHBondContact O-N 2.97Å; V149-F152 PolarHBondContact O-N 2.98Å; A150-F152 PolarHBondContact O-N 3.46Å; F152-F154 VanDerWaalsContact C-N 3.28Å; F152-F154 PolarHBondContact O-N 3.41Å; F152-L155 PolarHBondContact O-N 3.19Å; F152-N156 WeakPolarHBondContact O-CB 3.15Å; F152-N156 PolarHBondContact O-N 3.07Å; F152-F176 HydrophobicContact CD1-CZ 4.11Å; F152-F176 AromaticContact CE1-CE1 3.7Å; F152-F176 HydrophobicContact CE1-CE1 3.7Å; F152-F176 HydrophobicContact CE1-CE2 4.38Å; F152-F176 AromaticContact CE1-CZ 3.28Å; F152-F176 HydrophobicContact CE1-CZ 3.28Å; F152-F176 HydrophobicContact CZ-CE1 4.08Å; F152-F176 AromaticContact CZ-CZ 3.68Å; F152-F176 HydrophobicContact CZ-CZ 3.68Å |
| 153 | H | 89.2 | Confident | 87.7 | Confident | 55 Ų | 55 | 54.7 Ų | 54.7 | 26% | 0.255 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -60.5 | -40.9 | 174.7 | -82.4 | -77.7 | 0 | 0 | 0 | 111.6 | G121 I124 V149 A150 N156 F157 | G121-H153 WeakPolarHBondContact CA-CE1 3.5Å; I124-H153 HydrophobicContact CB-CB 4.44Å; I124-H153 HydrophobicContact CG2-CB 3.66Å; V149-H153 PolarHBondContact O-CD2 3.43Å; V149-H153 VanDerWaalsContact O-CD2 3.28Å; V149-H153 PolarHBondContact O-N 3.15Å; V149-H153 VanDerWaalsContact O-N 3.1Å; A150-H153 PolarHBondContact O-N 2.78Å; H153-N156 PolarHBondContact O-N 2.81Å; H153-F157 WeakPolarHBondContact O-CB 3.25Å; H153-F157 PolarHBondContact O-N 3.39Å |
| 154 | F | 91.7 | Very high | 87.3 | Confident | 1 Ų | 1 | 59.4 Ų | 59.4 | 0% | 0.004 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -64 | -48 | 176.8 | -171.9 | -123.4 | 0 | 0 | 0 | 112.7 | V128 F140 L144 A150 A151 F152 N156 F157 L158 Y170 | V128-F154 HydrophobicContact CG1-CB 3.91Å; V128-F154 HydrophobicContact CG1-CD2 3.49Å; V128-F154 VanDerWaalsContact CG1-CD2 3.49Å; V128-F154 HydrophobicContact CG1-CE2 4.21Å; V128-F154 HydrophobicContact CG1-CG 3.79Å; F140-F154 HydrophobicContact CE1-CD1 4.48Å; F140-F154 AromaticContact CE1-CE1 3.87Å; F140-F154 HydrophobicContact CE1-CE1 3.87Å; F140-F154 AromaticContact CE1-CZ 3.99Å; F140-F154 HydrophobicContact CE1-CZ 3.99Å; F140-F154 HydrophobicContact CZ-CD1 4.35Å; F140-F154 HydrophobicContact CZ-CE1 4.05Å; F140-F154 HydrophobicContact CZ-CE2 4.26Å; F140-F154 HydrophobicContact CZ-CZ 4.02Å; L144-F154 HydrophobicContact CD1-CB 4.41Å; L144-F154 HydrophobicContact CD2-CD1 3.7Å; L144-F154 HydrophobicContact CD2-CE1 4.27Å; L144-F154 HydrophobicContact CD2-CG 4.46Å; A150-F154 WeakPolarHBondContact O-CB 3.21Å; A150-F154 PolarHBondContact O-N 3.4Å; A151-F154 WeakPolarHBondContact O-CB 3.35Å; A151-F154 PolarHBondContact O-N 2.96Å; F152-F154 VanDerWaalsContact C-N 3.28Å; F152-F154 PolarHBondContact O-N 3.41Å; F154-N156 VanDerWaalsContact C-N 3.26Å; F154-N156 PolarHBondContact O-N 3.29Å; F154-F157 HydrophobicContact CD2-CD1 4.4Å; F154-F157 HydrophobicContact CE2-CD1 4.43Å; F154-F157 WeakPolarHBondContact O-CB 3.32Å; F154-F157 PolarHBondContact O-N 3.36Å; F154-F157 VanDerWaalsContact O-N 3.16Å; F154-L158 HydrophobicContact CD1-CD1 4.01Å; F154-L158 HydrophobicContact CE1-CD1 3.64Å; F154-L158 HydrophobicContact CE1-CG 4.3Å; F154-L158 HydrophobicContact CE2-CD1 4.49Å; F154-L158 HydrophobicContact CE2-CD2 4.21Å; F154-L158 HydrophobicContact CE2-CG 4.28Å; F154-L158 HydrophobicContact CZ-CD1 3.9Å; F154-L158 HydrophobicContact CZ-CD2 4.06Å; F154-L158 HydrophobicContact CZ-CG 4.14Å; F154-L158 WeakPolarHBondContact O-CG 3.27Å; F154-L158 PolarHBondContact O-N 2.98Å; F154-Y170 HydrophobicContact CD1-CD1 4.49Å; F154-Y170 HydrophobicContact CD1-CD2 4.48Å; F154-Y170 HydrophobicContact CD1-CG 4.34Å; F154-Y170 HydrophobicContact CE1-CD1 4.05Å; F154-Y170 AromaticContact CE1-CD2 3.59Å; F154-Y170 HydrophobicContact CE1-CD2 3.59Å; F154-Y170 HydrophobicContact CE1-CE1 4.06Å; F154-Y170 AromaticContact CE1-CE2 3.61Å; F154-Y170 HydrophobicContact CE1-CE2 3.61Å; F154-Y170 AromaticContact CE1-CG 3.83Å; F154-Y170 HydrophobicContact CE1-CG 3.83Å; F154-Y170 AromaticContact CE1-CZ 3.86Å; F154-Y170 HydrophobicContact CZ-CD2 4.38Å; F154-Y170 HydrophobicContact CZ-CE2 4.09Å |
| 155 | L | 89.1 | Confident | 86.9 | Confident | 15 Ų | 15 | 65 Ų | 65 | 8% | 0.079 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -58.4 | -41.4 | 175.2 | -68.1 | -178.9 | 0 | 0 | 0 | 111.3 | A151 F152 L158 R159 L167 M171 L174 F176 | A151-L155 WeakPolarHBondContact O-CG 3.4Å; A151-L155 PolarHBondContact O-N 3.39Å; F152-L155 PolarHBondContact O-N 3.19Å; L155-L158 PolarHBondContact O-N 3.46Å; L155-R159 WeakPolarHBondContact O-CB 3.4Å; L155-R159 PolarHBondContact O-N 3.44Å; L155-L167 HydrophobicContact CB-CD1 4.16Å; L155-L167 HydrophobicContact CD2-CD1 3.94Å; L155-L167 WeakPolarHBondContact O-CD1 3.41Å; L155-M171 HydrophobicContact CD1-CG 4.17Å; L155-M171 HydrophobicContact CD2-CG 3.83Å; L155-L174 HydrophobicContact CD1-CD1 3.75Å; L155-L174 HydrophobicContact CD2-CD1 4.09Å; L155-L174 HydrophobicContact CG-CD1 3.97Å; L155-F176 HydrophobicContact CD1-CD2 3.95Å; L155-F176 HydrophobicContact CD1-CE2 3.48Å; L155-F176 VanDerWaalsContact CD1-CE2 3.48Å; L155-F176 HydrophobicContact CD1-CZ 4.2Å |
| 156 | N | 85.9 | Confident | 86.9 | Confident | 58 Ų | 58 | 63.1 Ų | 63.1 | 31% | 0.31 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -64 | -42.1 | 176.7 | -165.4 | 43.5 | 0 | 0 | 0 | 112.2 | F152 H153 F154 R159 N160 | F152-N156 WeakPolarHBondContact O-CB 3.15Å; F152-N156 PolarHBondContact O-N 3.07Å; H153-N156 PolarHBondContact O-N 2.81Å; F154-N156 VanDerWaalsContact C-N 3.26Å; F154-N156 PolarHBondContact O-N 3.29Å; N156-R159 PolarHBondContact O-N 2.81Å; N156-R159 PolarHBondContact OD1-NE 3.35Å; N156-R159 PolarHBondContact OD1-NH2 2.88Å; N156-N160 WeakPolarHBondContact O-CB 3.17Å; N156-N160 PolarHBondContact O-N 3.47Å; N156-N160 PolarHBondContact O-ND2 3.37Å |
| 157 | F | 89.2 | Confident | 86.6 | Confident | 51 Ų | 51 | 56.4 Ų | 56.4 | 22% | 0.224 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -59.7 | -46.6 | 173.9 | 168.5 | -101.6 | 0 | 0 | 0 | 112 | T125 N129 H153 F154 R159 N160 T161 | T125-F157 HydrophobicContact CG2-CB 3.7Å; T125-F157 HydrophobicContact CG2-CD2 3.47Å; T125-F157 VanDerWaalsContact CG2-CD2 3.47Å; T125-F157 HydrophobicContact CG2-CE2 4.22Å; T125-F157 HydrophobicContact CG2-CG 3.64Å; N129-F157 WeakPolarHBondContact ND2-CE1 3.38Å; N129-F157 VanDerWaalsContact ND2-CZ 3.28Å; N129-F157 WeakPolarHBondContact ND2-CZ 3.48Å; N129-F157 WeakPolarHBondContact OD1-CE1 3.36Å; H153-F157 WeakPolarHBondContact O-CB 3.25Å; H153-F157 PolarHBondContact O-N 3.39Å; F154-F157 HydrophobicContact CD2-CD1 4.4Å; F154-F157 HydrophobicContact CE2-CD1 4.43Å; F154-F157 WeakPolarHBondContact O-CB 3.32Å; F154-F157 PolarHBondContact O-N 3.36Å; F154-F157 VanDerWaalsContact O-N 3.16Å; F157-R159 VanDerWaalsContact C-N 3.32Å; F157-R159 PolarHBondContact O-N 2.93Å; F157-N160 PolarHBondContact O-N 2.94Å; F157-T161 HydrophobicContact CD2-CG2 3.9Å; F157-T161 HydrophobicContact CE2-CG2 3.54Å; F157-T161 HydrophobicContact CZ-CG2 3.89Å; F157-T161 WeakPolarHBondContact O-CB 3.23Å; F157-T161 WeakPolarHBondContact O-CG2 3.36Å; F157-T161 PolarHBondContact O-N 3.22Å; F157-T161 PolarHBondContact O-OG1 3.45Å |
| 158 | L | 88.4 | Confident | 86.1 | Confident | 0 Ų | 0 | 63.1 Ų | 63.1 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -61.7 | -41.1 | 177.3 | -66 | 176.1 | 0 | 0 | 0 | 111.7 | F154 L155 T161 G162 Q163 D166 L167 Y170 | F154-L158 HydrophobicContact CD1-CD1 4.01Å; F154-L158 HydrophobicContact CE1-CD1 3.64Å; F154-L158 HydrophobicContact CE1-CG 4.3Å; F154-L158 HydrophobicContact CE2-CD1 4.49Å; F154-L158 HydrophobicContact CE2-CD2 4.21Å; F154-L158 HydrophobicContact CE2-CG 4.28Å; F154-L158 HydrophobicContact CZ-CD1 3.9Å; F154-L158 HydrophobicContact CZ-CD2 4.06Å; F154-L158 HydrophobicContact CZ-CG 4.14Å; F154-L158 WeakPolarHBondContact O-CG 3.27Å; F154-L158 PolarHBondContact O-N 2.98Å; L155-L158 PolarHBondContact O-N 3.46Å; L158-T161 PolarHBondContact O-OG1 3.33Å; L158-G162 PolarHBondContact O-N 3.49Å; L158-G162 VanDerWaalsContact O-N 3.12Å; L158-Q163 HydrophobicContact CB-CB 4.33Å; L158-Q163 HydrophobicContact CD2-CB 3.74Å; L158-Q163 HydrophobicContact CD2-CG 4.36Å; L158-Q163 PolarHBondContact O-N 3.46Å; L158-D166 HydrophobicContact CD1-CB 4.02Å; L158-D166 HydrophobicContact CD2-CB 4.03Å; L158-L167 HydrophobicContact CB-CB 4.05Å; L158-L167 HydrophobicContact CB-CD1 4.16Å; L158-Y170 HydrophobicContact CD1-CD2 3.98Å |
| 159 | R | 85.2 | Confident | 86 | Confident | 150 Ų | 150 | 64.1 Ų | 64.1 | 57% | 0.566 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -62.2 | -49.6 | 175.1 | 175.3 | 171.4 | 52.7 | -170.4 | -7.3 | 111.9 | L155 N156 F157 T161 G162 L167 | L155-R159 WeakPolarHBondContact O-CB 3.4Å; L155-R159 PolarHBondContact O-N 3.44Å; N156-R159 PolarHBondContact O-N 2.81Å; N156-R159 PolarHBondContact OD1-NE 3.35Å; N156-R159 PolarHBondContact OD1-NH2 2.88Å; F157-R159 VanDerWaalsContact C-N 3.32Å; F157-R159 PolarHBondContact O-N 2.93Å; R159-T161 VanDerWaalsContact C-N 3.31Å; R159-T161 PolarHBondContact O-N 2.93Å; R159-G162 PolarHBondContact O-N 3.31Å; R159-L167 HydrophobicContact CB-CD1 4.49Å; R159-L167 HydrophobicContact CB-CD2 4.02Å |
| 160 | N | 82.3 | Confident | 85.9 | Confident | 118 Ų | 118 | 61.2 Ų | 61.2 | 63% | 0.631 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -69.9 | -27.2 | -177.4 | -67.8 | -11.5 | 0 | 0 | 0 | 113 | N156 F157 | N156-N160 WeakPolarHBondContact O-CB 3.17Å; N156-N160 PolarHBondContact O-N 3.47Å; N156-N160 PolarHBondContact O-ND2 3.37Å; F157-N160 PolarHBondContact O-N 2.94Å |
| 161 | T | 86.9 | Confident | 85.3 | Confident | 72 Ų | 72 | 62.8 Ų | 62.8 | 44% | 0.442 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.2 | -1.7 | 176.2 | 56.5 | 0 | 0 | 0 | 0 | 113.7 | F157 L158 R159 Q163 | F157-T161 HydrophobicContact CD2-CG2 3.9Å; F157-T161 HydrophobicContact CE2-CG2 3.54Å; F157-T161 HydrophobicContact CZ-CG2 3.89Å; F157-T161 WeakPolarHBondContact O-CB 3.23Å; F157-T161 WeakPolarHBondContact O-CG2 3.36Å; F157-T161 PolarHBondContact O-N 3.22Å; F157-T161 PolarHBondContact O-OG1 3.45Å; L158-T161 PolarHBondContact O-OG1 3.33Å; R159-T161 VanDerWaalsContact C-N 3.31Å; R159-T161 PolarHBondContact O-N 2.93Å; T161-Q163 VanDerWaalsContact C-N 3.31Å; T161-Q163 PolarHBondContact O-N 3.27Å; T161-Q163 PolarHBondContact OG1-NE2 3.14Å |
| 162 | G | 80.4 | Confident | 84.7 | Confident | 48 Ų | 48 | 70 Ų | 70 | 50% | 0.495 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72 | 18.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | L158 R159 L164 | L158-G162 PolarHBondContact O-N 3.49Å; L158-G162 VanDerWaalsContact O-N 3.12Å; R159-G162 PolarHBondContact O-N 3.31Å; G162-L164 PolarHBondContact O-N 3.3Å |
| 163 | Q | 86.9 | Confident | 84.5 | Confident | 61 Ų | 61 | 67.4 Ų | 67.4 | 29% | 0.285 | 34% | 0.337 | S | S | . | . | trans | -77.4 | 63 | 176.6 | -71.1 | 177.2 | 71.9 | 0 | 0 | 111.1 | L158 T161 V165 D166 L167 | L158-Q163 HydrophobicContact CB-CB 4.33Å; L158-Q163 HydrophobicContact CD2-CB 3.74Å; L158-Q163 HydrophobicContact CD2-CG 4.36Å; L158-Q163 PolarHBondContact O-N 3.46Å; T161-Q163 VanDerWaalsContact C-N 3.31Å; T161-Q163 PolarHBondContact O-N 3.27Å; T161-Q163 PolarHBondContact OG1-NE2 3.14Å; Q163-V165 VanDerWaalsContact C-N 3.31Å; Q163-V165 PolarHBondContact O-N 3.13Å; Q163-D166 PolarHBondContact O-N 3.43Å; Q163-L167 WeakPolarHBondContact O-CB 3.46Å; Q163-L167 PolarHBondContact O-N 2.95Å | ||
| 164 | L | 78.9 | Confident | 83.9 | Confident | 105 Ų | 105 | 66.5 Ų | 66.5 | 55% | 0.55 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -65.7 | -27.7 | -168.4 | -60.1 | -178.1 | 0 | 0 | 0 | 114.6 | G162 L167 K168 | G162-L164 PolarHBondContact O-N 3.3Å; L164-L167 HydrophobicContact CD2-CD2 4.31Å; L164-K168 VanDerWaalsContact O-CG 3.3Å; L164-K168 WeakPolarHBondContact O-CG 3.24Å; L164-K168 PolarHBondContact O-N 2.9Å |
| 165 | V | 83.8 | Confident | 82.9 | Confident | 122 Ų | 122 | 68.5 Ų | 68.5 | 74% | 0.739 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -68.9 | -50.9 | 178.4 | 177.6 | 0 | 0 | 0 | 0 | 110.1 | Q163 K168 R169 | Q163-V165 VanDerWaalsContact C-N 3.31Å; Q163-V165 PolarHBondContact O-N 3.13Å; V165-K168 PolarHBondContact O-N 3.5Å; V165-R169 PolarHBondContact O-N 2.95Å |
| 166 | D | 86.1 | Confident | 81.8 | Confident | 39 Ų | 39 | 71 Ų | 71 | 21% | 0.209 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -64.7 | -42.8 | 177.3 | -68.7 | -19.1 | 0 | 0 | 0 | 110.8 | R132 L158 Q163 K168 R169 Y170 | R132-D166 IonicContact CZ-OD2 3.39Å; R132-D166 IonicContact NH1-OD2 2.72Å; R132-D166 IonicContact NH2-OD2 2.78Å; R132-D166 PolarHBondContact NH2-OD2 2.88Å; L158-D166 HydrophobicContact CD1-CB 4.02Å; L158-D166 HydrophobicContact CD2-CB 4.03Å; Q163-D166 PolarHBondContact O-N 3.43Å; D166-K168 VanDerWaalsContact C-N 3.31Å; D166-K168 PolarHBondContact O-N 3.39Å; D166-R169 WeakPolarHBondContact O-CB 3.19Å; D166-R169 PolarHBondContact O-N 3.24Å; D166-R169 VanDerWaalsContact O-N 3.07Å; D166-Y170 HydrophobicContact CB-CD2 4.33Å; D166-Y170 HydrophobicContact CB-CE2 4.43Å; D166-Y170 VanDerWaalsContact O-CD2 3.26Å; D166-Y170 WeakPolarHBondContact O-CD2 3.35Å; D166-Y170 PolarHBondContact O-N 3.34Å |
| 167 | L | 82.7 | Confident | 80.4 | Confident | 22 Ų | 22 | 73.2 Ų | 73.2 | 12% | 0.115 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -52.8 | -51 | 177.4 | 179 | 63.5 | 0 | 0 | 0 | 111 | L155 L158 R159 Q163 L164 R169 Y170 M171 | L155-L167 HydrophobicContact CB-CD1 4.16Å; L155-L167 HydrophobicContact CD2-CD1 3.94Å; L155-L167 WeakPolarHBondContact O-CD1 3.41Å; L158-L167 HydrophobicContact CB-CB 4.05Å; L158-L167 HydrophobicContact CB-CD1 4.16Å; R159-L167 HydrophobicContact CB-CD1 4.49Å; R159-L167 HydrophobicContact CB-CD2 4.02Å; Q163-L167 WeakPolarHBondContact O-CB 3.46Å; Q163-L167 PolarHBondContact O-N 2.95Å; L164-L167 HydrophobicContact CD2-CD2 4.31Å; L167-R169 VanDerWaalsContact C-N 3.33Å; L167-R169 PolarHBondContact O-N 3.42Å; L167-Y170 PolarHBondContact O-N 3.13Å; L167-M171 HydrophobicContact CD1-CG 4.1Å; L167-M171 HydrophobicContact CD1-SD 3.83Å; L167-M171 HydrophobicContact CD2-SD 4.44Å; L167-M171 HydrophobicContact CG-CG 4.41Å; L167-M171 HydrophobicContact CG-SD 3.76Å; L167-M171 WeakPolarHBondContact O-CB 3.29Å; L167-M171 WeakPolarHBondContact O-CG 3.32Å; L167-M171 PolarHBondContact O-N 3.13Å |
| 168 | K | 76.8 | Confident | 78.7 | Confident | 154 Ų | 154 | 75.3 Ų | 75.3 | 67% | 0.67 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -60.6 | -41 | 178.4 | -74.6 | 176 | -178.5 | -177.1 | 0 | 112.5 | L164 V165 D166 K172 | L164-K168 VanDerWaalsContact O-CG 3.3Å; L164-K168 WeakPolarHBondContact O-CG 3.24Å; L164-K168 PolarHBondContact O-N 2.9Å; V165-K168 PolarHBondContact O-N 3.5Å; D166-K168 VanDerWaalsContact C-N 3.31Å; D166-K168 PolarHBondContact O-N 3.39Å; K168-K172 WeakPolarHBondContact O-CB 3.49Å; K168-K172 PolarHBondContact O-N 2.77Å; K168-K172 VanDerWaalsContact O-N 3.13Å |
| 169 | R | 85.2 | Confident | 76.9 | Confident | 97 Ų | 97 | 78.4 Ų | 78.4 | 37% | 0.366 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -61.9 | -53.8 | 177.8 | 177 | -171.3 | 172.7 | 153.6 | 3.5 | 111.1 | E137 E141 V165 D166 L167 M171 K172 L173 | E137-R169 IonicContact OE1-CZ 2.68Å; E137-R169 IonicContact OE1-NH1 3.75Å; E137-R169 PolarHBondContact OE1-NH1 2.97Å; E137-R169 IonicContact OE1-NH2 3.48Å; E137-R169 PolarHBondContact OE1-NH2 3.02Å; E137-R169 VanDerWaalsContact OE1-NH2 3.16Å; E137-R169 IonicContact OE2-CZ 3.04Å; E137-R169 IonicContact OE2-NH1 3.97Å; E137-R169 PolarHBondContact OE2-NH1 3.3Å; E137-R169 VanDerWaalsContact OE2-NH1 3.15Å; E137-R169 IonicContact OE2-NH2 3.57Å; E137-R169 PolarHBondContact OE2-NH2 3.4Å; E141-R169 IonicContact OE1-CZ 2.66Å; E141-R169 VanDerWaalsContact OE1-CZ 3.32Å; E141-R169 IonicContact OE1-NE 3.79Å; E141-R169 PolarHBondContact OE1-NE 3.19Å; E141-R169 IonicContact OE1-NH2 2.69Å; E141-R169 PolarHBondContact OE1-NH2 2.82Å; V165-R169 PolarHBondContact O-N 2.95Å; D166-R169 WeakPolarHBondContact O-CB 3.19Å; D166-R169 PolarHBondContact O-N 3.24Å; D166-R169 VanDerWaalsContact O-N 3.07Å; L167-R169 VanDerWaalsContact C-N 3.33Å; L167-R169 PolarHBondContact O-N 3.42Å; R169-M171 PolarHBondContact O-N 3.03Å; R169-K172 WeakPolarHBondContact O-CB 3.34Å; R169-K172 PolarHBondContact O-N 2.7Å; R169-L173 PolarHBondContact O-N 3.38Å |
| 170 | Y | 85.7 | Confident | 75.1 | Confident | 3 Ų | 3 | 76.2 Ų | 76.2 | 1% | 0.012 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -69.4 | -34 | -176.7 | -76.7 | -77.6 | 0 | 0 | 0 | 112.4 | F140 E141 L144 F154 L158 D166 L167 K172 L173 L174 | F140-Y170 HydrophobicContact CD1-CE1 4.1Å; F140-Y170 WeakPolarHBondContact CD1-OH 3.44Å; F140-Y170 AromaticContact CE1-CE1 3.81Å; F140-Y170 HydrophobicContact CE1-CE1 3.81Å; F140-Y170 AromaticContact CE1-CZ 3.79Å; F140-Y170 WeakPolarHBondContact CE1-OH 3.18Å; E141-Y170 HydrophobicContact CG-CE1 3.87Å; L144-Y170 HydrophobicContact CD2-CD1 3.92Å; L144-Y170 HydrophobicContact CD2-CE1 4.17Å; F154-Y170 HydrophobicContact CD1-CD1 4.49Å; F154-Y170 HydrophobicContact CD1-CD2 4.48Å; F154-Y170 HydrophobicContact CD1-CG 4.34Å; F154-Y170 HydrophobicContact CE1-CD1 4.05Å; F154-Y170 AromaticContact CE1-CD2 3.59Å; F154-Y170 HydrophobicContact CE1-CD2 3.59Å; F154-Y170 HydrophobicContact CE1-CE1 4.06Å; F154-Y170 AromaticContact CE1-CE2 3.61Å; F154-Y170 HydrophobicContact CE1-CE2 3.61Å; F154-Y170 AromaticContact CE1-CG 3.83Å; F154-Y170 HydrophobicContact CE1-CG 3.83Å; F154-Y170 AromaticContact CE1-CZ 3.86Å; F154-Y170 HydrophobicContact CZ-CD2 4.38Å; F154-Y170 HydrophobicContact CZ-CE2 4.09Å; L158-Y170 HydrophobicContact CD1-CD2 3.98Å; D166-Y170 HydrophobicContact CB-CD2 4.33Å; D166-Y170 HydrophobicContact CB-CE2 4.43Å; D166-Y170 VanDerWaalsContact O-CD2 3.26Å; D166-Y170 WeakPolarHBondContact O-CD2 3.35Å; D166-Y170 PolarHBondContact O-N 3.34Å; L167-Y170 PolarHBondContact O-N 3.13Å; Y170-K172 VanDerWaalsContact C-N 3.31Å; Y170-K172 PolarHBondContact O-N 3.2Å; Y170-L173 HydrophobicContact CD1-CD2 3.97Å; Y170-L173 HydrophobicContact CE1-CD2 4.25Å; Y170-L173 PolarHBondContact O-N 3.45Å; Y170-L174 WeakPolarHBondContact O-CB 3.38Å; Y170-L174 WeakPolarHBondContact O-CD1 3.44Å; Y170-L174 VanDerWaalsContact O-CG 3.23Å; Y170-L174 WeakPolarHBondContact O-CG 3.28Å; Y170-L174 PolarHBondContact O-N 2.79Å |
| 171 | M | 78.9 | Confident | 73.9 | Confident | 33 Ų | 33 | 76.2 Ų | 76.2 | 16% | 0.163 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -59.4 | -44 | 171.1 | -73.1 | 177 | 79.4 | 0 | 0 | 111.5 | L155 L167 R169 G175 F176 E179 | L155-M171 HydrophobicContact CD1-CG 4.17Å; L155-M171 HydrophobicContact CD2-CG 3.83Å; L167-M171 HydrophobicContact CD1-CG 4.1Å; L167-M171 HydrophobicContact CD1-SD 3.83Å; L167-M171 HydrophobicContact CD2-SD 4.44Å; L167-M171 HydrophobicContact CG-CG 4.41Å; L167-M171 HydrophobicContact CG-SD 3.76Å; L167-M171 WeakPolarHBondContact O-CB 3.29Å; L167-M171 WeakPolarHBondContact O-CG 3.32Å; L167-M171 PolarHBondContact O-N 3.13Å; R169-M171 PolarHBondContact O-N 3.03Å; M171-G175 PolarHBondContact O-N 2.67Å; M171-F176 HydrophobicContact CB-CB 4.21Å; M171-F176 HydrophobicContact CB-CD2 4.45Å; M171-F176 HydrophobicContact CE-CB 4.5Å; M171-F176 WeakPolarHBondContact O-CB 3.48Å; M171-F176 PolarHBondContact O-N 3.07Å; M171-E179 HydrophobicContact CE-CG 4.21Å; M171-E179 VanDerWaalsContact CE-OE1 3.29Å; M171-E179 WeakPolarHBondContact CE-OE1 3.2Å; M171-E179 VanDerWaalsContact CE-OE2 3.25Å; M171-E179 WeakPolarHBondContact CE-OE2 3.42Å |
| 172 | K | 78.5 | Confident | 72.8 | Confident | 153 Ų | 153 | 75 Ų | 75 | 67% | 0.665 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -63.4 | -44.2 | 175.7 | -174.2 | -176.5 | 177.1 | -171.6 | 0 | 111.8 | K168 R169 Y170 G175 | K168-K172 WeakPolarHBondContact O-CB 3.49Å; K168-K172 PolarHBondContact O-N 2.77Å; K168-K172 VanDerWaalsContact O-N 3.13Å; R169-K172 WeakPolarHBondContact O-CB 3.34Å; R169-K172 PolarHBondContact O-N 2.7Å; Y170-K172 VanDerWaalsContact C-N 3.31Å; Y170-K172 PolarHBondContact O-N 3.2Å; K172-G175 PolarHBondContact O-N 3.11Å |
| 173 | L | 82.2 | Confident | 72.3 | Confident | 58 Ų | 58 | 76.5 Ų | 76.5 | 30% | 0.304 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -60.5 | -45.4 | 179.1 | 179.9 | 72.2 | 0 | 0 | 0 | 112.1 | E141 L145 R169 Y170 G175 | E141-L173 HydrophobicContact CB-CD2 3.75Å; E141-L173 HydrophobicContact CG-CD2 3.47Å; E141-L173 VanDerWaalsContact CG-CD2 3.47Å; L145-L173 HydrophobicContact CD1-CD1 4.26Å; L145-L173 HydrophobicContact CD1-CD2 4.48Å; L145-L173 HydrophobicContact CD1-CG 4.28Å; L145-L173 HydrophobicContact CD2-CG 4.37Å; L145-L173 HydrophobicContact CG-CG 4.45Å; R169-L173 PolarHBondContact O-N 3.38Å; Y170-L173 HydrophobicContact CD1-CD2 3.97Å; Y170-L173 HydrophobicContact CE1-CD2 4.25Å; Y170-L173 PolarHBondContact O-N 3.45Å; L173-G175 PolarHBondContact O-N 2.97Å; L173-G175 VanDerWaalsContact O-N 3.14Å |
| 174 | L | 78.4 | Confident | 71.6 | Confident | 37 Ų | 37 | 74 Ų | 74 | 19% | 0.194 | 39% | 0.386 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -76.1 | 6 | -179.1 | -65.6 | 164 | 0 | 0 | 0 | 113 | L145 A151 L155 Y170 F176 | L145-L174 HydrophobicContact CD2-CD2 3.87Å; L145-L174 HydrophobicContact CG-CD2 4.42Å; A151-L174 HydrophobicContact CB-CD1 3.79Å; A151-L174 HydrophobicContact CB-CD2 3.77Å; A151-L174 HydrophobicContact CB-CG 4.46Å; L155-L174 HydrophobicContact CD1-CD1 3.75Å; L155-L174 HydrophobicContact CD2-CD1 4.09Å; L155-L174 HydrophobicContact CG-CD1 3.97Å; Y170-L174 WeakPolarHBondContact O-CB 3.38Å; Y170-L174 WeakPolarHBondContact O-CD1 3.44Å; Y170-L174 VanDerWaalsContact O-CG 3.23Å; Y170-L174 WeakPolarHBondContact O-CG 3.28Å; Y170-L174 PolarHBondContact O-N 2.79Å; L174-F176 VanDerWaalsContact C-N 3.34Å; L174-F176 HydrophobicContact CB-CD2 3.59Å; L174-F176 HydrophobicContact CB-CE2 3.46Å; L174-F176 VanDerWaalsContact CB-CE2 3.46Å; L174-F176 HydrophobicContact CD1-CD2 4.45Å; L174-F176 HydrophobicContact CD1-CE2 3.91Å; L174-F176 HydrophobicContact CG-CE2 4.32Å; L174-F176 PolarHBondContact O-N 3.35Å |
| 175 | G | 69.7 | Low | 71.2 | Confident | 43 Ų | 43 | 71.6 Ų | 71.6 | 44% | 0.443 | 37% | 0.37 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 75.8 | 17.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | M171 K172 L173 I177 | M171-G175 PolarHBondContact O-N 2.67Å; K172-G175 PolarHBondContact O-N 3.11Å; L173-G175 PolarHBondContact O-N 2.97Å; L173-G175 VanDerWaalsContact O-N 3.14Å; G175-I177 PolarHBondContact O-N 3.08Å |
| 176 | F | 65.5 | Low | 70.6 | Confident | 67 Ų | 67 | 68.4 Ų | 68.4 | 29% | 0.294 | 35% | 0.353 | S | S | . | . | trans | -73.2 | 41.5 | 169.9 | -62.3 | -76.6 | 0 | 0 | 0 | 111.8 | F152 L155 M171 L174 K178 | F152-F176 HydrophobicContact CD1-CZ 4.11Å; F152-F176 AromaticContact CE1-CE1 3.7Å; F152-F176 HydrophobicContact CE1-CE1 3.7Å; F152-F176 HydrophobicContact CE1-CE2 4.38Å; F152-F176 AromaticContact CE1-CZ 3.28Å; F152-F176 HydrophobicContact CE1-CZ 3.28Å; F152-F176 HydrophobicContact CZ-CE1 4.08Å; F152-F176 AromaticContact CZ-CZ 3.68Å; F152-F176 HydrophobicContact CZ-CZ 3.68Å; L155-F176 HydrophobicContact CD1-CD2 3.95Å; L155-F176 HydrophobicContact CD1-CE2 3.48Å; L155-F176 VanDerWaalsContact CD1-CE2 3.48Å; L155-F176 HydrophobicContact CD1-CZ 4.2Å; M171-F176 HydrophobicContact CB-CB 4.21Å; M171-F176 HydrophobicContact CB-CD2 4.45Å; M171-F176 HydrophobicContact CE-CB 4.5Å; M171-F176 WeakPolarHBondContact O-CB 3.48Å; M171-F176 PolarHBondContact O-N 3.07Å; L174-F176 VanDerWaalsContact C-N 3.34Å; L174-F176 HydrophobicContact CB-CD2 3.59Å; L174-F176 HydrophobicContact CB-CE2 3.46Å; L174-F176 VanDerWaalsContact CB-CE2 3.46Å; L174-F176 HydrophobicContact CD1-CD2 4.45Å; L174-F176 HydrophobicContact CD1-CE2 3.91Å; L174-F176 HydrophobicContact CG-CE2 4.32Å; L174-F176 PolarHBondContact O-N 3.35Å; F176-K178 PolarHBondContact O-N 3.22Å | ||
| 177 | I | 56.5 | Low | 70.3 | Confident | 105 Ų | 105 | 71 Ų | 71 | 54% | 0.538 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -25.3 | 106.6 | -172.1 | -66.8 | 170.6 | 0 | 0 | 0 | 111.6 | G175 E179 | G175-I177 PolarHBondContact O-N 3.08Å; I177-E179 PolarHBondContact O-N 2.9Å |
| 178 | K | 54.8 | Low | 70.2 | Confident | 94 Ų | 94 | 70.3 Ų | 70.3 | 41% | 0.409 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 34.8 | 64.5 | 163.2 | -67.4 | 143.8 | 153.5 | -137.2 | 0 | 114.2 | F176 S180 E181 I182 | F176-K178 PolarHBondContact O-N 3.22Å; K178-S180 PolarHBondContact O-N 3.17Å; K178-E181 HydrophobicContact CB-CB 3.71Å; K178-E181 HydrophobicContact CB-CG 3.76Å; K178-E181 HydrophobicContact CD-CG 4.25Å; K178-E181 VanDerWaalsContact CD-OE1 3.27Å; K178-E181 WeakPolarHBondContact CD-OE1 3.42Å; K178-E181 WeakPolarHBondContact CD-OE2 3.45Å; K178-E181 VanDerWaalsContact CE-CD 3.4Å; K178-E181 WeakPolarHBondContact CE-OE1 3.4Å; K178-E181 WeakPolarHBondContact CE-OE2 3.4Å; K178-E181 HydrophobicContact CG-CG 4.1Å; K178-E181 WeakPolarHBondContact CG-OE2 3.41Å; K178-E181 IonicContact NZ-OE1 2.64Å; K178-E181 PolarHBondContact NZ-OE1 3.17Å; K178-E181 IonicContact NZ-OE2 3.15Å; K178-E181 PolarHBondContact NZ-OE2 3.29Å; K178-E181 PolarHBondContact O-N 2.87Å; K178-I182 PolarHBondContact O-N 3.2Å |
| 179 | E | 49.3 | Very low | 70.2 | Confident | 66 Ų | 66 | 66.5 Ų | 66.5 | 31% | 0.308 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -46.7 | -29.1 | 161.7 | -72.6 | -178.3 | -174.6 | 0 | 0 | 112.1 | M171 I177 Y185 | M171-E179 HydrophobicContact CE-CG 4.21Å; M171-E179 VanDerWaalsContact CE-OE1 3.29Å; M171-E179 WeakPolarHBondContact CE-OE1 3.2Å; M171-E179 VanDerWaalsContact CE-OE2 3.25Å; M171-E179 WeakPolarHBondContact CE-OE2 3.42Å; I177-E179 PolarHBondContact O-N 2.9Å; E179-Y185 HydrophobicContact CB-CD1 3.72Å; E179-Y185 HydrophobicContact CB-CE1 3.63Å; E179-Y185 VanDerWaalsContact CD-CE1 3.42Å; E179-Y185 HydrophobicContact CG-CD1 4Å; E179-Y185 HydrophobicContact CG-CE1 3.57Å; E179-Y185 PolarHBondContact OE1-OH 3.32Å; E179-Y185 VanDerWaalsContact OE2-CE1 3.27Å; E179-Y185 WeakPolarHBondContact OE2-CE1 3.23Å; E179-Y185 PolarHBondContact OE2-OH 3.27Å |
| 180 | S | 47.7 | Very low | 69.9 | Low | 103 Ų | 103 | 67 Ų | 67 | 72% | 0.72 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.1 | -17.8 | 174.6 | 60.9 | 0 | 0 | 0 | 0 | 115.9 | K178 | K178-S180 PolarHBondContact O-N 3.17Š|
| 181 | E | 57.2 | Low | 69.9 | Low | 119 Ų | 119 | 69.9 Ų | 69.9 | 56% | 0.556 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.8 | -15.3 | 177.8 | -71 | 176.5 | 35.8 | 0 | 0 | 112.5 | K178 S183 | K178-E181 HydrophobicContact CB-CB 3.71Å; K178-E181 HydrophobicContact CB-CG 3.76Å; K178-E181 HydrophobicContact CD-CG 4.25Å; K178-E181 VanDerWaalsContact CD-OE1 3.27Å; K178-E181 WeakPolarHBondContact CD-OE1 3.42Å; K178-E181 WeakPolarHBondContact CD-OE2 3.45Å; K178-E181 VanDerWaalsContact CE-CD 3.4Å; K178-E181 WeakPolarHBondContact CE-OE1 3.4Å; K178-E181 WeakPolarHBondContact CE-OE2 3.4Å; K178-E181 HydrophobicContact CG-CG 4.1Å; K178-E181 WeakPolarHBondContact CG-OE2 3.41Å; K178-E181 IonicContact NZ-OE1 2.64Å; K178-E181 PolarHBondContact NZ-OE1 3.17Å; K178-E181 IonicContact NZ-OE2 3.15Å; K178-E181 PolarHBondContact NZ-OE2 3.29Å; K178-E181 PolarHBondContact O-N 2.87Å; E181-S183 PolarHBondContact O-N 3.25Å; E181-S183 VanDerWaalsContact O-N 3.14Å |
| 182 | I | 63.2 | Low | 70.1 | Confident | 46 Ų | 46 | 68.9 Ų | 68.9 | 24% | 0.236 | 36% | 0.36 | C | S | . | . | trans | -84 | 91.6 | 174 | -55 | 178.2 | 0 | 0 | 0 | 107.6 | K178 S184 Y185 S186 E214 | K178-I182 PolarHBondContact O-N 3.2Å; I182-S184 WeakPolarHBondContact CG2-OG 3.44Å; I182-S184 PolarHBondContact O-N 3.41Å; I182-S184 VanDerWaalsContact O-N 3.16Å; I182-Y185 WeakPolarHBondContact O-CB 3.27Å; I182-Y185 PolarHBondContact O-N 2.97Å; I182-S186 PolarHBondContact O-N 2.73Å; I182-S186 VanDerWaalsContact O-N 3.12Å; I182-E214 WeakPolarHBondContact CG2-OE2 3.16Å | ||
| 183 | S | 69.8 | Low | 70 | Confident | 79 Ų | 79 | 68.1 Ų | 68.1 | 55% | 0.552 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -56.4 | -32.7 | -177.1 | 69.5 | 0 | 0 | 0 | 0 | 112.9 | E181 Q187 | E181-S183 PolarHBondContact O-N 3.25Å; E181-S183 VanDerWaalsContact O-N 3.14Å; S183-Q187 WeakPolarHBondContact O-CG 3.25Å; S183-Q187 PolarHBondContact O-N 3.07Å; S183-Q187 VanDerWaalsContact O-N 3.17Å |
| 184 | S | 72.5 | Confident | 70 | Confident | 9 Ų | 9 | 71.3 Ų | 71.3 | 6% | 0.063 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -68.3 | -39.1 | 177.5 | 80.5 | 0 | 0 | 0 | 0 | 111.8 | I182 Q187 L188 Y206 I210 E214 | I182-S184 WeakPolarHBondContact CG2-OG 3.44Å; I182-S184 PolarHBondContact O-N 3.41Å; I182-S184 VanDerWaalsContact O-N 3.16Å; S184-Q187 CarbonylContact O-C 3.57Å; S184-Q187 WeakPolarHBondContact O-CB 3.43Å; S184-Q187 PolarHBondContact O-N 2.86Å; S184-L188 PolarHBondContact O-N 3.33Å; S184-Y206 WeakPolarHBondContact CA-OH 3.28Å; S184-Y206 WeakPolarHBondContact O-CE1 3.46Å; S184-Y206 PolarHBondContact O-OH 2.87Å; S184-I210 WeakPolarHBondContact O-CD1 3.47Å; S184-E214 WeakPolarHBondContact CB-OE1 3.47Å; S184-E214 PolarHBondContact OG-OE1 3.01Å; S184-E214 PolarHBondContact OG-OE2 3.35Å |
| 185 | Y | 70.2 | Confident | 70.4 | Confident | 55 Ų | 55 | 70.9 Ų | 70.9 | 22% | 0.216 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -69.1 | -41.5 | -179.9 | -176.3 | -96.6 | 0 | 0 | 0 | 110.6 | E179 I182 Q187 L188 M189 | E179-Y185 HydrophobicContact CB-CD1 3.72Å; E179-Y185 HydrophobicContact CB-CE1 3.63Å; E179-Y185 VanDerWaalsContact CD-CE1 3.42Å; E179-Y185 HydrophobicContact CG-CD1 4Å; E179-Y185 HydrophobicContact CG-CE1 3.57Å; E179-Y185 PolarHBondContact OE1-OH 3.32Å; E179-Y185 VanDerWaalsContact OE2-CE1 3.27Å; E179-Y185 WeakPolarHBondContact OE2-CE1 3.23Å; E179-Y185 PolarHBondContact OE2-OH 3.27Å; I182-Y185 WeakPolarHBondContact O-CB 3.27Å; I182-Y185 PolarHBondContact O-N 2.97Å; Y185-Q187 VanDerWaalsContact C-N 3.3Å; Y185-Q187 PolarHBondContact O-N 2.86Å; Y185-L188 HydrophobicContact CD2-CD2 4.41Å; Y185-L188 WeakPolarHBondContact O-CB 3.29Å; Y185-L188 PolarHBondContact O-N 2.85Å; Y185-L188 VanDerWaalsContact O-N 3.11Å; Y185-M189 HydrophobicContact CD1-CG 4.08Å; Y185-M189 HydrophobicContact CE1-CG 3.73Å; Y185-M189 HydrophobicContact CE1-SD 4.25Å; Y185-M189 WeakPolarHBondContact O-CG 3.45Å; Y185-M189 PolarHBondContact O-N 3.45Å |
| 186 | S | 70.8 | Confident | 71.2 | Confident | 55 Ų | 55 | 71.3 Ų | 71.3 | 39% | 0.385 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -57.3 | -43.6 | 170.9 | -178.2 | 0 | 0 | 0 | 0 | 111.9 | I182 M189 Q190 | I182-S186 PolarHBondContact O-N 2.73Å; I182-S186 VanDerWaalsContact O-N 3.12Å; S186-M189 PolarHBondContact O-N 3.22Å; S186-Q190 WeakPolarHBondContact O-CG 3.28Å; S186-Q190 PolarHBondContact O-N 3.11Å; S186-Q190 VanDerWaalsContact O-N 3.1Å |
| 187 | Q | 80.1 | Confident | 72 | Confident | 94 Ų | 94 | 71.4 Ų | 71.4 | 44% | 0.439 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -66.3 | -37.4 | 174.4 | -71 | 174 | 46 | 0 | 0 | 112.5 | S183 S184 Y185 Q190 K191 Y206 | S183-Q187 WeakPolarHBondContact O-CG 3.25Å; S183-Q187 PolarHBondContact O-N 3.07Å; S183-Q187 VanDerWaalsContact O-N 3.17Å; S184-Q187 CarbonylContact O-C 3.57Å; S184-Q187 WeakPolarHBondContact O-CB 3.43Å; S184-Q187 PolarHBondContact O-N 2.86Å; Y185-Q187 VanDerWaalsContact C-N 3.3Å; Y185-Q187 PolarHBondContact O-N 2.86Å; Q187-Q190 PolarHBondContact O-N 3.18Å; Q187-K191 WeakPolarHBondContact O-CG 2.96Å; Q187-K191 PolarHBondContact O-N 3.28Å; Q187-Y206 HydrophobicContact CB-CE1 4.16Å; Q187-Y206 WeakPolarHBondContact CB-OH 3.37Å; Q187-Y206 PolarHBondContact OE1-OH 2.87Å |
| 188 | L | 80.5 | Confident | 73.3 | Confident | 7 Ų | 7 | 69.7 Ų | 69.7 | 4% | 0.037 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -62.1 | -47.9 | 175.8 | 173.5 | 61.4 | 0 | 0 | 0 | 110.4 | S184 Y185 Q190 K191 L192 V203 Y206 I207 I210 | S184-L188 PolarHBondContact O-N 3.33Å; Y185-L188 HydrophobicContact CD2-CD2 4.41Å; Y185-L188 WeakPolarHBondContact O-CB 3.29Å; Y185-L188 PolarHBondContact O-N 2.85Å; Y185-L188 VanDerWaalsContact O-N 3.11Å; L188-Q190 VanDerWaalsContact C-N 3.28Å; L188-Q190 PolarHBondContact O-N 3.34Å; L188-K191 WeakPolarHBondContact O-CB 3.21Å; L188-K191 PolarHBondContact O-N 3.05Å; L188-L192 HydrophobicContact CD1-CD1 3.95Å; L188-L192 HydrophobicContact CD1-CG 3.99Å; L188-L192 HydrophobicContact CD2-CD1 4.41Å; L188-L192 HydrophobicContact CG-CD1 3.79Å; L188-L192 HydrophobicContact CG-CG 4.28Å; L188-L192 WeakPolarHBondContact O-CG 3.27Å; L188-L192 PolarHBondContact O-N 2.92Å; L188-V203 HydrophobicContact CD1-CG1 4.23Å; L188-Y206 HydrophobicContact CB-CD1 4.08Å; L188-Y206 HydrophobicContact CB-CE1 3.84Å; L188-Y206 HydrophobicContact CD1-CD1 3.98Å; L188-I207 HydrophobicContact CD1-CD1 4.24Å; L188-I207 HydrophobicContact CD1-CG1 3.39Å; L188-I207 HydrophobicContact CD2-CG1 4.18Å; L188-I207 HydrophobicContact CG-CG1 4.42Å; L188-I210 HydrophobicContact CB-CD1 3.67Å; L188-I210 HydrophobicContact CD2-CD1 3.98Å; L188-I210 HydrophobicContact CG-CD1 4.31Å |
| 189 | M | 77.7 | Confident | 74.9 | Confident | 73 Ų | 73 | 69.8 Ų | 69.8 | 36% | 0.36 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -59.7 | -39.6 | 177.1 | -69.6 | -54.7 | -61.6 | 0 | 0 | 111.7 | Y185 S186 L192 M193 | Y185-M189 HydrophobicContact CD1-CG 4.08Å; Y185-M189 HydrophobicContact CE1-CG 3.73Å; Y185-M189 HydrophobicContact CE1-SD 4.25Å; Y185-M189 WeakPolarHBondContact O-CG 3.45Å; Y185-M189 PolarHBondContact O-N 3.45Å; S186-M189 PolarHBondContact O-N 3.22Å; M189-L192 PolarHBondContact O-N 3.38Å; M189-L192 HydrophobicContact SD-CD1 4.16Å; M189-M193 WeakPolarHBondContact O-CB 3.16Å; M189-M193 VanDerWaalsContact O-CG 3.27Å; M189-M193 WeakPolarHBondContact O-CG 2.93Å; M189-M193 PolarHBondContact O-N 3.36Å |
| 190 | Q | 78.8 | Confident | 76.8 | Confident | 108 Ų | 108 | 66.7 Ų | 66.7 | 51% | 0.505 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.7 | -40.1 | 173.4 | -71.3 | 177.4 | 22 | 0 | 0 | 113 | S186 Q187 L188 M193 N194 | S186-Q190 WeakPolarHBondContact O-CG 3.28Å; S186-Q190 PolarHBondContact O-N 3.11Å; S186-Q190 VanDerWaalsContact O-N 3.1Å; Q187-Q190 PolarHBondContact O-N 3.18Å; L188-Q190 VanDerWaalsContact C-N 3.28Å; L188-Q190 PolarHBondContact O-N 3.34Å; Q190-M193 HydrophobicContact CG-CE 4.23Å; Q190-N194 PolarHBondContact O-N 3.25Å; Q190-N194 PolarHBondContact O-ND2 3.36Å |
| 191 | K | 85.2 | Confident | 78.8 | Confident | 64 Ų | 64 | 67.4 Ų | 67.4 | 28% | 0.278 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -65.4 | -43 | 174.9 | -76 | 180 | 177.1 | -70 | 0 | 111.8 | Q187 L188 N194 L195 E202 V203 Y206 | Q187-K191 WeakPolarHBondContact O-CG 2.96Å; Q187-K191 PolarHBondContact O-N 3.28Å; L188-K191 WeakPolarHBondContact O-CB 3.21Å; L188-K191 PolarHBondContact O-N 3.05Å; K191-N194 CarbonylContact O-C 3.56Å; K191-N194 PolarHBondContact O-N 3.39Å; K191-L195 PolarHBondContact O-N 3.09Å; K191-E202 IonicContact NZ-OE1 3.67Å; K191-E202 PolarHBondContact NZ-OE1 3.46Å; K191-V203 HydrophobicContact CB-CG2 3.94Å; K191-Y206 HydrophobicContact CD-CD1 3.78Å; K191-Y206 HydrophobicContact CD-CE1 4.24Å; K191-Y206 HydrophobicContact CD-CG 4.03Å |
| 192 | L | 83.4 | Confident | 80.3 | Confident | 11 Ų | 11 | 66.4 Ų | 66.4 | 6% | 0.058 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -66.2 | -40.1 | 178.3 | -69.5 | 169.5 | 0 | 0 | 0 | 112.5 | L188 M189 N194 L195 V203 I207 L231 L235 M271 | L188-L192 HydrophobicContact CD1-CD1 3.95Å; L188-L192 HydrophobicContact CD1-CG 3.99Å; L188-L192 HydrophobicContact CD2-CD1 4.41Å; L188-L192 HydrophobicContact CG-CD1 3.79Å; L188-L192 HydrophobicContact CG-CG 4.28Å; L188-L192 WeakPolarHBondContact O-CG 3.27Å; L188-L192 PolarHBondContact O-N 2.92Å; M189-L192 PolarHBondContact O-N 3.38Å; M189-L192 HydrophobicContact SD-CD1 4.16Å; L192-N194 PolarHBondContact O-N 3.13Å; L192-L195 VanDerWaalsContact O-CB 3.26Å; L192-L195 WeakPolarHBondContact O-CB 2.73Å; L192-L195 PolarHBondContact O-N 2.96Å; L192-V203 HydrophobicContact CD2-CG1 3.65Å; L192-V203 HydrophobicContact CG-CG1 4.28Å; L192-I207 HydrophobicContact CD2-CD1 4.42Å; L192-L231 HydrophobicContact CD1-CD2 4.17Å; L192-L231 HydrophobicContact CD2-CD2 4.39Å; L192-L235 HydrophobicContact CD2-CD1 3.99Å; L192-M271 HydrophobicContact CB-CE 4Å; L192-M271 HydrophobicContact CB-SD 4.18Å; L192-M271 HydrophobicContact CD1-CE 4.48Å; L192-M271 HydrophobicContact CD2-CE 4.15Å; L192-M271 HydrophobicContact CD2-SD 3.56Å; L192-M271 VanDerWaalsContact CD2-SD 3.56Å; L192-M271 HydrophobicContact CG-CE 4.44Å; L192-M271 HydrophobicContact CG-SD 4.39Å |
| 193 | M | 76.9 | Confident | 81.5 | Confident | 137 Ų | 137 | 64.4 Ų | 64.4 | 68% | 0.675 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -63.8 | -25.7 | 177 | -76.2 | -171.4 | -60.3 | 0 | 0 | 113.4 | M189 Q190 | M189-M193 WeakPolarHBondContact O-CB 3.16Å; M189-M193 VanDerWaalsContact O-CG 3.27Å; M189-M193 WeakPolarHBondContact O-CG 2.93Å; M189-M193 PolarHBondContact O-N 3.36Å; Q190-M193 HydrophobicContact CG-CE 4.23Å |
| 194 | N | 81.1 | Confident | 82.4 | Confident | 126 Ų | 126 | 61.2 Ų | 61.2 | 67% | 0.674 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108.6 | 20.3 | 179.2 | -61.5 | -64 | 0 | 0 | 0 | 112.1 | Q190 K191 L192 S196 | Q190-N194 PolarHBondContact O-N 3.25Å; Q190-N194 PolarHBondContact O-ND2 3.36Å; K191-N194 CarbonylContact O-C 3.56Å; K191-N194 PolarHBondContact O-N 3.39Å; L192-N194 PolarHBondContact O-N 3.13Å; N194-S196 PolarHBondContact O-N 2.78Å |
| 195 | L | 86.4 | Confident | 83.2 | Confident | 28 Ų | 28 | 67.5 Ų | 67.5 | 15% | 0.147 | 36% | 0.36 | C | S | . | . | trans | -63.7 | 136.3 | -175 | -169.9 | 69.9 | 0 | 0 | 0 | 110.9 | K191 L192 V200 V203 L235 L270 M271 | K191-L195 PolarHBondContact O-N 3.09Å; L192-L195 VanDerWaalsContact O-CB 3.26Å; L192-L195 WeakPolarHBondContact O-CB 2.73Å; L192-L195 PolarHBondContact O-N 2.96Å; L195-V200 HydrophobicContact CD1-CG2 4.12Å; L195-V200 HydrophobicContact CD2-CG2 4.37Å; L195-V200 HydrophobicContact CG-CG2 4.33Å; L195-V203 HydrophobicContact CD1-CB 3.93Å; L195-V203 HydrophobicContact CD1-CG1 4.29Å; L195-V203 HydrophobicContact CD1-CG2 3.6Å; L195-L235 HydrophobicContact CD2-CD1 4.39Å; L195-L235 HydrophobicContact CD2-CD2 3.62Å; L195-L270 HydrophobicContact CD2-CB 4.29Å; L195-L270 HydrophobicContact CG-CD1 4.48Å; L195-M271 HydrophobicContact CB-CG 4.39Å; L195-M271 HydrophobicContact CD2-CG 3.78Å; L195-M271 HydrophobicContact CD2-SD 4.01Å | ||
| 196 | S | 87.3 | Confident | 83.9 | Confident | 52 Ų | 52 | 66.5 Ų | 66.5 | 36% | 0.364 | 36% | 0.357 | S | S | . | . | trans | -139.5 | 160.3 | 170.2 | 50.8 | 0 | 0 | 0 | 0 | 109 | N194 G198 H199 | N194-S196 PolarHBondContact O-N 2.78Å; S196-G198 PolarHBondContact O-N 3.39Å; S196-H199 PolarHBondContact O-N 2.86Å; S196-H199 PolarHBondContact OG-ND1 3.09Å | ||
| 197 | S | 82.6 | Confident | 84.6 | Confident | 68 Ų | 68 | 63.9 Ų | 63.9 | 48% | 0.476 | 34% | 0.338 | S | S | . | . | G | 310 helix | trans | -54 | -31.4 | -173.8 | 53.1 | 0 | 0 | 0 | 0 | 114.3 | H199 N239 | S197-H199 VanDerWaalsContact C-N 3.3Å; S197-H199 PolarHBondContact O-N 3.31Å; S197-N239 VanDerWaalsContact CA-OD1 3.24Å; S197-N239 WeakPolarHBondContact CA-OD1 3.42Å; S197-N239 VanDerWaalsContact CB-OD1 3.26Å; S197-N239 WeakPolarHBondContact CB-OD1 3.46Å; S197-N239 PolarHBondContact O-ND2 3.36Å; S197-N239 PolarHBondContact O-OD1 3.37Å; S197-N239 VanDerWaalsContact O-OD1 3.12Å |
| 198 | G | 83.9 | Confident | 84.7 | Confident | 70 Ų | 70 | 63 Ų | 63 | 72% | 0.722 | 34% | 0.335 | S | S | * | . | G | 310 helix | trans | -74.6 | -10.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | S196 | S196-G198 PolarHBondContact O-N 3.39Š|
| 199 | H | 88.4 | Confident | 84.8 | Confident | 96 Ų | 96 | 66.9 Ų | 66.9 | 44% | 0.444 | 35% | 0.353 | S | S | . | . | G | 310 helix | trans | -116.6 | 1.5 | -174.7 | -61.2 | 93.7 | 0 | 0 | 0 | 113.4 | S196 S197 D201 E202 V203 | S196-H199 PolarHBondContact O-N 2.86Å; S196-H199 PolarHBondContact OG-ND1 3.09Å; S197-H199 VanDerWaalsContact C-N 3.3Å; S197-H199 PolarHBondContact O-N 3.31Å; H199-D201 PolarHBondContact O-N 2.92Å; H199-E202 IonicContact CD2-OE2 3.77Å; H199-E202 WeakPolarHBondContact O-CB 3.32Å; H199-E202 PolarHBondContact O-N 2.94Å; H199-V203 WeakPolarHBondContact O-CG2 3.43Å; H199-V203 PolarHBondContact O-N 3.07Å |
| 200 | V | 89.1 | Confident | 84.8 | Confident | 0 Ų | 0 | 63.8 Ų | 63.8 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -59.1 | -45.8 | -176.5 | 176.8 | 0 | 0 | 0 | 0 | 111.9 | L195 E202 V203 N204 L235 N239 L270 | L195-V200 HydrophobicContact CD1-CG2 4.12Å; L195-V200 HydrophobicContact CD2-CG2 4.37Å; L195-V200 HydrophobicContact CG-CG2 4.33Å; V200-E202 VanDerWaalsContact C-N 3.29Å; V200-E202 PolarHBondContact O-N 3.21Å; V200-V203 PolarHBondContact O-N 3.27Å; V200-N204 WeakPolarHBondContact O-CB 3.4Å; V200-N204 PolarHBondContact O-N 3.44Å; V200-L235 HydrophobicContact CG1-CB 4.06Å; V200-N239 HydrophobicContact CB-CB 4.13Å; V200-N239 HydrophobicContact CG1-CB 3.99Å; V200-N239 HydrophobicContact CG2-CB 3.91Å; V200-L270 HydrophobicContact CG2-CD1 4.46Å; V200-L270 HydrophobicContact CG2-CD2 3.9Å |
| 201 | D | 89.3 | Confident | 84.5 | Confident | 118 Ų | 118 | 58.9 Ų | 58.9 | 63% | 0.631 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -60.5 | -38.7 | 178.4 | -63.3 | -12.6 | 0 | 0 | 0 | 112.3 | H199 K205 | H199-D201 PolarHBondContact O-N 2.92Å; D201-K205 WeakPolarHBondContact O-CB 3.36Å; D201-K205 PolarHBondContact O-N 3.02Å |
| 202 | E | 89.3 | Confident | 84.1 | Confident | 99 Ų | 99 | 62.5 Ų | 62.5 | 46% | 0.463 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -66.1 | -45 | 177.4 | -170.1 | -162.3 | 142.2 | 0 | 0 | 110.8 | K191 H199 V200 K205 Y206 | K191-E202 IonicContact NZ-OE1 3.67Å; K191-E202 PolarHBondContact NZ-OE1 3.46Å; H199-E202 IonicContact CD2-OE2 3.77Å; H199-E202 WeakPolarHBondContact O-CB 3.32Å; H199-E202 PolarHBondContact O-N 2.94Å; V200-E202 VanDerWaalsContact C-N 3.29Å; V200-E202 PolarHBondContact O-N 3.21Å; E202-K205 PolarHBondContact O-N 3.44Å; E202-Y206 WeakPolarHBondContact O-CB 3.26Å; E202-Y206 PolarHBondContact O-N 2.94Å |
| 203 | V | 88.6 | Confident | 83.6 | Confident | 4 Ų | 4 | 65.8 Ų | 65.8 | 2% | 0.024 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -67.6 | -42.6 | 178.9 | 176.2 | 0 | 0 | 0 | 0 | 111 | L188 K191 L192 L195 H199 V200 K205 Y206 I207 | L188-V203 HydrophobicContact CD1-CG1 4.23Å; K191-V203 HydrophobicContact CB-CG2 3.94Å; L192-V203 HydrophobicContact CD2-CG1 3.65Å; L192-V203 HydrophobicContact CG-CG1 4.28Å; L195-V203 HydrophobicContact CD1-CB 3.93Å; L195-V203 HydrophobicContact CD1-CG1 4.29Å; L195-V203 HydrophobicContact CD1-CG2 3.6Å; H199-V203 WeakPolarHBondContact O-CG2 3.43Å; H199-V203 PolarHBondContact O-N 3.07Å; V200-V203 PolarHBondContact O-N 3.27Å; V203-K205 VanDerWaalsContact C-N 3.34Å; V203-K205 PolarHBondContact O-N 3.43Å; V203-Y206 CarbonylContact O-C 3.49Å; V203-Y206 WeakPolarHBondContact O-CA 3.39Å; V203-Y206 WeakPolarHBondContact O-CB 3.23Å; V203-Y206 PolarHBondContact O-N 3.37Å; V203-I207 HydrophobicContact CG1-CD1 3.94Å; V203-I207 HydrophobicContact CG1-CG1 4.29Å; V203-I207 VanDerWaalsContact O-CG1 3.3Å; V203-I207 WeakPolarHBondContact O-CG1 3.45Å; V203-I207 PolarHBondContact O-N 2.63Å |
| 204 | N | 89.1 | Confident | 83 | Confident | 11 Ų | 11 | 62.6 Ų | 62.6 | 6% | 0.059 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -62.7 | -41 | 176.4 | -78.6 | -8.2 | 0 | 0 | 0 | 112 | V200 Y206 I207 M208 A232 L235 D236 | V200-N204 WeakPolarHBondContact O-CB 3.4Å; V200-N204 PolarHBondContact O-N 3.44Å; N204-Y206 VanDerWaalsContact C-N 3.28Å; N204-Y206 PolarHBondContact O-N 3.19Å; N204-I207 PolarHBondContact O-N 3.42Å; N204-M208 WeakPolarHBondContact O-CG 3.48Å; N204-M208 PolarHBondContact O-N 3.23Å; N204-A232 HydrophobicContact CB-CB 4.3Å; N204-A232 PolarHBondContact ND2-O 3.14Å; N204-A232 VanDerWaalsContact ND2-O 3.12Å; N204-A232 WeakPolarHBondContact OD1-CA 3.45Å; N204-L235 WeakPolarHBondContact OD1-CD1 3.41Å; N204-D236 PolarHBondContact ND2-OD1 3.04Å |
| 205 | K | 87.8 | Confident | 82 | Confident | 141 Ų | 141 | 57 Ų | 57 | 61% | 0.613 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -59.6 | -41.6 | 171.4 | -175.8 | 176.9 | -179.9 | -179.7 | 0 | 111.6 | D201 E202 V203 M208 Q209 | D201-K205 WeakPolarHBondContact O-CB 3.36Å; D201-K205 PolarHBondContact O-N 3.02Å; E202-K205 PolarHBondContact O-N 3.44Å; V203-K205 VanDerWaalsContact C-N 3.34Å; V203-K205 PolarHBondContact O-N 3.43Å; K205-M208 PolarHBondContact O-N 3.34Å; K205-Q209 VanDerWaalsContact O-CG 3.25Å; K205-Q209 WeakPolarHBondContact O-CG 3.46Å; K205-Q209 PolarHBondContact O-N 2.94Å |
| 206 | Y | 86.7 | Confident | 80.8 | Confident | 35 Ų | 35 | 59.6 Ų | 59.6 | 14% | 0.137 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -68.7 | -39.9 | 178.9 | -167.6 | -107.3 | 0 | 0 | 0 | 112.6 | S184 Q187 L188 K191 E202 V203 N204 M208 Q209 I210 | S184-Y206 WeakPolarHBondContact CA-OH 3.28Å; S184-Y206 WeakPolarHBondContact O-CE1 3.46Å; S184-Y206 PolarHBondContact O-OH 2.87Å; Q187-Y206 HydrophobicContact CB-CE1 4.16Å; Q187-Y206 WeakPolarHBondContact CB-OH 3.37Å; Q187-Y206 PolarHBondContact OE1-OH 2.87Å; L188-Y206 HydrophobicContact CB-CD1 4.08Å; L188-Y206 HydrophobicContact CB-CE1 3.84Å; L188-Y206 HydrophobicContact CD1-CD1 3.98Å; K191-Y206 HydrophobicContact CD-CD1 3.78Å; K191-Y206 HydrophobicContact CD-CE1 4.24Å; K191-Y206 HydrophobicContact CD-CG 4.03Å; E202-Y206 WeakPolarHBondContact O-CB 3.26Å; E202-Y206 PolarHBondContact O-N 2.94Å; V203-Y206 CarbonylContact O-C 3.49Å; V203-Y206 WeakPolarHBondContact O-CA 3.39Å; V203-Y206 WeakPolarHBondContact O-CB 3.23Å; V203-Y206 PolarHBondContact O-N 3.37Å; N204-Y206 VanDerWaalsContact C-N 3.28Å; N204-Y206 PolarHBondContact O-N 3.19Å; Y206-M208 PolarHBondContact O-N 2.88Å; Y206-Q209 WeakPolarHBondContact O-CB 3.29Å; Y206-Q209 PolarHBondContact O-N 3.22Å; Y206-I210 HydrophobicContact CD1-CD1 3.81Å; Y206-I210 HydrophobicContact CE1-CD1 3.42Å; Y206-I210 VanDerWaalsContact CE1-CD1 3.42Å; Y206-I210 HydrophobicContact CE1-CG1 4.25Å; Y206-I210 WeakPolarHBondContact O-CG1 3.22Å; Y206-I210 PolarHBondContact O-N 2.77Å |
| 207 | I | 84.5 | Confident | 79.4 | Confident | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -56.4 | -50 | 172.2 | -70.9 | 168 | 0 | 0 | 0 | 110.3 | L188 L192 V203 N204 Q209 I210 A211 S228 L231 A232 L235 | L188-I207 HydrophobicContact CD1-CD1 4.24Å; L188-I207 HydrophobicContact CD1-CG1 3.39Å; L188-I207 HydrophobicContact CD2-CG1 4.18Å; L188-I207 HydrophobicContact CG-CG1 4.42Å; L192-I207 HydrophobicContact CD2-CD1 4.42Å; V203-I207 HydrophobicContact CG1-CD1 3.94Å; V203-I207 HydrophobicContact CG1-CG1 4.29Å; V203-I207 VanDerWaalsContact O-CG1 3.3Å; V203-I207 WeakPolarHBondContact O-CG1 3.45Å; V203-I207 PolarHBondContact O-N 2.63Å; N204-I207 PolarHBondContact O-N 3.42Å; I207-Q209 VanDerWaalsContact C-N 3.33Å; I207-Q209 PolarHBondContact O-N 3.41Å; I207-I210 PolarHBondContact O-N 3.46Å; I207-A211 WeakPolarHBondContact O-CB 3.25Å; I207-A211 PolarHBondContact O-N 3.43Å; I207-S228 VanDerWaalsContact CG2-O 3.22Å; I207-S228 WeakPolarHBondContact CG2-O 3.31Å; I207-L231 HydrophobicContact CD1-CD2 3.97Å; I207-L231 HydrophobicContact CD1-CG 4.13Å; I207-A232 HydrophobicContact CG2-CB 4.36Å; I207-L235 HydrophobicContact CD1-CD1 3.9Å |
| 208 | M | 82.4 | Confident | 78.2 | Confident | 74 Ų | 74 | 62.7 Ų | 62.7 | 37% | 0.365 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -65.7 | -36.5 | 179.6 | -66.2 | -58.5 | -69.1 | 0 | 0 | 112.1 | N204 K205 Y206 A211 E212 | N204-M208 WeakPolarHBondContact O-CG 3.48Å; N204-M208 PolarHBondContact O-N 3.23Å; K205-M208 PolarHBondContact O-N 3.34Å; Y206-M208 PolarHBondContact O-N 2.88Å; M208-A211 PolarHBondContact O-N 3.37Å; M208-E212 WeakPolarHBondContact O-CB 3.15Å; M208-E212 VanDerWaalsContact O-CG 3.32Å; M208-E212 WeakPolarHBondContact O-CG 3.34Å; M208-E212 PolarHBondContact O-N 3.23Å |
| 209 | Q | 83.2 | Confident | 76.9 | Confident | 90 Ų | 90 | 67.2 Ų | 67.2 | 42% | 0.421 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -60.5 | -46.1 | 173.6 | -77.4 | 173.7 | -16.6 | 0 | 0 | 112.1 | K205 Y206 I207 E212 S213 | K205-Q209 VanDerWaalsContact O-CG 3.25Å; K205-Q209 WeakPolarHBondContact O-CG 3.46Å; K205-Q209 PolarHBondContact O-N 2.94Å; Y206-Q209 WeakPolarHBondContact O-CB 3.29Å; Y206-Q209 PolarHBondContact O-N 3.22Å; I207-Q209 VanDerWaalsContact C-N 3.33Å; I207-Q209 PolarHBondContact O-N 3.41Å; Q209-E212 PolarHBondContact O-N 3.49Å; Q209-S213 WeakPolarHBondContact O-CB 2.99Å; Q209-S213 PolarHBondContact O-N 2.9Å; Q209-S213 PolarHBondContact O-OG 2.92Å |
| 210 | I | 76 | Confident | 75.3 | Confident | 7 Ų | 7 | 65.8 Ų | 65.8 | 4% | 0.036 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -62 | -46.3 | 177.3 | -68.5 | 172.4 | 0 | 0 | 0 | 110.5 | S184 L188 Y206 I207 E212 S213 E214 | S184-I210 WeakPolarHBondContact O-CD1 3.47Å; L188-I210 HydrophobicContact CB-CD1 3.67Å; L188-I210 HydrophobicContact CD2-CD1 3.98Å; L188-I210 HydrophobicContact CG-CD1 4.31Å; Y206-I210 HydrophobicContact CD1-CD1 3.81Å; Y206-I210 HydrophobicContact CE1-CD1 3.42Å; Y206-I210 VanDerWaalsContact CE1-CD1 3.42Å; Y206-I210 HydrophobicContact CE1-CG1 4.25Å; Y206-I210 WeakPolarHBondContact O-CG1 3.22Å; Y206-I210 PolarHBondContact O-N 2.77Å; I207-I210 PolarHBondContact O-N 3.46Å; I210-E212 VanDerWaalsContact C-N 3.31Å; I210-E212 PolarHBondContact O-N 3.16Å; I210-S213 PolarHBondContact O-N 3.33Å; I210-E214 PolarHBondContact O-N 2.95Å |
| 211 | A | 74.5 | Confident | 74 | Confident | 6 Ų | 6 | 66.9 Ų | 66.9 | 5% | 0.05 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -58.1 | -42.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I207 M208 V215 V225 | I207-A211 WeakPolarHBondContact O-CB 3.25Å; I207-A211 PolarHBondContact O-N 3.43Å; M208-A211 PolarHBondContact O-N 3.37Å; A211-V215 WeakPolarHBondContact O-CB 3.37Å; A211-V225 HydrophobicContact CB-CB 4.42Å; A211-V225 HydrophobicContact CB-CG2 3.76Å; A211-V225 WeakPolarHBondContact O-CG2 3.43Å |
| 212 | E | 74.9 | Confident | 72.8 | Confident | 139 Ų | 139 | 66.9 Ų | 66.9 | 65% | 0.65 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -78.9 | -32.5 | -179.5 | -71.7 | 175.2 | -179.3 | 0 | 0 | 113.7 | M208 Q209 I210 A216 | M208-E212 WeakPolarHBondContact O-CB 3.15Å; M208-E212 VanDerWaalsContact O-CG 3.32Å; M208-E212 WeakPolarHBondContact O-CG 3.34Å; M208-E212 PolarHBondContact O-N 3.23Å; Q209-E212 PolarHBondContact O-N 3.49Å; I210-E212 VanDerWaalsContact C-N 3.31Å; I210-E212 PolarHBondContact O-N 3.16Å; E212-A216 VanDerWaalsContact O-CB 3.27Å; E212-A216 WeakPolarHBondContact O-CB 3.34Å |
| 213 | S | 74.3 | Confident | 71.7 | Confident | 81 Ų | 81 | 67.1 Ų | 67.1 | 57% | 0.566 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -94.3 | -45.8 | -172.9 | 69 | 0 | 0 | 0 | 0 | 114.6 | Q209 I210 | Q209-S213 WeakPolarHBondContact O-CB 2.99Å; Q209-S213 PolarHBondContact O-N 2.9Å; Q209-S213 PolarHBondContact O-OG 2.92Å; I210-S213 PolarHBondContact O-N 3.33Å |
| 214 | E | 63.2 | Low | 70.6 | Confident | 70 Ų | 70 | 69.7 Ų | 69.7 | 33% | 0.327 | 38% | 0.383 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.4 | -22.2 | -170 | -68.2 | -173.6 | 168.6 | 0 | 0 | 113 | I182 S184 I210 | I182-E214 WeakPolarHBondContact CG2-OE2 3.16Å; S184-E214 WeakPolarHBondContact CB-OE1 3.47Å; S184-E214 PolarHBondContact OG-OE1 3.01Å; S184-E214 PolarHBondContact OG-OE2 3.35Å; I210-E214 PolarHBondContact O-N 2.95Å |
| 215 | V | 61.5 | Low | 69.7 | Low | 7 Ų | 7 | 71.5 Ų | 71.5 | 4% | 0.042 | 39% | 0.394 | C | S | . | . | S | Bend | trans | -96.2 | -25.9 | -176.3 | -175.9 | 0 | 0 | 0 | 0 | 112.6 | A211 S217 N218 V221 I224 V225 | A211-V215 WeakPolarHBondContact O-CB 3.37Å; V215-S217 PolarHBondContact O-N 3.27Å; V215-N218 PolarHBondContact O-N 3.19Å; V215-N218 VanDerWaalsContact O-N 3.11Å; V215-V221 HydrophobicContact CB-CB 4.34Å; V215-V221 HydrophobicContact CB-CG1 3.74Å; V215-V221 HydrophobicContact CG1-CB 3.72Å; V215-V221 HydrophobicContact CG1-CG1 3.5Å; V215-V221 VanDerWaalsContact CG1-CG1 3.5Å; V215-V221 WeakPolarHBondContact CG1-O 3.34Å; V215-V221 HydrophobicContact CG2-CB 4.48Å; V215-V221 HydrophobicContact CG2-CG1 3.4Å; V215-V221 VanDerWaalsContact CG2-CG1 3.4Å; V215-I224 HydrophobicContact CG2-CB 4.46Å; V215-I224 HydrophobicContact CG2-CG2 4.33Å; V215-V225 HydrophobicContact CB-CG2 3.33Å; V215-V225 HydrophobicContact CG1-CB 3.96Å; V215-V225 HydrophobicContact CG1-CG2 3.15Å; V215-V225 HydrophobicContact CG2-CG2 3.85Å |
| 216 | A | 60.2 | Low | 69.1 | Low | 84 Ų | 84 | 69 Ų | 69 | 69% | 0.694 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.7 | -19.4 | -173.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | E212 | E212-A216 VanDerWaalsContact O-CB 3.27Å; E212-A216 WeakPolarHBondContact O-CB 3.34Å |
| 217 | S | 57.1 | Low | 68.6 | Low | 112 Ų | 112 | 72.4 Ų | 72.4 | 78% | 0.783 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.7 | -2.2 | -179.3 | 55.5 | 0 | 0 | 0 | 0 | 115.5 | V215 | V215-S217 PolarHBondContact O-N 3.27Š|
| 218 | N | 58.4 | Low | 68.3 | Low | 72 Ų | 72 | 72.8 Ų | 72.8 | 39% | 0.385 | 41% | 0.407 | S | S | . | . | trans | -127.2 | 111 | -174.4 | -167.9 | -17.3 | 0 | 0 | 0 | 112.3 | V215 A220 V221 K222 | V215-N218 PolarHBondContact O-N 3.19Å; V215-N218 VanDerWaalsContact O-N 3.11Å; N218-A220 PolarHBondContact O-N 3.01Å; N218-A220 VanDerWaalsContact OD1-CB 3.24Å; N218-A220 WeakPolarHBondContact OD1-CB 3.26Å; N218-A220 PolarHBondContact OD1-N 3.38Å; N218-V221 HydrophobicContact CB-CB 4.09Å; N218-V221 HydrophobicContact CB-CG2 3.65Å; N218-V221 WeakPolarHBondContact O-CA 3.45Å; N218-V221 WeakPolarHBondContact O-CB 3.37Å; N218-V221 PolarHBondContact O-N 3.37Å; N218-K222 PolarHBondContact O-N 3.44Å | ||
| 219 | L | 57.3 | Low | 68.3 | Low | 165 Ų | 165 | 71.5 Ų | 71.5 | 86% | 0.864 | 41% | 0.406 | S | S | * | . | G | 310 helix | trans | -56.1 | -32.1 | 175.9 | -94.6 | 138.5 | 0 | 0 | 0 | 113.1 | V221 K222 | L219-V221 PolarHBondContact O-N 3.28Å; L219-K222 PolarHBondContact O-N 2.94Å |
| 220 | A | 54.4 | Low | 68.4 | Low | 67 Ų | 67 | 72.1 Ų | 72.1 | 55% | 0.554 | 41% | 0.409 | S | S | * | . | G | 310 helix | trans | -66 | -17.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.8 | N218 | N218-A220 PolarHBondContact O-N 3.01Å; N218-A220 VanDerWaalsContact OD1-CB 3.24Å; N218-A220 WeakPolarHBondContact OD1-CB 3.26Å; N218-A220 PolarHBondContact OD1-N 3.38Å |
| 221 | V | 60.8 | Low | 69 | Low | 22 Ų | 22 | 74 Ų | 74 | 13% | 0.133 | 42% | 0.419 | C | S | . | . | G | 310 helix | trans | -108.4 | -6.6 | -171 | -167.9 | 0 | 0 | 0 | 0 | 110.8 | V215 N218 L219 N223 I224 V225 | V215-V221 HydrophobicContact CB-CB 4.34Å; V215-V221 HydrophobicContact CB-CG1 3.74Å; V215-V221 HydrophobicContact CG1-CB 3.72Å; V215-V221 HydrophobicContact CG1-CG1 3.5Å; V215-V221 VanDerWaalsContact CG1-CG1 3.5Å; V215-V221 WeakPolarHBondContact CG1-O 3.34Å; V215-V221 HydrophobicContact CG2-CB 4.48Å; V215-V221 HydrophobicContact CG2-CG1 3.4Å; V215-V221 VanDerWaalsContact CG2-CG1 3.4Å; N218-V221 HydrophobicContact CB-CB 4.09Å; N218-V221 HydrophobicContact CB-CG2 3.65Å; N218-V221 WeakPolarHBondContact O-CA 3.45Å; N218-V221 WeakPolarHBondContact O-CB 3.37Å; N218-V221 PolarHBondContact O-N 3.37Å; L219-V221 PolarHBondContact O-N 3.28Å; V221-N223 PolarHBondContact O-N 3.34Å; V221-N223 VanDerWaalsContact O-N 3.07Å; V221-I224 HydrophobicContact CB-CD1 4.48Å; V221-I224 HydrophobicContact CG1-CB 3.8Å; V221-I224 HydrophobicContact CG1-CD1 3.58Å; V221-I224 HydrophobicContact CG1-CG1 3.98Å; V221-I224 HydrophobicContact CG1-CG2 4.44Å; V221-I224 WeakPolarHBondContact O-CA 3.36Å; V221-I224 VanDerWaalsContact O-CB 3.23Å; V221-I224 WeakPolarHBondContact O-CB 2.97Å; V221-I224 PolarHBondContact O-N 3.27Å; V221-V225 PolarHBondContact O-N 2.94Å |
| 222 | K | 65.3 | Low | 69.6 | Low | 119 Ų | 119 | 74.1 Ų | 74.1 | 52% | 0.517 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -48.5 | -41.7 | 178.9 | -176.7 | -175.4 | 172 | -167.7 | 0 | 112.9 | N218 L219 I224 V225 E226 | N218-K222 PolarHBondContact O-N 3.44Å; L219-K222 PolarHBondContact O-N 2.94Å; K222-I224 PolarHBondContact O-N 3.35Å; K222-V225 PolarHBondContact O-N 3.42Å; K222-V225 VanDerWaalsContact O-N 3.12Å; K222-E226 VanDerWaalsContact CE-OE1 3.3Å; K222-E226 WeakPolarHBondContact CE-OE1 3.35Å; K222-E226 IonicContact NZ-OE1 2.73Å; K222-E226 PolarHBondContact O-N 3.36Å |
| 223 | N | 65.5 | Low | 70.3 | Confident | 104 Ų | 104 | 69.5 Ų | 69.5 | 56% | 0.556 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -61.4 | -31.4 | 176.7 | -65.1 | -9 | 0 | 0 | 0 | 112.4 | V221 E226 I227 | V221-N223 PolarHBondContact O-N 3.34Å; V221-N223 VanDerWaalsContact O-N 3.07Å; N223-E226 PolarHBondContact O-N 3.1Å; N223-I227 WeakPolarHBondContact O-CB 3.35Å; N223-I227 WeakPolarHBondContact O-CD1 3.32Å; N223-I227 WeakPolarHBondContact O-CG1 3.42Å; N223-I227 PolarHBondContact O-N 3.39Å |
| 224 | I | 66.6 | Low | 71.2 | Confident | 57 Ų | 57 | 66.3 Ų | 66.3 | 29% | 0.292 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -68 | -37.2 | 176.3 | -59.1 | -180 | 0 | 0 | 0 | 110.8 | V215 V221 K222 S228 | V215-I224 HydrophobicContact CG2-CB 4.46Å; V215-I224 HydrophobicContact CG2-CG2 4.33Å; V221-I224 HydrophobicContact CB-CD1 4.48Å; V221-I224 HydrophobicContact CG1-CB 3.8Å; V221-I224 HydrophobicContact CG1-CD1 3.58Å; V221-I224 HydrophobicContact CG1-CG1 3.98Å; V221-I224 HydrophobicContact CG1-CG2 4.44Å; V221-I224 WeakPolarHBondContact O-CA 3.36Å; V221-I224 VanDerWaalsContact O-CB 3.23Å; V221-I224 WeakPolarHBondContact O-CB 2.97Å; V221-I224 PolarHBondContact O-N 3.27Å; K222-I224 PolarHBondContact O-N 3.35Å; I224-S228 WeakPolarHBondContact O-CA 3.39Å; I224-S228 WeakPolarHBondContact O-CB 3.08Å; I224-S228 PolarHBondContact O-N 2.92Å; I224-S228 PolarHBondContact O-OG 2.9Å |
| 225 | V | 68.5 | Low | 72.6 | Confident | 49 Ų | 49 | 63 Ų | 63 | 30% | 0.297 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -61.7 | -47.1 | 172.5 | 158.8 | 0 | 0 | 0 | 0 | 110.8 | A211 V215 V221 K222 S228 S229 | A211-V225 HydrophobicContact CB-CB 4.42Å; A211-V225 HydrophobicContact CB-CG2 3.76Å; A211-V225 WeakPolarHBondContact O-CG2 3.43Å; V215-V225 HydrophobicContact CB-CG2 3.33Å; V215-V225 HydrophobicContact CG1-CB 3.96Å; V215-V225 HydrophobicContact CG1-CG2 3.15Å; V215-V225 HydrophobicContact CG2-CG2 3.85Å; V221-V225 PolarHBondContact O-N 2.94Å; K222-V225 PolarHBondContact O-N 3.42Å; K222-V225 VanDerWaalsContact O-N 3.12Å; V225-S228 PolarHBondContact O-N 3.32Å; V225-S229 WeakPolarHBondContact O-CB 3.39Å; V225-S229 PolarHBondContact O-N 3.4Å; V225-S229 PolarHBondContact O-OG 2.89Å |
| 226 | E | 75.3 | Confident | 74 | Confident | 90 Ų | 90 | 66 Ų | 66 | 42% | 0.421 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.3 | -51.3 | -179.6 | -68.1 | 176.9 | -175.6 | 0 | 0 | 110.2 | K222 N223 S228 S229 E230 | K222-E226 VanDerWaalsContact CE-OE1 3.3Å; K222-E226 WeakPolarHBondContact CE-OE1 3.35Å; K222-E226 IonicContact NZ-OE1 2.73Å; K222-E226 PolarHBondContact O-N 3.36Å; N223-E226 PolarHBondContact O-N 3.1Å; E226-S228 VanDerWaalsContact C-N 3.33Å; E226-S228 PolarHBondContact O-N 3.41Å; E226-S229 PolarHBondContact O-N 3.39Å; E226-S229 PolarHBondContact O-OG 3.07Å; E226-E230 PolarHBondContact O-N 3.17Å |
| 227 | I | 77.6 | Confident | 75.6 | Confident | 105 Ų | 105 | 63.5 Ų | 63.5 | 54% | 0.538 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -59.8 | -40.7 | 176.3 | -67.4 | 164.7 | 0 | 0 | 0 | 111.8 | N223 E230 L231 | N223-I227 WeakPolarHBondContact O-CB 3.35Å; N223-I227 WeakPolarHBondContact O-CD1 3.32Å; N223-I227 WeakPolarHBondContact O-CG1 3.42Å; N223-I227 PolarHBondContact O-N 3.39Å; I227-E230 PolarHBondContact O-N 3.13Å; I227-L231 WeakPolarHBondContact O-CB 3.5Å; I227-L231 PolarHBondContact O-N 2.99Å |
| 228 | S | 78.3 | Confident | 77.4 | Confident | 9 Ų | 9 | 58.2 Ų | 58.2 | 6% | 0.063 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -64.2 | -43.6 | 178.1 | -68.3 | 0 | 0 | 0 | 0 | 111.3 | I207 I224 V225 E226 E230 L231 A232 | I207-S228 VanDerWaalsContact CG2-O 3.22Å; I207-S228 WeakPolarHBondContact CG2-O 3.31Å; I224-S228 WeakPolarHBondContact O-CA 3.39Å; I224-S228 WeakPolarHBondContact O-CB 3.08Å; I224-S228 PolarHBondContact O-N 2.92Å; I224-S228 PolarHBondContact O-OG 2.9Å; V225-S228 PolarHBondContact O-N 3.32Å; E226-S228 VanDerWaalsContact C-N 3.33Å; E226-S228 PolarHBondContact O-N 3.41Å; S228-E230 VanDerWaalsContact C-N 3.35Å; S228-L231 PolarHBondContact O-N 3.43Å; S228-A232 PolarHBondContact O-N 3.32Å |
| 229 | S | 81.4 | Confident | 79.1 | Confident | 47 Ų | 47 | 56.8 Ų | 56.8 | 33% | 0.329 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -64.9 | -40 | 177.4 | 73.7 | 0 | 0 | 0 | 0 | 111.9 | V225 E226 A232 V233 | V225-S229 WeakPolarHBondContact O-CB 3.39Å; V225-S229 PolarHBondContact O-N 3.4Å; V225-S229 PolarHBondContact O-OG 2.89Å; E226-S229 PolarHBondContact O-N 3.39Å; E226-S229 PolarHBondContact O-OG 3.07Å; S229-A232 PolarHBondContact O-N 3.33Å; S229-V233 VanDerWaalsContact O-CG2 3.29Å; S229-V233 WeakPolarHBondContact O-CG2 3.41Å; S229-V233 PolarHBondContact O-N 2.97Å; S229-V233 VanDerWaalsContact O-N 3.11Å |
| 230 | E | 86.1 | Confident | 80.9 | Confident | 103 Ų | 103 | 53.2 Ų | 53.2 | 48% | 0.481 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -65.2 | -41.7 | 174.4 | -78.3 | -174.9 | -176.3 | 0 | 0 | 112 | E226 I227 S228 V233 I234 F301 | E226-E230 PolarHBondContact O-N 3.17Å; I227-E230 PolarHBondContact O-N 3.13Å; S228-E230 VanDerWaalsContact C-N 3.35Å; E230-V233 PolarHBondContact O-N 3.36Å; E230-I234 PolarHBondContact O-N 3.39Å; E230-F301 HydrophobicContact CB-CE1 3.91Å; E230-F301 HydrophobicContact CG-CD1 4.46Å; E230-F301 HydrophobicContact CG-CE1 4.08Å |
| 231 | L | 87.7 | Confident | 82.8 | Confident | 47 Ų | 47 | 52.7 Ų | 52.7 | 25% | 0.246 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -62.4 | -44.8 | 175.8 | -178.6 | 61.3 | 0 | 0 | 0 | 111.6 | L192 I207 I227 S228 V233 I234 L235 | L192-L231 HydrophobicContact CD1-CD2 4.17Å; L192-L231 HydrophobicContact CD2-CD2 4.39Å; I207-L231 HydrophobicContact CD1-CD2 3.97Å; I207-L231 HydrophobicContact CD1-CG 4.13Å; I227-L231 WeakPolarHBondContact O-CB 3.5Å; I227-L231 PolarHBondContact O-N 2.99Å; S228-L231 PolarHBondContact O-N 3.43Å; L231-V233 VanDerWaalsContact C-N 3.3Å; L231-V233 PolarHBondContact O-N 3.24Å; L231-I234 HydrophobicContact CD1-CG2 4.11Å; L231-I234 WeakPolarHBondContact O-CG2 3.46Å; L231-I234 PolarHBondContact O-N 3.34Å; L231-L235 HydrophobicContact CD1-CD1 4.14Å; L231-L235 HydrophobicContact CD1-CG 4.08Å; L231-L235 HydrophobicContact CG-CD1 3.99Å; L231-L235 HydrophobicContact CG-CG 4.35Å; L231-L235 WeakPolarHBondContact O-CB 3.4Å; L231-L235 VanDerWaalsContact O-CG 3.23Å; L231-L235 WeakPolarHBondContact O-CG 3.41Å; L231-L235 PolarHBondContact O-N 3.47Å |
| 232 | A | 88.2 | Confident | 84.4 | Confident | 8 Ų | 8 | 52.6 Ų | 52.6 | 7% | 0.066 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60.7 | -44 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | N204 I207 S228 S229 I234 L235 D236 | N204-A232 HydrophobicContact CB-CB 4.3Å; N204-A232 PolarHBondContact ND2-O 3.14Å; N204-A232 VanDerWaalsContact ND2-O 3.12Å; N204-A232 WeakPolarHBondContact OD1-CA 3.45Å; I207-A232 HydrophobicContact CG2-CB 4.36Å; S228-A232 PolarHBondContact O-N 3.32Å; S229-A232 PolarHBondContact O-N 3.33Å; A232-I234 PolarHBondContact O-N 3.35Å; A232-L235 PolarHBondContact O-N 2.92Å; A232-D236 PolarHBondContact O-N 3.24Å |
| 233 | V | 89.7 | Confident | 85.8 | Confident | 42 Ų | 42 | 57.6 Ų | 57.6 | 26% | 0.255 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -61.6 | -44.6 | 178.3 | 164.9 | 0 | 0 | 0 | 0 | 112.6 | S229 E230 L231 Y237 K300 F301 | S229-V233 VanDerWaalsContact O-CG2 3.29Å; S229-V233 WeakPolarHBondContact O-CG2 3.41Å; S229-V233 PolarHBondContact O-N 2.97Å; S229-V233 VanDerWaalsContact O-N 3.11Å; E230-V233 PolarHBondContact O-N 3.36Å; L231-V233 VanDerWaalsContact C-N 3.3Å; L231-V233 PolarHBondContact O-N 3.24Å; V233-Y237 PolarHBondContact O-N 3.27Å; V233-K300 HydrophobicContact CG1-CD 3.8Å; V233-F301 HydrophobicContact CB-CZ 4.2Å; V233-F301 HydrophobicContact CG1-CE2 3.75Å; V233-F301 HydrophobicContact CG1-CZ 3.67Å |
| 234 | I | 92.3 | Very high | 87.2 | Confident | 14 Ų | 14 | 56.6 Ų | 56.6 | 7% | 0.072 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -70 | -38.9 | 179 | -165.8 | 174.3 | 0 | 0 | 0 | 110.8 | E230 L231 A232 Y237 Q238 L274 F301 | E230-I234 PolarHBondContact O-N 3.39Å; L231-I234 HydrophobicContact CD1-CG2 4.11Å; L231-I234 WeakPolarHBondContact O-CG2 3.46Å; L231-I234 PolarHBondContact O-N 3.34Å; A232-I234 PolarHBondContact O-N 3.35Å; I234-Y237 WeakPolarHBondContact O-CB 3.3Å; I234-Y237 PolarHBondContact O-N 2.94Å; I234-Y237 VanDerWaalsContact O-N 3.15Å; I234-Q238 HydrophobicContact CG1-CG 4.23Å; I234-Q238 VanDerWaalsContact O-CG 3.25Å; I234-Q238 WeakPolarHBondContact O-CG 3.42Å; I234-Q238 PolarHBondContact O-N 2.91Å; I234-L274 HydrophobicContact CD1-CB 3.96Å; I234-L274 HydrophobicContact CD1-CD1 4.04Å; I234-F301 HydrophobicContact CB-CE2 4.43Å; I234-F301 HydrophobicContact CB-CZ 3.82Å |
| 235 | L | 92.9 | Very high | 88.6 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.6 | -44 | 178 | -74.9 | 178.2 | 0 | 0 | 0 | 112.3 | L192 L195 V200 N204 I207 L231 A232 Y237 Q238 N239 M271 | L192-L235 HydrophobicContact CD2-CD1 3.99Å; L195-L235 HydrophobicContact CD2-CD1 4.39Å; L195-L235 HydrophobicContact CD2-CD2 3.62Å; V200-L235 HydrophobicContact CG1-CB 4.06Å; N204-L235 WeakPolarHBondContact OD1-CD1 3.41Å; I207-L235 HydrophobicContact CD1-CD1 3.9Å; L231-L235 HydrophobicContact CD1-CD1 4.14Å; L231-L235 HydrophobicContact CD1-CG 4.08Å; L231-L235 HydrophobicContact CG-CD1 3.99Å; L231-L235 HydrophobicContact CG-CG 4.35Å; L231-L235 WeakPolarHBondContact O-CB 3.4Å; L231-L235 VanDerWaalsContact O-CG 3.23Å; L231-L235 WeakPolarHBondContact O-CG 3.41Å; L231-L235 PolarHBondContact O-N 3.47Å; A232-L235 PolarHBondContact O-N 2.92Å; L235-Y237 VanDerWaalsContact C-N 3.26Å; L235-Y237 PolarHBondContact O-N 3.5Å; L235-Q238 PolarHBondContact O-N 3.09Å; L235-N239 VanDerWaalsContact O-CB 3.31Å; L235-N239 WeakPolarHBondContact O-CB 3.46Å; L235-N239 PolarHBondContact O-N 2.93Å; L235-M271 HydrophobicContact CD2-CG 4.43Å; L235-M271 HydrophobicContact CD2-SD 3.85Å |
| 236 | D | 91.4 | Very high | 89.8 | Confident | 71 Ų | 71 | 53.9 Ų | 53.9 | 38% | 0.38 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -58.9 | -41.2 | 173.9 | -78.9 | -24.9 | 0 | 0 | 0 | 111.4 | N204 A232 S240 | N204-D236 PolarHBondContact ND2-OD1 3.04Å; A232-D236 PolarHBondContact O-N 3.24Å; D236-S240 PolarHBondContact O-N 2.89Å; D236-S240 VanDerWaalsContact O-N 3.12Å; D236-S240 PolarHBondContact O-OG 3.18Å |
| 237 | Y | 92 | Very high | 90.6 | Very high | 31 Ų | 31 | 52.7 Ų | 52.7 | 12% | 0.122 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -66.7 | -46.6 | 179.2 | -154.9 | -89.2 | 0 | 0 | 0 | 111.4 | V233 I234 L235 S240 Y241 L281 R293 L297 | V233-Y237 PolarHBondContact O-N 3.27Å; I234-Y237 WeakPolarHBondContact O-CB 3.3Å; I234-Y237 PolarHBondContact O-N 2.94Å; I234-Y237 VanDerWaalsContact O-N 3.15Å; L235-Y237 VanDerWaalsContact C-N 3.26Å; L235-Y237 PolarHBondContact O-N 3.5Å; Y237-S240 WeakPolarHBondContact O-CB 3.46Å; Y237-S240 PolarHBondContact O-N 3.2Å; Y237-Y241 AromaticContact CD1-CD2 3.87Å; Y237-Y241 HydrophobicContact CD1-CD2 3.87Å; Y237-Y241 AromaticContact CD1-CE2 3.7Å; Y237-Y241 HydrophobicContact CD1-CE2 3.7Å; Y237-Y241 HydrophobicContact CD2-CE2 4.49Å; Y237-Y241 AromaticContact CE1-CD2 3.82Å; Y237-Y241 HydrophobicContact CE1-CD2 3.82Å; Y237-Y241 AromaticContact CE1-CE2 3.34Å; Y237-Y241 HydrophobicContact CE1-CE2 3.34Å; Y237-Y241 HydrophobicContact CE2-CE2 4.2Å; Y237-Y241 HydrophobicContact CG-CE2 4.28Å; Y237-Y241 AromaticContact CZ-CE2 3.64Å; Y237-Y241 WeakPolarHBondContact O-CD2 3.44Å; Y237-L281 HydrophobicContact CD1-CD1 4.2Å; Y237-L281 HydrophobicContact CE1-CD1 3.51Å; Y237-L281 HydrophobicContact CE1-CD2 4.02Å; Y237-L281 HydrophobicContact CE1-CG 4.4Å; Y237-R293 PolarHBondContact OH-O 2.78Å; Y237-L297 HydrophobicContact CD1-CD1 3.94Å; Y237-L297 HydrophobicContact CD1-CD2 4.01Å; Y237-L297 HydrophobicContact CD1-CG 4.44Å; Y237-L297 HydrophobicContact CD2-CD1 4.07Å; Y237-L297 HydrophobicContact CE1-CB 4.11Å; Y237-L297 HydrophobicContact CE1-CD1 4.19Å; Y237-L297 HydrophobicContact CE1-CD2 4.07Å; Y237-L297 HydrophobicContact CE1-CG 4.36Å; Y237-L297 HydrophobicContact CE2-CD1 4.31Å; Y237-L297 HydrophobicContact CG-CD1 3.86Å |
| 238 | Q | 95.3 | Very high | 91.4 | Very high | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.4 | -45.9 | 176.1 | -69.2 | 171.6 | -13.5 | 0 | 0 | 111 | I234 L235 S240 Y241 E242 L269 L270 Q272 T277 | I234-Q238 HydrophobicContact CG1-CG 4.23Å; I234-Q238 VanDerWaalsContact O-CG 3.25Å; I234-Q238 WeakPolarHBondContact O-CG 3.42Å; I234-Q238 PolarHBondContact O-N 2.91Å; L235-Q238 PolarHBondContact O-N 3.09Å; Q238-S240 PolarHBondContact O-N 3.18Å; Q238-Y241 CarbonylContact O-C 3.51Å; Q238-Y241 PolarHBondContact O-N 3.42Å; Q238-E242 PolarHBondContact O-N 3.13Å; Q238-L269 HydrophobicContact CB-CD2 4.37Å; Q238-L269 HydrophobicContact CB-CG 4.05Å; Q238-L269 HydrophobicContact CG-CG 3.99Å; Q238-L269 WeakPolarHBondContact CG-O 3.18Å; Q238-L269 PolarHBondContact NE2-O 3.42Å; Q238-L269 PolarHBondContact OE1-O 2.92Å; Q238-L270 HydrophobicContact CB-CD2 4.09Å; Q238-Q272 PolarHBondContact NE2-O 3.25Å; Q238-T277 HydrophobicContact CG-CG2 3.88Å; Q238-T277 PolarHBondContact NE2-OG1 3.27Å |
| 239 | N | 94.8 | Very high | 92 | Very high | 43 Ų | 43 | 50.6 Ų | 50.6 | 23% | 0.23 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -59.3 | -37 | 179.2 | -166.1 | 38.3 | 0 | 0 | 0 | 112.6 | S197 V200 L235 Y241 L270 | S197-N239 VanDerWaalsContact CA-OD1 3.24Å; S197-N239 WeakPolarHBondContact CA-OD1 3.42Å; S197-N239 VanDerWaalsContact CB-OD1 3.26Å; S197-N239 WeakPolarHBondContact CB-OD1 3.46Å; S197-N239 PolarHBondContact O-ND2 3.36Å; S197-N239 PolarHBondContact O-OD1 3.37Å; S197-N239 VanDerWaalsContact O-OD1 3.12Å; V200-N239 HydrophobicContact CB-CB 4.13Å; V200-N239 HydrophobicContact CG1-CB 3.99Å; V200-N239 HydrophobicContact CG2-CB 3.91Å; L235-N239 VanDerWaalsContact O-CB 3.31Å; L235-N239 WeakPolarHBondContact O-CB 3.46Å; L235-N239 PolarHBondContact O-N 2.93Å; N239-Y241 PolarHBondContact O-N 3.12Å; N239-L270 HydrophobicContact CB-CD2 4.17Å |
| 240 | S | 94 | Very high | 92.5 | Very high | 89 Ų | 89 | 51.5 Ų | 51.5 | 62% | 0.622 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -62.4 | -25.3 | 177.4 | -60 | 0 | 0 | 0 | 0 | 113.1 | D236 Y237 Q238 | D236-S240 PolarHBondContact O-N 2.89Å; D236-S240 VanDerWaalsContact O-N 3.12Å; D236-S240 PolarHBondContact O-OG 3.18Å; Y237-S240 WeakPolarHBondContact O-CB 3.46Å; Y237-S240 PolarHBondContact O-N 3.2Å; Q238-S240 PolarHBondContact O-N 3.18Å |
| 241 | Y | 95 | Very high | 92.6 | Very high | 56 Ų | 56 | 51.5 Ų | 51.5 | 22% | 0.22 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -118.2 | -1.5 | -176.9 | -57.5 | -64.9 | 0 | 0 | 0 | 114.4 | Y237 Q238 N239 R243 E244 W245 L281 R293 | Y237-Y241 AromaticContact CD1-CD2 3.87Å; Y237-Y241 HydrophobicContact CD1-CD2 3.87Å; Y237-Y241 AromaticContact CD1-CE2 3.7Å; Y237-Y241 HydrophobicContact CD1-CE2 3.7Å; Y237-Y241 HydrophobicContact CD2-CE2 4.49Å; Y237-Y241 AromaticContact CE1-CD2 3.82Å; Y237-Y241 HydrophobicContact CE1-CD2 3.82Å; Y237-Y241 AromaticContact CE1-CE2 3.34Å; Y237-Y241 HydrophobicContact CE1-CE2 3.34Å; Y237-Y241 HydrophobicContact CE2-CE2 4.2Å; Y237-Y241 HydrophobicContact CG-CE2 4.28Å; Y237-Y241 AromaticContact CZ-CE2 3.64Å; Y237-Y241 WeakPolarHBondContact O-CD2 3.44Å; Q238-Y241 CarbonylContact O-C 3.51Å; Q238-Y241 PolarHBondContact O-N 3.42Å; N239-Y241 PolarHBondContact O-N 3.12Å; Y241-R243 VanDerWaalsContact C-N 3.29Å; Y241-R243 PolarHBondContact O-N 3.22Å; Y241-E244 PolarHBondContact O-N 3.38Å; Y241-W245 PolarHBondContact O-N 3.23Å; Y241-L281 HydrophobicContact CD2-CD2 3.82Å; Y241-L281 HydrophobicContact CE2-CD2 4.24Å; Y241-L281 HydrophobicContact CG-CD2 4.17Å; Y241-R293 VanDerWaalsContact CE1-NH1 3.28Å; Y241-R293 WeakPolarHBondContact OH-CD 3.45Å |
| 242 | E | 95 | Very high | 92.6 | Very high | 21 Ų | 21 | 50.3 Ų | 50.3 | 10% | 0.098 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -52 | -46.4 | -177.3 | 178 | 58.6 | -151.9 | 0 | 0 | 111.9 | Q238 E244 W245 S246 S268 L269 L270 | Q238-E242 PolarHBondContact O-N 3.13Å; E242-E244 PolarHBondContact O-N 3.34Å; E242-W245 PolarHBondContact O-N 3.44Å; E242-S246 PolarHBondContact O-N 2.81Å; E242-S246 PolarHBondContact O-OG 3.05Å; E242-S268 PolarHBondContact OE1-OG 3.36Å; E242-L269 VanDerWaalsContact OE2-CA 3.32Å; E242-L269 WeakPolarHBondContact OE2-CA 3.25Å; E242-L269 WeakPolarHBondContact OE2-CB 3.23Å; E242-L269 PolarHBondContact OE2-N 3.38Å; E242-L270 HydrophobicContact CG-CD1 4.43Å; E242-L270 HydrophobicContact CG-CG 4.26Å; E242-L270 PolarHBondContact OE2-N 3.16Å |
| 243 | R | 94.5 | Very high | 92.4 | Very high | 223 Ų | 223 | 53.1 Ų | 53.1 | 84% | 0.842 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -63.9 | -40.1 | -180 | -173 | -175.5 | -62.6 | 160.7 | 3.2 | 112.9 | Y241 S247 | Y241-R243 VanDerWaalsContact C-N 3.29Å; Y241-R243 PolarHBondContact O-N 3.22Å; R243-S247 PolarHBondContact O-N 3.03Å |
| 244 | E | 95.2 | Very high | 92.2 | Very high | 84 Ų | 84 | 56.3 Ų | 56.3 | 39% | 0.393 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -67.8 | -42.3 | 178 | -170.3 | -175.8 | 151.1 | 0 | 0 | 110.2 | Y241 E242 S247 Y248 M284 R293 | Y241-E244 PolarHBondContact O-N 3.38Å; E242-E244 PolarHBondContact O-N 3.34Å; E244-S247 WeakPolarHBondContact O-CB 3.29Å; E244-S247 PolarHBondContact O-N 3.27Å; E244-Y248 PolarHBondContact O-N 3.43Å; E244-M284 HydrophobicContact CB-SD 4.1Å; E244-M284 HydrophobicContact CG-SD 3.89Å; E244-R293 IonicContact OE1-CZ 2.71Å; E244-R293 IonicContact OE1-NH1 3.37Å; E244-R293 PolarHBondContact OE1-NH1 3.44Å; E244-R293 IonicContact OE1-NH2 3.8Å; E244-R293 PolarHBondContact OE1-NH2 3.14Å; E244-R293 IonicContact OE2-CZ 3.32Å; E244-R293 IonicContact OE2-NH1 3.06Å; E244-R293 PolarHBondContact OE2-NH1 3.11Å; E244-R293 IonicContact OE2-NH2 2.78Å |
| 245 | W | 95.2 | Very high | 91.5 | Very high | 2 Ų | 2 | 63 Ų | 63 | 1% | 0.008 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -59.6 | -48.5 | 174.9 | 176.5 | -109 | 0 | 0 | 0 | 112.1 | Y241 E242 S247 Y248 Y249 L265 P266 E267 L269 A280 M284 | Y241-W245 PolarHBondContact O-N 3.23Å; E242-W245 PolarHBondContact O-N 3.44Å; W245-S247 PolarHBondContact O-N 3.03Å; W245-Y248 HydrophobicContact CE3-CD1 4.07Å; W245-Y248 AromaticContact CZ3-CD1 3.76Å; W245-Y248 HydrophobicContact CZ3-CD1 3.76Å; W245-Y248 HydrophobicContact CZ3-CE1 4.16Å; W245-Y248 PolarHBondContact O-N 3.3Å; W245-Y248 VanDerWaalsContact O-N 3.17Å; W245-Y249 HydrophobicContact CZ2-CD2 4.19Å; W245-Y249 VanDerWaalsContact O-CB 3.29Å; W245-Y249 WeakPolarHBondContact O-CB 3.33Å; W245-Y249 PolarHBondContact O-N 3.17Å; W245-L265 HydrophobicContact CH2-CB 4.47Å; W245-L265 HydrophobicContact CH2-CD1 4.24Å; W245-L265 HydrophobicContact CZ2-CB 4.31Å; W245-P266 VanDerWaalsContact CZ2-O 3.32Å; W245-P266 WeakPolarHBondContact CZ2-O 3.39Å; W245-P266 PolarHBondContact NE1-O 2.73Å; W245-E267 PolarHBondContact NE1-O 3.31Å; W245-L269 HydrophobicContact CB-CB 4.03Å; W245-L269 HydrophobicContact CB-CD2 4.31Å; W245-L269 HydrophobicContact CG-CB 3.87Å; W245-A280 HydrophobicContact CD2-CB 4.16Å; W245-A280 HydrophobicContact CE3-CB 3.66Å; W245-A280 HydrophobicContact CH2-CB 3.96Å; W245-A280 HydrophobicContact CZ2-CB 4.45Å; W245-A280 HydrophobicContact CZ3-CB 3.54Å; W245-M284 WeakPolarHBondContact CA-SD 3.47Å; W245-M284 HydrophobicContact CB-CE 4.39Å; W245-M284 HydrophobicContact CB-SD 3.9Å; W245-M284 HydrophobicContact CE3-CE 4.4Å; W245-M284 HydrophobicContact CE3-CG 4.04Å; W245-M284 HydrophobicContact CE3-SD 3.99Å; W245-M284 PolarHBondContact N-SD 3.3Å; W245-M284 VanDerWaalsContact N-SD 3.41Å |
| 246 | S | 93.6 | Very high | 90 | Very high | 46 Ų | 46 | 68.7 Ų | 68.7 | 32% | 0.322 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -59.3 | -36.4 | 178.2 | -48.2 | 0 | 0 | 0 | 0 | 112.1 | E242 S250 | E242-S246 PolarHBondContact O-N 2.81Å; E242-S246 PolarHBondContact O-OG 3.05Å; S246-S250 WeakPolarHBondContact O-CB 3.37Å; S246-S250 PolarHBondContact O-N 2.62Å; S246-S250 VanDerWaalsContact O-N 3.08Å; S246-S250 PolarHBondContact O-OG 2.95Å |
| 247 | S | 93.6 | Very high | 88.9 | Confident | 65 Ų | 65 | 72.5 Ų | 72.5 | 46% | 0.455 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -66 | -50.3 | 175.2 | -166.7 | 0 | 0 | 0 | 0 | 111.1 | R243 E244 W245 Y249 S250 E251 | R243-S247 PolarHBondContact O-N 3.03Å; E244-S247 WeakPolarHBondContact O-CB 3.29Å; E244-S247 PolarHBondContact O-N 3.27Å; W245-S247 PolarHBondContact O-N 3.03Å; S247-Y249 PolarHBondContact O-N 3.12Å; S247-S250 WeakPolarHBondContact O-CB 3.26Å; S247-S250 PolarHBondContact O-N 2.93Å; S247-E251 WeakPolarHBondContact O-CG 3.46Å; S247-E251 PolarHBondContact O-N 2.88Å |
| 248 | Y | 92.7 | Very high | 87.9 | Confident | 40 Ų | 40 | 72 Ų | 72 | 16% | 0.157 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -60.6 | -44.2 | 178.3 | -178.5 | -98.9 | 0 | 0 | 0 | 112.2 | E244 W245 S250 E251 L252 R283 M284 | E244-Y248 PolarHBondContact O-N 3.43Å; W245-Y248 HydrophobicContact CE3-CD1 4.07Å; W245-Y248 AromaticContact CZ3-CD1 3.76Å; W245-Y248 HydrophobicContact CZ3-CD1 3.76Å; W245-Y248 HydrophobicContact CZ3-CE1 4.16Å; W245-Y248 PolarHBondContact O-N 3.3Å; W245-Y248 VanDerWaalsContact O-N 3.17Å; Y248-S250 VanDerWaalsContact C-N 3.34Å; Y248-S250 PolarHBondContact O-N 3.22Å; Y248-E251 WeakPolarHBondContact O-CB 3.42Å; Y248-E251 PolarHBondContact O-N 3.48Å; Y248-L252 HydrophobicContact CD1-CD1 3.91Å; Y248-L252 HydrophobicContact CD1-CG 4.21Å; Y248-L252 HydrophobicContact CE1-CD1 3.46Å; Y248-L252 VanDerWaalsContact CE1-CD1 3.46Å; Y248-L252 HydrophobicContact CE1-CD2 4.16Å; Y248-L252 HydrophobicContact CE1-CG 3.84Å; Y248-L252 WeakPolarHBondContact O-CG 3.37Å; Y248-L252 PolarHBondContact O-N 2.87Å; Y248-R283 HydrophobicContact CE1-CB 3.76Å; Y248-M284 HydrophobicContact CD1-CG 4.2Å; Y248-M284 HydrophobicContact CG-CG 4.02Å |
| 249 | Y | 91.9 | Very high | 86.6 | Confident | 31 Ų | 31 | 79.4 Ų | 79.4 | 12% | 0.122 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -59.4 | -43.1 | 176.1 | -175.7 | -93.9 | 0 | 0 | 0 | 111.9 | W245 S247 E251 L252 L253 L265 E267 | W245-Y249 HydrophobicContact CZ2-CD2 4.19Å; W245-Y249 VanDerWaalsContact O-CB 3.29Å; W245-Y249 WeakPolarHBondContact O-CB 3.33Å; W245-Y249 PolarHBondContact O-N 3.17Å; S247-Y249 PolarHBondContact O-N 3.12Å; Y249-E251 VanDerWaalsContact C-N 3.34Å; Y249-E251 PolarHBondContact O-N 3.44Å; Y249-L252 WeakPolarHBondContact O-CB 3.42Å; Y249-L252 PolarHBondContact O-N 3.04Å; Y249-L253 HydrophobicContact CD1-CD1 3.92Å; Y249-L253 HydrophobicContact CD1-CG 4.46Å; Y249-L253 HydrophobicContact CE1-CD1 3.5Å; Y249-L253 VanDerWaalsContact CE1-CD1 3.5Å; Y249-L253 HydrophobicContact CE1-CG 4.12Å; Y249-L253 PolarHBondContact O-N 2.99Å; Y249-L253 VanDerWaalsContact O-N 3.15Å; Y249-L265 HydrophobicContact CE2-CB 4.26Å; Y249-E267 HydrophobicContact CD1-CG 4.2Å; Y249-E267 HydrophobicContact CE1-CB 4.04Å; Y249-E267 HydrophobicContact CE1-CG 3.86Å |
| 250 | S | 91 | Very high | 85.7 | Confident | 66 Ų | 66 | 85.8 Ų | 85.8 | 46% | 0.462 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -64 | -37.8 | 176.3 | -60.4 | 0 | 0 | 0 | 0 | 112.4 | S246 S247 Y248 L253 T254 | S246-S250 WeakPolarHBondContact O-CB 3.37Å; S246-S250 PolarHBondContact O-N 2.62Å; S246-S250 VanDerWaalsContact O-N 3.08Å; S246-S250 PolarHBondContact O-OG 2.95Å; S247-S250 WeakPolarHBondContact O-CB 3.26Å; S247-S250 PolarHBondContact O-N 2.93Å; Y248-S250 VanDerWaalsContact C-N 3.34Å; Y248-S250 PolarHBondContact O-N 3.22Å; S250-L253 PolarHBondContact O-N 3.35Å; S250-T254 PolarHBondContact O-N 2.88Å; S250-T254 PolarHBondContact O-OG1 3.23Å |
| 251 | E | 89.5 | Confident | 84.7 | Confident | 102 Ų | 102 | 83.3 Ų | 83.3 | 48% | 0.477 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -64 | -45 | 173.5 | -71.7 | 177 | -163.1 | 0 | 0 | 111.4 | S247 Y248 Y249 L253 T254 Y255 | S247-E251 WeakPolarHBondContact O-CG 3.46Å; S247-E251 PolarHBondContact O-N 2.88Å; Y248-E251 WeakPolarHBondContact O-CB 3.42Å; Y248-E251 PolarHBondContact O-N 3.48Å; Y249-E251 VanDerWaalsContact C-N 3.34Å; Y249-E251 PolarHBondContact O-N 3.44Å; E251-L253 VanDerWaalsContact C-N 3.27Å; E251-L253 PolarHBondContact O-N 3.28Å; E251-T254 WeakPolarHBondContact O-CB 3.42Å; E251-T254 PolarHBondContact O-N 2.99Å; E251-Y255 WeakPolarHBondContact O-CD2 3.23Å; E251-Y255 PolarHBondContact O-N 3.24Å |
| 252 | L | 86.8 | Confident | 83.8 | Confident | 23 Ų | 23 | 80.6 Ų | 80.6 | 12% | 0.12 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -57.8 | -38.1 | 177.2 | -70.4 | 178.2 | 0 | 0 | 0 | 112.9 | Y248 Y249 T254 A258 A262 L265 | Y248-L252 HydrophobicContact CD1-CD1 3.91Å; Y248-L252 HydrophobicContact CD1-CG 4.21Å; Y248-L252 HydrophobicContact CE1-CD1 3.46Å; Y248-L252 VanDerWaalsContact CE1-CD1 3.46Å; Y248-L252 HydrophobicContact CE1-CD2 4.16Å; Y248-L252 HydrophobicContact CE1-CG 3.84Å; Y248-L252 WeakPolarHBondContact O-CG 3.37Å; Y248-L252 PolarHBondContact O-N 2.87Å; Y249-L252 WeakPolarHBondContact O-CB 3.42Å; Y249-L252 PolarHBondContact O-N 3.04Å; L252-T254 PolarHBondContact O-N 2.9Å; L252-A258 HydrophobicContact CB-CB 4.5Å; L252-A258 HydrophobicContact CD2-CB 3.88Å; L252-A262 HydrophobicContact CB-CB 3.99Å; L252-L265 HydrophobicContact CD1-CD1 3.91Å |
| 253 | L | 85 | Confident | 82.9 | Confident | 66 Ų | 66 | 84.6 Ų | 84.6 | 35% | 0.346 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -66.7 | -24.3 | 177 | -73.8 | 174.1 | 0 | 0 | 0 | 113.3 | Y249 S250 E251 A262 | Y249-L253 HydrophobicContact CD1-CD1 3.92Å; Y249-L253 HydrophobicContact CD1-CG 4.46Å; Y249-L253 HydrophobicContact CE1-CD1 3.5Å; Y249-L253 VanDerWaalsContact CE1-CD1 3.5Å; Y249-L253 HydrophobicContact CE1-CG 4.12Å; Y249-L253 PolarHBondContact O-N 2.99Å; Y249-L253 VanDerWaalsContact O-N 3.15Å; S250-L253 PolarHBondContact O-N 3.35Å; E251-L253 VanDerWaalsContact C-N 3.27Å; E251-L253 PolarHBondContact O-N 3.28Å; L253-A262 HydrophobicContact CD2-CB 3.82Å; L253-A262 HydrophobicContact CG-CB 4.29Å |
| 254 | T | 84.5 | Confident | 82.3 | Confident | 110 Ų | 110 | 78.7 Ų | 78.7 | 68% | 0.675 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -79.9 | -35.5 | -177.8 | -55.4 | 0 | 0 | 0 | 0 | 111.8 | S250 E251 L252 | S250-T254 PolarHBondContact O-N 2.88Å; S250-T254 PolarHBondContact O-OG1 3.23Å; E251-T254 WeakPolarHBondContact O-CB 3.42Å; E251-T254 PolarHBondContact O-N 2.99Å; L252-T254 PolarHBondContact O-N 2.9Å |
| 255 | Y | 78.7 | Confident | 82 | Confident | 154 Ų | 154 | 75.3 Ų | 75.3 | 60% | 0.604 | 40% | 0.398 | S | S | * | . | S | Bend | trans | -84.7 | 119 | -180 | -64.9 | -75.6 | 0 | 0 | 0 | 111.8 | E251 N257 A258 R259 | E251-Y255 WeakPolarHBondContact O-CD2 3.23Å; E251-Y255 PolarHBondContact O-N 3.24Å; Y255-N257 PolarHBondContact O-N 2.92Å; Y255-N257 VanDerWaalsContact O-N 3.11Å; Y255-A258 PolarHBondContact O-N 2.73Å; Y255-R259 PolarHBondContact O-N 2.91Å |
| 256 | T | 61.4 | Low | 81.7 | Confident | 120 Ų | 120 | 76.4 Ų | 76.4 | 74% | 0.736 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.5 | -35.3 | -174.8 | 51.1 | 0 | 0 | 0 | 0 | 114.1 | ||
| 257 | N | 67.8 | Low | 81.6 | Confident | 150 Ų | 150 | 81.1 Ų | 81.1 | 80% | 0.802 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.7 | -26.4 | -179 | -64.3 | -10 | 0 | 0 | 0 | 112.4 | Y255 | Y255-N257 PolarHBondContact O-N 2.92Å; Y255-N257 VanDerWaalsContact O-N 3.11Å |
| 258 | A | 69.8 | Low | 81.5 | Confident | 21 Ų | 21 | 80 Ų | 80 | 17% | 0.174 | 42% | 0.415 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.9 | -16.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113 | L252 Y255 K260 T261 A262 | L252-A258 HydrophobicContact CB-CB 4.5Å; L252-A258 HydrophobicContact CD2-CB 3.88Å; Y255-A258 PolarHBondContact O-N 2.73Å; A258-K260 VanDerWaalsContact C-N 3.28Å; A258-K260 PolarHBondContact O-N 2.96Å; A258-T261 WeakPolarHBondContact O-CB 3.34Å; A258-T261 PolarHBondContact O-N 3.37Å; A258-T261 VanDerWaalsContact O-N 3.08Å; A258-A262 PolarHBondContact O-N 3.12Å |
| 259 | R | 69.5 | Low | 81.5 | Confident | 156 Ų | 156 | 78.2 Ų | 78.2 | 59% | 0.589 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -59.5 | -33.5 | -175.9 | -169 | 172.7 | 179.4 | 158.9 | 1.3 | 114 | Y255 A262 T263 | Y255-R259 PolarHBondContact O-N 2.91Å; R259-A262 PolarHBondContact O-N 3.11Å; R259-T263 PolarHBondContact O-N 2.96Å |
| 260 | K | 75.1 | Confident | 81.6 | Confident | 176 Ų | 176 | 77.2 Ų | 77.2 | 77% | 0.765 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -64.3 | -43.7 | 175.8 | -71.4 | -174.2 | 178.4 | -177.5 | 0 | 111.5 | A258 T263 | A258-K260 VanDerWaalsContact C-N 3.28Å; A258-K260 PolarHBondContact O-N 2.96Å; K260-T263 PolarHBondContact O-OG1 2.9Å |
| 261 | T | 73.4 | Confident | 81.5 | Confident | 37 Ų | 37 | 77.8 Ų | 77.8 | 23% | 0.227 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -68.1 | -38.2 | 175.4 | -45 | 0 | 0 | 0 | 0 | 111.1 | A258 T263 T264 L265 Q318 | A258-T261 WeakPolarHBondContact O-CB 3.34Å; A258-T261 PolarHBondContact O-N 3.37Å; A258-T261 VanDerWaalsContact O-N 3.08Å; T261-T263 VanDerWaalsContact C-N 3.27Å; T261-T263 PolarHBondContact O-N 3.11Å; T261-T264 PolarHBondContact O-N 3.42Å; T261-T264 PolarHBondContact O-OG1 3.1Å; T261-L265 HydrophobicContact CG2-CD1 4.29Å; T261-L265 WeakPolarHBondContact O-CG 3.12Å; T261-Q318 HydrophobicContact CG2-CB 3.89Å; T261-Q318 HydrophobicContact CG2-CG 4.02Å |
| 262 | A | 75.1 | Confident | 81.6 | Confident | 0 Ų | 0 | 75.4 Ų | 75.4 | 0% | 0 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -60.3 | -35.9 | 179 | 0 | 0 | 0 | 0 | 0 | 112.7 | L252 L253 A258 R259 T264 L265 | L252-A262 HydrophobicContact CB-CB 3.99Å; L253-A262 HydrophobicContact CD2-CB 3.82Å; L253-A262 HydrophobicContact CG-CB 4.29Å; A258-A262 PolarHBondContact O-N 3.12Å; R259-A262 PolarHBondContact O-N 3.11Å; A262-T264 PolarHBondContact O-N 3.19Å; A262-L265 PolarHBondContact O-N 3.25Å |
| 263 | T | 76.3 | Confident | 81.8 | Confident | 104 Ų | 104 | 77.5 Ų | 77.5 | 64% | 0.638 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.3 | -14.9 | -179.9 | 49.9 | 0 | 0 | 0 | 0 | 114.7 | R259 K260 T261 | R259-T263 PolarHBondContact O-N 2.96Å; K260-T263 PolarHBondContact O-OG1 2.9Å; T261-T263 VanDerWaalsContact C-N 3.27Å; T261-T263 PolarHBondContact O-N 3.11Å |
| 264 | T | 83.4 | Confident | 82.1 | Confident | 100 Ų | 100 | 76.5 Ų | 76.5 | 61% | 0.613 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.3 | -7.9 | 176.1 | 61 | 0 | 0 | 0 | 0 | 112.7 | T261 A262 | T261-T264 PolarHBondContact O-N 3.42Å; T261-T264 PolarHBondContact O-OG1 3.1Å; A262-T264 PolarHBondContact O-N 3.19Å |
| 265 | L | 88.6 | Confident | 82.5 | Confident | 12 Ų | 12 | 73.7 Ų | 73.7 | 6% | 0.063 | 38% | 0.383 | C | S | . | . | S | Bend | trans | -97.9 | 148.2 | -177.2 | -65.4 | 170.9 | 0 | 0 | 0 | 111.2 | W245 Y249 L252 T261 A262 | W245-L265 HydrophobicContact CH2-CB 4.47Å; W245-L265 HydrophobicContact CH2-CD1 4.24Å; W245-L265 HydrophobicContact CZ2-CB 4.31Å; Y249-L265 HydrophobicContact CE2-CB 4.26Å; L252-L265 HydrophobicContact CD1-CD1 3.91Å; T261-L265 HydrophobicContact CG2-CD1 4.29Å; T261-L265 WeakPolarHBondContact O-CG 3.12Å; A262-L265 PolarHBondContact O-N 3.25Å |
| 266 | P | 89 | Confident | 83.2 | Confident | 26 Ų | 26 | 69.8 Ų | 69.8 | 17% | 0.169 | 37% | 0.371 | C | S | . | . | trans | -70.7 | 137 | 177.1 | 30 | -35 | 0 | 0 | 0 | 111.4 | W245 S268 Q272 | W245-P266 VanDerWaalsContact CZ2-O 3.32Å; W245-P266 WeakPolarHBondContact CZ2-O 3.39Å; W245-P266 PolarHBondContact NE1-O 2.73Å; P266-S268 VanDerWaalsContact C-N 3.28Å; P266-S268 PolarHBondContact O-N 3.12Å; P266-Q272 HydrophobicContact CB-CG 3.97Å; P266-Q272 HydrophobicContact CG-CG 3.73Å | ||
| 267 | E | 90.1 | Very high | 84.8 | Confident | 145 Ų | 145 | 64.1 Ų | 64.1 | 68% | 0.678 | 34% | 0.336 | S | S | * | . | S | Bend | trans | -64.4 | -34 | 177.6 | -176.6 | 177 | 177.6 | 0 | 0 | 112.4 | W245 Y249 | W245-E267 PolarHBondContact NE1-O 3.31Å; Y249-E267 HydrophobicContact CD1-CG 4.2Å; Y249-E267 HydrophobicContact CE1-CB 4.04Å; Y249-E267 HydrophobicContact CE1-CG 3.86Å |
| 268 | S | 92.3 | Very high | 86.1 | Confident | 42 Ų | 42 | 57 Ų | 57 | 29% | 0.294 | 30% | 0.298 | S | S | . | . | trans | -112.8 | 139.8 | 179.2 | 165.2 | 0 | 0 | 0 | 0 | 110.4 | E242 P266 L270 Q272 | E242-S268 PolarHBondContact OE1-OG 3.36Å; P266-S268 VanDerWaalsContact C-N 3.28Å; P266-S268 PolarHBondContact O-N 3.12Å; S268-L270 WeakPolarHBondContact OG-CB 3.47Å; S268-L270 PolarHBondContact OG-N 3.36Å; S268-Q272 VanDerWaalsContact O-CG 3.28Å; S268-Q272 WeakPolarHBondContact O-CG 3.45Å; S268-Q272 PolarHBondContact O-NE2 2.61Å | ||
| 269 | L | 93.4 | Very high | 87.2 | Confident | 1 Ų | 1 | 56 Ų | 56 | 1% | 0.005 | 29% | 0.29 | C | S | . | . | S | Bend | trans | -79.2 | -27.6 | 174.6 | -174.3 | 61.5 | 0 | 0 | 0 | 111.2 | Q238 E242 W245 Q272 T277 A280 | Q238-L269 HydrophobicContact CB-CD2 4.37Å; Q238-L269 HydrophobicContact CB-CG 4.05Å; Q238-L269 HydrophobicContact CG-CG 3.99Å; Q238-L269 WeakPolarHBondContact CG-O 3.18Å; Q238-L269 PolarHBondContact NE2-O 3.42Å; Q238-L269 PolarHBondContact OE1-O 2.92Å; E242-L269 VanDerWaalsContact OE2-CA 3.32Å; E242-L269 WeakPolarHBondContact OE2-CA 3.25Å; E242-L269 WeakPolarHBondContact OE2-CB 3.23Å; E242-L269 PolarHBondContact OE2-N 3.38Å; W245-L269 HydrophobicContact CB-CB 4.03Å; W245-L269 HydrophobicContact CB-CD2 4.31Å; W245-L269 HydrophobicContact CG-CB 3.87Å; L269-Q272 WeakPolarHBondContact O-CB 3.27Å; L269-Q272 VanDerWaalsContact O-CG 3.29Å; L269-Q272 WeakPolarHBondContact O-CG 3.46Å; L269-Q272 PolarHBondContact O-N 2.71Å; L269-T277 HydrophobicContact CD1-CG2 4.21Å; L269-A280 HydrophobicContact CD1-CB 3.51Å |
| 270 | L | 92.9 | Very high | 88.4 | Confident | 10 Ų | 10 | 48.7 Ų | 48.7 | 5% | 0.052 | 26% | 0.263 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.5 | 142.3 | 174.5 | -61.4 | 175.6 | 0 | 0 | 0 | 112.1 | L195 V200 Q238 N239 E242 S268 Q272 | L195-L270 HydrophobicContact CD2-CB 4.29Å; L195-L270 HydrophobicContact CG-CD1 4.48Å; V200-L270 HydrophobicContact CG2-CD1 4.46Å; V200-L270 HydrophobicContact CG2-CD2 3.9Å; Q238-L270 HydrophobicContact CB-CD2 4.09Å; N239-L270 HydrophobicContact CB-CD2 4.17Å; E242-L270 HydrophobicContact CG-CD1 4.43Å; E242-L270 HydrophobicContact CG-CG 4.26Å; E242-L270 PolarHBondContact OE2-N 3.16Å; S268-L270 WeakPolarHBondContact OG-CB 3.47Å; S268-L270 PolarHBondContact OG-N 3.36Å; L270-Q272 PolarHBondContact O-N 2.85Å; L270-Q272 VanDerWaalsContact O-N 3.1Å |
| 271 | M | 89.6 | Confident | 89.3 | Confident | 78 Ų | 78 | 40.3 Ų | 40.3 | 38% | 0.384 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 63.1 | 6.6 | 178.5 | -67.9 | -64.1 | -60.2 | 0 | 0 | 115.2 | L192 L195 L235 | L192-M271 HydrophobicContact CB-CE 4Å; L192-M271 HydrophobicContact CB-SD 4.18Å; L192-M271 HydrophobicContact CD1-CE 4.48Å; L192-M271 HydrophobicContact CD2-CE 4.15Å; L192-M271 HydrophobicContact CD2-SD 3.56Å; L192-M271 VanDerWaalsContact CD2-SD 3.56Å; L192-M271 HydrophobicContact CG-CE 4.44Å; L192-M271 HydrophobicContact CG-SD 4.39Å; L195-M271 HydrophobicContact CB-CG 4.39Å; L195-M271 HydrophobicContact CD2-CG 3.78Å; L195-M271 HydrophobicContact CD2-SD 4.01Å; L235-M271 HydrophobicContact CD2-CG 4.43Å; L235-M271 HydrophobicContact CD2-SD 3.85Å |
| 272 | Q | 91.3 | Very high | 90.3 | Very high | 52 Ų | 52 | 38.7 Ų | 38.7 | 24% | 0.243 | 22% | 0.217 | C | C | . | . | trans | -72 | 148.6 | 174.2 | -62 | -51.2 | -47.3 | 0 | 0 | 110.5 | Q238 P266 S268 L269 L270 E276 | Q238-Q272 PolarHBondContact NE2-O 3.25Å; P266-Q272 HydrophobicContact CB-CG 3.97Å; P266-Q272 HydrophobicContact CG-CG 3.73Å; S268-Q272 VanDerWaalsContact O-CG 3.28Å; S268-Q272 WeakPolarHBondContact O-CG 3.45Å; S268-Q272 PolarHBondContact O-NE2 2.61Å; L269-Q272 WeakPolarHBondContact O-CB 3.27Å; L269-Q272 VanDerWaalsContact O-CG 3.29Å; L269-Q272 WeakPolarHBondContact O-CG 3.46Å; L269-Q272 PolarHBondContact O-N 2.71Å; L270-Q272 PolarHBondContact O-N 2.85Å; L270-Q272 VanDerWaalsContact O-N 3.1Å; Q272-E276 HydrophobicContact CB-CB 3.92Å | ||
| 273 | P | 90.8 | Very high | 91.1 | Very high | 68 Ų | 68 | 39.2 Ų | 39.2 | 44% | 0.442 | 22% | 0.219 | S | C | . | . | trans | -64.9 | 165.8 | 173 | 28.7 | -35.3 | 0 | 0 | 0 | 111.1 | C275 E276 T277 | P273-C275 VanDerWaalsContact C-N 3.27Å; P273-C275 PolarHBondContact O-N 3.06Å; P273-E276 HydrophobicContact CG-CB 4.01Å; P273-E276 HydrophobicContact CG-CG 3.69Å; P273-E276 PolarHBondContact O-N 3.29Å; P273-T277 PolarHBondContact O-N 3.13Å; P273-T277 PolarHBondContact O-OG1 2.86Å | ||
| 274 | L | 92 | Very high | 91.9 | Very high | 44 Ų | 44 | 35 Ų | 35 | 23% | 0.23 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -56.4 | -39.2 | -179.4 | -178.1 | 58.1 | 0 | 0 | 0 | 112.9 | I234 T277 L278 L297 F301 I303 | I234-L274 HydrophobicContact CD1-CB 3.96Å; I234-L274 HydrophobicContact CD1-CD1 4.04Å; L274-T277 PolarHBondContact O-N 3.04Å; L274-L278 HydrophobicContact CD1-CD1 4.3Å; L274-L278 HydrophobicContact CD1-CG 4.24Å; L274-L278 HydrophobicContact CG-CD1 4.11Å; L274-L278 WeakPolarHBondContact O-CB 3.46Å; L274-L278 VanDerWaalsContact O-CG 3.25Å; L274-L278 WeakPolarHBondContact O-CG 3.5Å; L274-L278 PolarHBondContact O-N 2.78Å; L274-L297 HydrophobicContact CD1-CD1 4.46Å; L274-L297 HydrophobicContact CD1-CD2 3.8Å; L274-L297 HydrophobicContact CD1-CG 3.88Å; L274-F301 HydrophobicContact CD1-CD2 3.96Å; L274-F301 HydrophobicContact CD1-CE2 4.31Å; L274-F301 HydrophobicContact CD1-CG 4.13Å; L274-F301 HydrophobicContact CD2-CB 3.69Å; L274-F301 HydrophobicContact CD2-CD1 3.88Å; L274-F301 HydrophobicContact CD2-CD2 4.39Å; L274-F301 HydrophobicContact CD2-CG 3.73Å; L274-I303 HydrophobicContact CD2-CD1 3.67Å; L274-I303 HydrophobicContact CD2-CG1 4.16Å; L274-I303 HydrophobicContact CG-CD1 4.08Å |
| 275 | C | 92.2 | Very high | 92.3 | Very high | 51 Ų | 51 | 32.5 Ų | 32.5 | 35% | 0.345 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -60.3 | -49.7 | 176.8 | 51.6 | 0 | 0 | 0 | 0 | 112.5 | P273 T277 L278 G279 L311 | P273-C275 VanDerWaalsContact C-N 3.27Å; P273-C275 PolarHBondContact O-N 3.06Å; C275-T277 VanDerWaalsContact C-N 3.32Å; C275-T277 PolarHBondContact O-N 3.44Å; C275-L278 PolarHBondContact O-N 3.16Å; C275-G279 PolarHBondContact O-N 2.73Å; C275-L311 HydrophobicContact CB-CD2 3.55Å |
| 276 | E | 93 | Very high | 92.2 | Very high | 73 Ų | 73 | 38.7 Ų | 38.7 | 34% | 0.341 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -65.5 | -37.7 | 177.7 | -69.7 | -55.4 | 148.4 | 0 | 0 | 111.6 | Q272 P273 G279 A280 | Q272-E276 HydrophobicContact CB-CB 3.92Å; P273-E276 HydrophobicContact CG-CB 4.01Å; P273-E276 HydrophobicContact CG-CG 3.69Å; P273-E276 PolarHBondContact O-N 3.29Å; E276-G279 PolarHBondContact O-N 3.15Å; E276-A280 WeakPolarHBondContact O-CB 3.37Å; E276-A280 PolarHBondContact O-N 3.17Å |
| 277 | T | 95 | Very high | 92.2 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.1 | -46.9 | 176 | -53.1 | 0 | 0 | 0 | 0 | 111.2 | Q238 L269 P273 L274 C275 G279 A280 L281 L297 | Q238-T277 HydrophobicContact CG-CG2 3.88Å; Q238-T277 PolarHBondContact NE2-OG1 3.27Å; L269-T277 HydrophobicContact CD1-CG2 4.21Å; P273-T277 PolarHBondContact O-N 3.13Å; P273-T277 PolarHBondContact O-OG1 2.86Å; L274-T277 PolarHBondContact O-N 3.04Å; C275-T277 VanDerWaalsContact C-N 3.32Å; C275-T277 PolarHBondContact O-N 3.44Å; T277-G279 VanDerWaalsContact C-N 3.32Å; T277-G279 PolarHBondContact O-N 3.42Å; T277-A280 PolarHBondContact O-N 2.61Å; T277-L281 HydrophobicContact CG2-CD1 4.27Å; T277-L281 WeakPolarHBondContact O-CD1 3.26Å; T277-L281 WeakPolarHBondContact O-CG 3.41Å; T277-L281 PolarHBondContact O-N 2.93Å; T277-L297 HydrophobicContact CG2-CD2 3.69Å |
| 278 | L | 95.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -60.4 | -43.7 | 175 | -73.5 | 168.4 | 0 | 0 | 0 | 111.7 | L274 C275 L281 A282 A294 L297 I303 F308 L311 | L274-L278 HydrophobicContact CD1-CD1 4.3Å; L274-L278 HydrophobicContact CD1-CG 4.24Å; L274-L278 HydrophobicContact CG-CD1 4.11Å; L274-L278 WeakPolarHBondContact O-CB 3.46Å; L274-L278 VanDerWaalsContact O-CG 3.25Å; L274-L278 WeakPolarHBondContact O-CG 3.5Å; L274-L278 PolarHBondContact O-N 2.78Å; C275-L278 PolarHBondContact O-N 3.16Å; L278-L281 PolarHBondContact O-N 3.26Å; L278-A282 WeakPolarHBondContact O-CB 3.37Å; L278-A282 PolarHBondContact O-N 2.8Å; L278-A294 HydrophobicContact CD2-CB 4.2Å; L278-A294 WeakPolarHBondContact CD2-O 3.41Å; L278-L297 HydrophobicContact CD2-CB 3.94Å; L278-L297 HydrophobicContact CD2-CD2 3.95Å; L278-L297 HydrophobicContact CD2-CG 4.13Å; L278-L297 HydrophobicContact CG-CD2 4.28Å; L278-I303 HydrophobicContact CD1-CD1 3.46Å; L278-I303 VanDerWaalsContact CD1-CD1 3.46Å; L278-F308 HydrophobicContact CD2-CE2 4.18Å; L278-L311 HydrophobicContact CD1-CD1 3.84Å |
| 279 | G | 93.7 | Very high | 92 | Very high | 1 Ų | 1 | 35.4 Ų | 35.4 | 1% | 0.01 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.7 | -44.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 | C275 E276 T277 A282 R283 | C275-G279 PolarHBondContact O-N 2.73Å; E276-G279 PolarHBondContact O-N 3.15Å; T277-G279 VanDerWaalsContact C-N 3.32Å; T277-G279 PolarHBondContact O-N 3.42Å; G279-A282 PolarHBondContact O-N 2.64Å; G279-R283 VanDerWaalsContact CA-NH1 3.25Å; G279-R283 WeakPolarHBondContact O-CG 3.23Å; G279-R283 PolarHBondContact O-N 3.23Å; G279-R283 VanDerWaalsContact O-N 3.07Å; G279-R283 PolarHBondContact O-NH1 3.16Å |
| 280 | A | 94 | Very high | 91.7 | Very high | 3 Ų | 3 | 40 Ų | 40 | 3% | 0.025 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -60.7 | -45.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | W245 L269 E276 T277 R283 M284 | W245-A280 HydrophobicContact CD2-CB 4.16Å; W245-A280 HydrophobicContact CE3-CB 3.66Å; W245-A280 HydrophobicContact CH2-CB 3.96Å; W245-A280 HydrophobicContact CZ2-CB 4.45Å; W245-A280 HydrophobicContact CZ3-CB 3.54Å; L269-A280 HydrophobicContact CD1-CB 3.51Å; E276-A280 WeakPolarHBondContact O-CB 3.37Å; E276-A280 PolarHBondContact O-N 3.17Å; T277-A280 PolarHBondContact O-N 2.61Å; A280-R283 PolarHBondContact O-N 3.46Å; A280-M284 WeakPolarHBondContact O-CG 3.36Å; A280-M284 PolarHBondContact O-N 2.99Å |
| 281 | L | 94.9 | Very high | 91.5 | Very high | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.8 | -44.7 | 176.8 | -64.6 | 165.5 | 0 | 0 | 0 | 112.1 | Y237 Y241 T277 L278 R283 M284 D285 R293 A294 L297 | Y237-L281 HydrophobicContact CD1-CD1 4.2Å; Y237-L281 HydrophobicContact CE1-CD1 3.51Å; Y237-L281 HydrophobicContact CE1-CD2 4.02Å; Y237-L281 HydrophobicContact CE1-CG 4.4Å; Y241-L281 HydrophobicContact CD2-CD2 3.82Å; Y241-L281 HydrophobicContact CE2-CD2 4.24Å; Y241-L281 HydrophobicContact CG-CD2 4.17Å; T277-L281 HydrophobicContact CG2-CD1 4.27Å; T277-L281 WeakPolarHBondContact O-CD1 3.26Å; T277-L281 WeakPolarHBondContact O-CG 3.41Å; T277-L281 PolarHBondContact O-N 2.93Å; L278-L281 PolarHBondContact O-N 3.26Å; L281-R283 VanDerWaalsContact C-N 3.27Å; L281-R283 PolarHBondContact O-N 2.87Å; L281-M284 HydrophobicContact CD2-CE 3.95Å; L281-M284 PolarHBondContact O-N 3.22Å; L281-D285 WeakPolarHBondContact O-CB 3.46Å; L281-D285 PolarHBondContact O-N 2.92Å; L281-R293 HydrophobicContact CB-CB 4.3Å; L281-R293 HydrophobicContact CD1-CB 4.37Å; L281-R293 HydrophobicContact CD2-CB 3.92Å; L281-R293 HydrophobicContact CG-CB 4.41Å; L281-A294 HydrophobicContact CB-CB 4.2Å; L281-L297 HydrophobicContact CD1-CB 4.29Å; L281-L297 HydrophobicContact CD1-CD2 3.64Å |
| 282 | A | 94.2 | Very high | 91.7 | Very high | 3 Ų | 3 | 42.5 Ų | 42.5 | 3% | 0.025 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.8 | -36.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L278 G279 Q286 V288 L312 P315 | L278-A282 WeakPolarHBondContact O-CB 3.37Å; L278-A282 PolarHBondContact O-N 2.8Å; G279-A282 PolarHBondContact O-N 2.64Å; A282-Q286 PolarHBondContact O-N 3.44Å; A282-V288 HydrophobicContact CB-CG1 3.54Å; A282-L312 HydrophobicContact CB-CD2 3.74Å; A282-P315 HydrophobicContact CB-CB 4.36Å |
| 283 | R | 92 | Very high | 91.8 | Very high | 11 Ų | 11 | 41.6 Ų | 41.6 | 4% | 0.042 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -70.1 | -45.5 | 175.9 | -71.6 | 179.5 | -170.9 | 82.6 | -9.6 | 112 | Y248 G279 A280 L281 Q286 P315 | Y248-R283 HydrophobicContact CE1-CB 3.76Å; G279-R283 VanDerWaalsContact CA-NH1 3.25Å; G279-R283 WeakPolarHBondContact O-CG 3.23Å; G279-R283 PolarHBondContact O-N 3.23Å; G279-R283 VanDerWaalsContact O-N 3.07Å; G279-R283 PolarHBondContact O-NH1 3.16Å; A280-R283 PolarHBondContact O-N 3.46Å; L281-R283 VanDerWaalsContact C-N 3.27Å; L281-R283 PolarHBondContact O-N 2.87Å; R283-Q286 PolarHBondContact O-N 2.94Å; R283-P315 HydrophobicContact CG-CB 4.45Å |
| 284 | M | 92.5 | Very high | 92 | Very high | 16 Ų | 16 | 38.4 Ų | 38.4 | 8% | 0.079 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -67.5 | -41.9 | 179.4 | -69.8 | -172.4 | -65.6 | 0 | 0 | 112.6 | E244 W245 Y248 A280 L281 Q286 | E244-M284 HydrophobicContact CB-SD 4.1Å; E244-M284 HydrophobicContact CG-SD 3.89Å; W245-M284 WeakPolarHBondContact CA-SD 3.47Å; W245-M284 HydrophobicContact CB-CE 4.39Å; W245-M284 HydrophobicContact CB-SD 3.9Å; W245-M284 HydrophobicContact CE3-CE 4.4Å; W245-M284 HydrophobicContact CE3-CG 4.04Å; W245-M284 HydrophobicContact CE3-SD 3.99Å; W245-M284 PolarHBondContact N-SD 3.3Å; W245-M284 VanDerWaalsContact N-SD 3.41Å; Y248-M284 HydrophobicContact CD1-CG 4.2Å; Y248-M284 HydrophobicContact CG-CG 4.02Å; A280-M284 WeakPolarHBondContact O-CG 3.36Å; A280-M284 PolarHBondContact O-N 2.99Å; L281-M284 HydrophobicContact CD2-CE 3.95Å; L281-M284 PolarHBondContact O-N 3.22Å; M284-Q286 PolarHBondContact O-N 3.26Å |
| 285 | D | 91.7 | Very high | 92.1 | Very high | 47 Ų | 47 | 38.2 Ų | 38.2 | 25% | 0.251 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -66.2 | -25.2 | 178.6 | -79.3 | -16.5 | 0 | 0 | 0 | 112.5 | L281 S287 R293 | L281-D285 WeakPolarHBondContact O-CB 3.46Å; L281-D285 PolarHBondContact O-N 2.92Å; D285-S287 VanDerWaalsContact CB-O 3.23Å; D285-S287 WeakPolarHBondContact CB-O 3.41Å; D285-S287 PolarHBondContact O-N 3.02Å; D285-R293 IonicContact OD1-CZ 2.66Å; D285-R293 IonicContact OD1-NE 2.75Å; D285-R293 PolarHBondContact OD1-NE 3.47Å; D285-R293 IonicContact OD1-NH2 3.36Å; D285-R293 PolarHBondContact OD1-NH2 3.28Å; D285-R293 WeakPolarHBondContact OD2-CB 3.23Å; D285-R293 PolarHBondContact OD2-N 3.39Å; D285-R293 IonicContact OD2-NE 3.06Å |
| 286 | Q | 86.1 | Confident | 92.2 | Very high | 142 Ų | 142 | 39 Ų | 39 | 66% | 0.664 | 20% | 0.203 | S | C | * | . | S | Bend | trans | 53.3 | 8.3 | -167.4 | -57.5 | -179.6 | 3 | 0 | 0 | 113.6 | A282 R283 M284 N321 | A282-Q286 PolarHBondContact O-N 3.44Å; R283-Q286 PolarHBondContact O-N 2.94Å; M284-Q286 PolarHBondContact O-N 3.26Å; Q286-N321 PolarHBondContact O-ND2 3.4Å |
| 287 | S | 90.3 | Very high | 92.2 | Very high | 31 Ų | 31 | 35.6 Ų | 35.6 | 22% | 0.217 | 19% | 0.186 | C | C | . | . | trans | -153.8 | 139.9 | 172.8 | -172 | 0 | 0 | 0 | 0 | 112 | D285 K289 D324 | D285-S287 VanDerWaalsContact CB-O 3.23Å; D285-S287 WeakPolarHBondContact CB-O 3.41Å; D285-S287 PolarHBondContact O-N 3.02Å; S287-K289 WeakPolarHBondContact OG-CD 3.33Å; S287-K289 WeakPolarHBondContact OG-CG 3.46Å; S287-K289 PolarHBondContact OG-N 3.47Å; S287-D324 VanDerWaalsContact C-OD2 3.3Å; S287-D324 WeakPolarHBondContact CA-OD2 3.4Å; S287-D324 VanDerWaalsContact CB-OD2 3.32Å; S287-D324 WeakPolarHBondContact CB-OD2 3.41Å; S287-D324 PolarHBondContact OG-OD2 3.45Å | ||
| 288 | V | 89.3 | Confident | 92.2 | Very high | 4 Ų | 4 | 35.7 Ų | 35.7 | 2% | 0.024 | 19% | 0.187 | C | C | . | . | trans | -112 | 24.6 | 177.7 | -65.6 | 0 | 0 | 0 | 0 | 112.1 | A282 L312 L316 D324 I328 | A282-V288 HydrophobicContact CB-CG1 3.54Å; V288-L312 HydrophobicContact CB-CD1 4.02Å; V288-L312 HydrophobicContact CG1-CD1 3.93Å; V288-L312 HydrophobicContact CG1-CD2 4.37Å; V288-L312 HydrophobicContact CG2-CD1 4.29Å; V288-L316 HydrophobicContact CG1-CD2 4.27Å; V288-L316 HydrophobicContact CG2-CD1 4Å; V288-L316 HydrophobicContact CG2-CD2 4.07Å; V288-D324 HydrophobicContact CG2-CB 3.85Å; V288-D324 PolarHBondContact N-OD2 2.96Å; V288-I328 HydrophobicContact CG2-CG2 3.6Å | ||
| 289 | K | 88 | Confident | 92.1 | Very high | 109 Ų | 109 | 41.5 Ų | 41.5 | 47% | 0.474 | 21% | 0.213 | S | C | . | . | S | Bend | trans | -65.4 | 178.1 | 175.1 | -70.8 | 172.8 | -170.2 | 167.2 | 0 | 112 | S287 N291 S292 D324 F327 | S287-K289 WeakPolarHBondContact OG-CD 3.33Å; S287-K289 WeakPolarHBondContact OG-CG 3.46Å; S287-K289 PolarHBondContact OG-N 3.47Å; K289-N291 PolarHBondContact O-N 2.9Å; K289-S292 VanDerWaalsContact O-CB 3.25Å; K289-S292 WeakPolarHBondContact O-CB 3.23Å; K289-S292 PolarHBondContact O-N 3.27Å; K289-S292 PolarHBondContact O-OG 3.18Å; K289-S292 VanDerWaalsContact O-OG 3.09Å; K289-D324 WeakPolarHBondContact CE-OD1 3.22Å; K289-D324 IonicContact NZ-OD1 3.73Å; K289-F327 HydrophobicContact CB-CE1 4.47Å; K289-F327 HydrophobicContact CG-CD1 4.26Å; K289-F327 HydrophobicContact CG-CE1 4.16Å; K289-F327 HydrophobicContact CG-CZ 4.45Å |
| 290 | T | 87.1 | Confident | 92 | Very high | 96 Ų | 96 | 47.1 Ų | 47.1 | 59% | 0.589 | 24% | 0.237 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -53 | 129.8 | -178.3 | -49.2 | 0 | 0 | 0 | 0 | 111.8 | S292 E295 | T290-S292 VanDerWaalsContact C-N 3.33Å; T290-E295 WeakPolarHBondContact CA-OE2 3.45Å |
| 291 | N | 89.2 | Confident | 91.9 | Very high | 130 Ų | 130 | 48.6 Ų | 48.6 | 70% | 0.695 | 24% | 0.243 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 68.6 | 18.7 | -174.8 | -49.2 | -47.2 | 0 | 0 | 0 | 115.6 | K289 E295 | K289-N291 PolarHBondContact O-N 2.9Å; N291-E295 PolarHBondContact N-OE2 3.23Å |
| 292 | S | 93.3 | Very high | 91.8 | Very high | 12 Ų | 12 | 57.8 Ų | 57.8 | 8% | 0.084 | 28% | 0.283 | C | S | . | . | trans | -58.6 | 158.4 | 166.5 | 61 | 0 | 0 | 0 | 0 | 111.4 | K289 T290 A294 E295 T296 | K289-S292 VanDerWaalsContact O-CB 3.25Å; K289-S292 WeakPolarHBondContact O-CB 3.23Å; K289-S292 PolarHBondContact O-N 3.27Å; K289-S292 PolarHBondContact O-OG 3.18Å; K289-S292 VanDerWaalsContact O-OG 3.09Å; T290-S292 VanDerWaalsContact C-N 3.33Å; S292-A294 VanDerWaalsContact C-N 3.25Å; S292-A294 PolarHBondContact O-N 3.24Å; S292-E295 PolarHBondContact O-N 3.38Å; S292-E295 WeakPolarHBondContact OG-CB 3.4Å; S292-E295 PolarHBondContact OG-N 3.4Å; S292-T296 WeakPolarHBondContact O-CB 3.46Å; S292-T296 PolarHBondContact O-N 2.86Å; S292-T296 PolarHBondContact O-OG1 3.11Å | ||
| 293 | R | 94.6 | Very high | 91.7 | Very high | 33 Ų | 33 | 59 Ų | 59 | 13% | 0.125 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -64.9 | -35.5 | 178.6 | -67.3 | -178.6 | -74 | -171.2 | -11.5 | 111.1 | Y237 Y241 E244 L281 D285 L297 | Y237-R293 PolarHBondContact OH-O 2.78Å; Y241-R293 VanDerWaalsContact CE1-NH1 3.28Å; Y241-R293 WeakPolarHBondContact OH-CD 3.45Å; E244-R293 IonicContact OE1-CZ 2.71Å; E244-R293 IonicContact OE1-NH1 3.37Å; E244-R293 PolarHBondContact OE1-NH1 3.44Å; E244-R293 IonicContact OE1-NH2 3.8Å; E244-R293 PolarHBondContact OE1-NH2 3.14Å; E244-R293 IonicContact OE2-CZ 3.32Å; E244-R293 IonicContact OE2-NH1 3.06Å; E244-R293 PolarHBondContact OE2-NH1 3.11Å; E244-R293 IonicContact OE2-NH2 2.78Å; L281-R293 HydrophobicContact CB-CB 4.3Å; L281-R293 HydrophobicContact CD1-CB 4.37Å; L281-R293 HydrophobicContact CD2-CB 3.92Å; L281-R293 HydrophobicContact CG-CB 4.41Å; D285-R293 IonicContact OD1-CZ 2.66Å; D285-R293 IonicContact OD1-NE 2.75Å; D285-R293 PolarHBondContact OD1-NE 3.47Å; D285-R293 IonicContact OD1-NH2 3.36Å; D285-R293 PolarHBondContact OD1-NH2 3.28Å; D285-R293 WeakPolarHBondContact OD2-CB 3.23Å; D285-R293 PolarHBondContact OD2-N 3.39Å; D285-R293 IonicContact OD2-NE 3.06Å; R293-L297 WeakPolarHBondContact O-CB 3.43Å; R293-L297 PolarHBondContact O-N 2.97Å |
| 294 | A | 94.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -62.6 | -49.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L278 L281 S292 T296 L297 G298 F308 L312 | L278-A294 HydrophobicContact CD2-CB 4.2Å; L278-A294 WeakPolarHBondContact CD2-O 3.41Å; L281-A294 HydrophobicContact CB-CB 4.2Å; S292-A294 VanDerWaalsContact C-N 3.25Å; S292-A294 PolarHBondContact O-N 3.24Å; A294-T296 VanDerWaalsContact C-N 3.34Å; A294-T296 PolarHBondContact O-N 3.34Å; A294-L297 PolarHBondContact O-N 3.39Å; A294-G298 PolarHBondContact O-N 2.88Å; A294-F308 HydrophobicContact CB-CZ 4.37Å; A294-F308 WeakPolarHBondContact O-CE2 3.44Å; A294-L312 HydrophobicContact CB-CD2 4.5Å |
| 295 | E | 93.5 | Very high | 91.6 | Very high | 41 Ų | 41 | 65.2 Ų | 65.2 | 19% | 0.192 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -62.5 | -41.6 | 178.6 | -168.4 | -164 | -168.1 | 0 | 0 | 111.7 | T290 N291 S292 L297 G298 K299 F308 | T290-E295 WeakPolarHBondContact CA-OE2 3.45Å; N291-E295 PolarHBondContact N-OE2 3.23Å; S292-E295 PolarHBondContact O-N 3.38Å; S292-E295 WeakPolarHBondContact OG-CB 3.4Å; S292-E295 PolarHBondContact OG-N 3.4Å; E295-L297 PolarHBondContact O-N 2.86Å; E295-G298 PolarHBondContact O-N 3.42Å; E295-K299 HydrophobicContact CG-CD 4.36Å; E295-K299 WeakPolarHBondContact O-CG 3.37Å; E295-K299 PolarHBondContact O-N 3.32Å; E295-K299 VanDerWaalsContact OE1-CE 3.23Å; E295-K299 WeakPolarHBondContact OE1-CE 3.43Å; E295-K299 IonicContact OE1-NZ 2.73Å; E295-K299 PolarHBondContact OE1-NZ 3.17Å; E295-K299 IonicContact OE2-NZ 3.16Å; E295-K299 PolarHBondContact OE2-NZ 3.46Å; E295-F308 HydrophobicContact CB-CZ 4.1Å |
| 296 | T | 93.9 | Very high | 91.6 | Very high | 68 Ų | 68 | 67.4 Ų | 67.4 | 42% | 0.417 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -61.3 | -45.3 | 178.1 | -57.8 | 0 | 0 | 0 | 0 | 111.3 | S292 A294 K300 | S292-T296 WeakPolarHBondContact O-CB 3.46Å; S292-T296 PolarHBondContact O-N 2.86Å; S292-T296 PolarHBondContact O-OG1 3.11Å; A294-T296 VanDerWaalsContact C-N 3.34Å; A294-T296 PolarHBondContact O-N 3.34Å; T296-K300 PolarHBondContact O-N 3.33Å; T296-K300 VanDerWaalsContact O-N 3.07Å |
| 297 | L | 94.1 | Very high | 91.8 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -65.2 | -44.8 | 176.4 | -174.5 | 64.2 | 0 | 0 | 0 | 111.4 | Y237 L274 T277 L278 L281 R293 A294 E295 K299 K300 F301 | Y237-L297 HydrophobicContact CD1-CD1 3.94Å; Y237-L297 HydrophobicContact CD1-CD2 4.01Å; Y237-L297 HydrophobicContact CD1-CG 4.44Å; Y237-L297 HydrophobicContact CD2-CD1 4.07Å; Y237-L297 HydrophobicContact CE1-CB 4.11Å; Y237-L297 HydrophobicContact CE1-CD1 4.19Å; Y237-L297 HydrophobicContact CE1-CD2 4.07Å; Y237-L297 HydrophobicContact CE1-CG 4.36Å; Y237-L297 HydrophobicContact CE2-CD1 4.31Å; Y237-L297 HydrophobicContact CG-CD1 3.86Å; L274-L297 HydrophobicContact CD1-CD1 4.46Å; L274-L297 HydrophobicContact CD1-CD2 3.8Å; L274-L297 HydrophobicContact CD1-CG 3.88Å; T277-L297 HydrophobicContact CG2-CD2 3.69Å; L278-L297 HydrophobicContact CD2-CB 3.94Å; L278-L297 HydrophobicContact CD2-CD2 3.95Å; L278-L297 HydrophobicContact CD2-CG 4.13Å; L278-L297 HydrophobicContact CG-CD2 4.28Å; L281-L297 HydrophobicContact CD1-CB 4.29Å; L281-L297 HydrophobicContact CD1-CD2 3.64Å; R293-L297 WeakPolarHBondContact O-CB 3.43Å; R293-L297 PolarHBondContact O-N 2.97Å; A294-L297 PolarHBondContact O-N 3.39Å; E295-L297 PolarHBondContact O-N 2.86Å; L297-K299 VanDerWaalsContact C-N 3.34Å; L297-K299 PolarHBondContact O-N 2.96Å; L297-K300 WeakPolarHBondContact O-CB 3.43Å; L297-K300 PolarHBondContact O-N 3.25Å; L297-K300 VanDerWaalsContact O-N 3.1Å; L297-F301 HydrophobicContact CD1-CD2 3.69Å; L297-F301 HydrophobicContact CD1-CE2 3.51Å; L297-F301 HydrophobicContact CG-CD2 4.2Å; L297-F301 HydrophobicContact CG-CE2 4.41Å; L297-F301 WeakPolarHBondContact O-CD2 3.43Å; L297-F301 PolarHBondContact O-N 3.4Å; L297-F301 VanDerWaalsContact O-N 3.08Å |
| 298 | G | 93.7 | Very high | 92 | Very high | 2 Ų | 2 | 65.9 Ų | 65.9 | 2% | 0.021 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -58 | -44 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | A294 E295 F301 K302 I303 | A294-G298 PolarHBondContact O-N 2.88Å; E295-G298 PolarHBondContact O-N 3.42Å; G298-F301 CarbonylContact O-C 3.56Å; G298-F301 PolarHBondContact O-N 2.98Å; G298-K302 PolarHBondContact O-N 3.2Å; G298-K302 VanDerWaalsContact O-N 3.13Å; G298-I303 PolarHBondContact O-N 3.39Å |
| 299 | K | 93.1 | Very high | 92.2 | Very high | 123 Ų | 123 | 67.4 Ų | 67.4 | 54% | 0.535 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63 | -40.6 | 174 | -73.7 | 174.1 | -177.3 | 164.3 | 0 | 112.4 | E295 L297 F301 K302 | E295-K299 HydrophobicContact CG-CD 4.36Å; E295-K299 WeakPolarHBondContact O-CG 3.37Å; E295-K299 PolarHBondContact O-N 3.32Å; E295-K299 VanDerWaalsContact OE1-CE 3.23Å; E295-K299 WeakPolarHBondContact OE1-CE 3.43Å; E295-K299 IonicContact OE1-NZ 2.73Å; E295-K299 PolarHBondContact OE1-NZ 3.17Å; E295-K299 IonicContact OE2-NZ 3.16Å; E295-K299 PolarHBondContact OE2-NZ 3.46Å; L297-K299 VanDerWaalsContact C-N 3.34Å; L297-K299 PolarHBondContact O-N 2.96Å; K299-F301 VanDerWaalsContact C-N 3.29Å; K299-F301 PolarHBondContact O-N 3.29Å; K299-K302 PolarHBondContact O-N 2.93Å; K299-K302 VanDerWaalsContact O-N 3.11Å |
| 300 | K | 92.4 | Very high | 92.5 | Very high | 118 Ų | 118 | 65.8 Ų | 65.8 | 51% | 0.513 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -60.5 | -40.1 | 178.7 | -169.3 | 176.4 | -170.7 | -179.2 | 0 | 111.9 | V233 T296 L297 K302 | V233-K300 HydrophobicContact CG1-CD 3.8Å; T296-K300 PolarHBondContact O-N 3.33Å; T296-K300 VanDerWaalsContact O-N 3.07Å; L297-K300 WeakPolarHBondContact O-CB 3.43Å; L297-K300 PolarHBondContact O-N 3.25Å; L297-K300 VanDerWaalsContact O-N 3.1Å; K300-K302 VanDerWaalsContact C-N 3.32Å |
| 301 | F | 91.4 | Very high | 92.8 | Very high | 35 Ų | 35 | 64.1 Ų | 64.1 | 15% | 0.154 | 31% | 0.308 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.9 | 10.1 | 177.4 | -77.7 | -92.9 | 0 | 0 | 0 | 113.8 | E230 V233 I234 L274 L297 G298 K299 I303 | E230-F301 HydrophobicContact CB-CE1 3.91Å; E230-F301 HydrophobicContact CG-CD1 4.46Å; E230-F301 HydrophobicContact CG-CE1 4.08Å; V233-F301 HydrophobicContact CB-CZ 4.2Å; V233-F301 HydrophobicContact CG1-CE2 3.75Å; V233-F301 HydrophobicContact CG1-CZ 3.67Å; I234-F301 HydrophobicContact CB-CE2 4.43Å; I234-F301 HydrophobicContact CB-CZ 3.82Å; L274-F301 HydrophobicContact CD1-CD2 3.96Å; L274-F301 HydrophobicContact CD1-CE2 4.31Å; L274-F301 HydrophobicContact CD1-CG 4.13Å; L274-F301 HydrophobicContact CD2-CB 3.69Å; L274-F301 HydrophobicContact CD2-CD1 3.88Å; L274-F301 HydrophobicContact CD2-CD2 4.39Å; L274-F301 HydrophobicContact CD2-CG 3.73Å; L297-F301 HydrophobicContact CD1-CD2 3.69Å; L297-F301 HydrophobicContact CD1-CE2 3.51Å; L297-F301 HydrophobicContact CG-CD2 4.2Å; L297-F301 HydrophobicContact CG-CE2 4.41Å; L297-F301 WeakPolarHBondContact O-CD2 3.43Å; L297-F301 PolarHBondContact O-N 3.4Å; L297-F301 VanDerWaalsContact O-N 3.08Å; G298-F301 CarbonylContact O-C 3.56Å; G298-F301 PolarHBondContact O-N 2.98Å; K299-F301 VanDerWaalsContact C-N 3.29Å; K299-F301 PolarHBondContact O-N 3.29Å; F301-I303 HydrophobicContact CB-CG1 4.12Å; F301-I303 PolarHBondContact O-N 2.93Å; F301-I303 VanDerWaalsContact O-N 3.12Å |
| 302 | K | 92.1 | Very high | 93.1 | Very high | 193 Ų | 193 | 57.9 Ų | 57.9 | 84% | 0.839 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.7 | 33.6 | 178.1 | -54.4 | 175.9 | -176.2 | 170.1 | 0 | 113.5 | G298 K299 K300 S304 | G298-K302 PolarHBondContact O-N 3.2Å; G298-K302 VanDerWaalsContact O-N 3.13Å; K299-K302 PolarHBondContact O-N 2.93Å; K299-K302 VanDerWaalsContact O-N 3.11Å; K300-K302 VanDerWaalsContact C-N 3.32Å; K302-S304 PolarHBondContact O-N 3.07Å |
| 303 | I | 92.2 | Very high | 93.1 | Very high | 27 Ų | 27 | 57.3 Ų | 57.3 | 14% | 0.138 | 27% | 0.271 | C | S | . | . | trans | -64.5 | 131.3 | 175.8 | -55.6 | -179.4 | 0 | 0 | 0 | 108 | L274 L278 G298 F301 Q307 F308 L311 | L274-I303 HydrophobicContact CD2-CD1 3.67Å; L274-I303 HydrophobicContact CD2-CG1 4.16Å; L274-I303 HydrophobicContact CG-CD1 4.08Å; L278-I303 HydrophobicContact CD1-CD1 3.46Å; L278-I303 VanDerWaalsContact CD1-CD1 3.46Å; G298-I303 PolarHBondContact O-N 3.39Å; F301-I303 HydrophobicContact CB-CG1 4.12Å; F301-I303 PolarHBondContact O-N 2.93Å; F301-I303 VanDerWaalsContact O-N 3.12Å; I303-Q307 HydrophobicContact CG2-CB 3.57Å; I303-F308 HydrophobicContact CG2-CB 4.02Å; I303-L311 HydrophobicContact CD1-CD1 4.22Å; I303-L311 HydrophobicContact CG2-CD1 4.39Å | ||
| 304 | S | 92.1 | Very high | 93 | Very high | 52 Ų | 52 | 60 Ų | 60 | 36% | 0.364 | 29% | 0.285 | S | S | . | . | trans | -62.8 | 149.5 | 175.9 | 66.5 | 0 | 0 | 0 | 0 | 110.8 | K302 E306 Q307 F308 | K302-S304 PolarHBondContact O-N 3.07Å; S304-E306 PolarHBondContact O-N 3.46Å; S304-E306 VanDerWaalsContact O-N 3.13Å; S304-Q307 PolarHBondContact O-N 3.3Å; S304-Q307 VanDerWaalsContact O-N 3.13Å; S304-Q307 WeakPolarHBondContact OG-CB 3.46Å; S304-Q307 VanDerWaalsContact OG-CD 3.24Å; S304-Q307 WeakPolarHBondContact OG-CG 3.41Å; S304-Q307 PolarHBondContact OG-N 2.64Å; S304-Q307 PolarHBondContact OG-OE1 2.72Å; S304-F308 WeakPolarHBondContact O-CB 3.37Å; S304-F308 PolarHBondContact O-N 3.03Å | ||
| 305 | D | 90.8 | Very high | 92.9 | Very high | 107 Ų | 107 | 60.4 Ų | 60.4 | 57% | 0.572 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -54.6 | -36 | 179 | -72 | 3.7 | 0 | 0 | 0 | 112.5 | R309 | D305-R309 VanDerWaalsContact C-NH1 3.26Å; D305-R309 VanDerWaalsContact CB-NH1 3.32Å; D305-R309 VanDerWaalsContact O-CG 3.28Å; D305-R309 WeakPolarHBondContact O-CG 3.36Å; D305-R309 PolarHBondContact O-N 2.9Å; D305-R309 VanDerWaalsContact O-N 3.13Å; D305-R309 PolarHBondContact O-NH1 3.42Å; D305-R309 VanDerWaalsContact O-NH1 3.14Å; D305-R309 IonicContact OD2-NH2 3.89Å |
| 306 | E | 91.2 | Very high | 92.9 | Very high | 93 Ų | 93 | 58.5 Ų | 58.5 | 44% | 0.435 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -67.3 | -49.5 | 177.2 | 175.3 | 166.4 | -168.5 | 0 | 0 | 112 | S304 F308 R309 W310 I343 | S304-E306 PolarHBondContact O-N 3.46Å; S304-E306 VanDerWaalsContact O-N 3.13Å; E306-F308 VanDerWaalsContact C-N 3.31Å; E306-F308 PolarHBondContact O-N 3.46Å; E306-R309 WeakPolarHBondContact O-CB 3.23Å; E306-R309 PolarHBondContact O-N 2.9Å; E306-W310 VanDerWaalsContact O-CD1 3.24Å; E306-W310 PolarHBondContact O-N 2.81Å; E306-W310 VanDerWaalsContact O-N 3.09Å; E306-I343 HydrophobicContact CG-CG2 4.02Å |
| 307 | Q | 91.9 | Very high | 92.9 | Very high | 112 Ų | 112 | 56 Ų | 56 | 52% | 0.523 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.5 | -43.2 | 176.2 | -73.8 | 166.8 | -38.7 | 0 | 0 | 111.2 | I303 S304 R309 W310 L311 | I303-Q307 HydrophobicContact CG2-CB 3.57Å; S304-Q307 PolarHBondContact O-N 3.3Å; S304-Q307 VanDerWaalsContact O-N 3.13Å; S304-Q307 WeakPolarHBondContact OG-CB 3.46Å; S304-Q307 VanDerWaalsContact OG-CD 3.24Å; S304-Q307 WeakPolarHBondContact OG-CG 3.41Å; S304-Q307 PolarHBondContact OG-N 2.64Å; S304-Q307 PolarHBondContact OG-OE1 2.72Å; Q307-R309 VanDerWaalsContact C-N 3.28Å; Q307-R309 PolarHBondContact O-N 3.36Å; Q307-W310 PolarHBondContact O-N 3.39Å; Q307-L311 VanDerWaalsContact O-CG 3.25Å; Q307-L311 WeakPolarHBondContact O-CG 3.41Å; Q307-L311 PolarHBondContact O-N 2.93Å |
| 308 | F | 93.7 | Very high | 92.6 | Very high | 28 Ų | 28 | 58.4 Ų | 58.4 | 12% | 0.123 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -57.7 | -42.7 | 178.3 | -176.8 | -101.1 | 0 | 0 | 0 | 111.6 | L278 A294 E295 I303 S304 E306 L311 L312 | L278-F308 HydrophobicContact CD2-CE2 4.18Å; A294-F308 HydrophobicContact CB-CZ 4.37Å; A294-F308 WeakPolarHBondContact O-CE2 3.44Å; E295-F308 HydrophobicContact CB-CZ 4.1Å; I303-F308 HydrophobicContact CG2-CB 4.02Å; S304-F308 WeakPolarHBondContact O-CB 3.37Å; S304-F308 PolarHBondContact O-N 3.03Å; E306-F308 VanDerWaalsContact C-N 3.31Å; E306-F308 PolarHBondContact O-N 3.46Å; F308-L311 PolarHBondContact O-N 2.69Å; F308-L312 HydrophobicContact CD1-CD1 3.95Å; F308-L312 HydrophobicContact CE1-CD1 3.31Å; F308-L312 HydrophobicContact CE1-CG 4.34Å; F308-L312 HydrophobicContact CE2-CD1 4.16Å; F308-L312 HydrophobicContact CZ-CD1 3.44Å; F308-L312 VanDerWaalsContact CZ-CD1 3.44Å; F308-L312 HydrophobicContact CZ-CG 4.3Å; F308-L312 WeakPolarHBondContact O-CG 3.42Å; F308-L312 PolarHBondContact O-N 3.38Å |
| 309 | R | 93.9 | Very high | 92.3 | Very high | 37 Ų | 37 | 60.7 Ų | 60.7 | 14% | 0.14 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61.7 | -49.7 | 175.3 | -76.9 | 177.4 | -162 | 103.8 | 7.7 | 112.1 | D305 E306 Q307 L311 L312 I313 I328 M329 T342 I343 | D305-R309 VanDerWaalsContact C-NH1 3.26Å; D305-R309 VanDerWaalsContact CB-NH1 3.32Å; D305-R309 VanDerWaalsContact O-CG 3.28Å; D305-R309 WeakPolarHBondContact O-CG 3.36Å; D305-R309 PolarHBondContact O-N 2.9Å; D305-R309 VanDerWaalsContact O-N 3.13Å; D305-R309 PolarHBondContact O-NH1 3.42Å; D305-R309 VanDerWaalsContact O-NH1 3.14Å; D305-R309 IonicContact OD2-NH2 3.89Å; E306-R309 WeakPolarHBondContact O-CB 3.23Å; E306-R309 PolarHBondContact O-N 2.9Å; Q307-R309 VanDerWaalsContact C-N 3.28Å; Q307-R309 PolarHBondContact O-N 3.36Å; R309-L311 VanDerWaalsContact C-N 3.29Å; R309-L311 PolarHBondContact O-N 3.04Å; R309-L312 PolarHBondContact O-N 3.47Å; R309-L312 VanDerWaalsContact O-N 3.13Å; R309-I313 WeakPolarHBondContact O-CG1 3.37Å; R309-I313 PolarHBondContact O-N 3.49Å; R309-I328 VanDerWaalsContact CD-O 3.23Å; R309-I328 WeakPolarHBondContact CD-O 3.48Å; R309-I328 PolarHBondContact NE-O 2.88Å; R309-M329 HydrophobicContact CB-CE 3.56Å; R309-M329 HydrophobicContact CB-SD 4.25Å; R309-M329 HydrophobicContact CG-CE 4.09Å; R309-M329 WeakPolarHBondContact O-CE 3.46Å; R309-T342 WeakPolarHBondContact CD-OG1 3.16Å; R309-T342 PolarHBondContact NE-OG1 3.05Å; R309-I343 HydrophobicContact CB-CG2 4.16Å |
| 310 | W | 93.8 | Very high | 92.2 | Very high | 74 Ų | 74 | 61.7 Ų | 61.7 | 28% | 0.28 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -56.9 | -43 | 177.9 | -79.3 | 112 | 0 | 0 | 0 | 112.3 | E306 Q307 L312 I313 I343 R347 F348 H351 | E306-W310 VanDerWaalsContact O-CD1 3.24Å; E306-W310 PolarHBondContact O-N 2.81Å; E306-W310 VanDerWaalsContact O-N 3.09Å; Q307-W310 PolarHBondContact O-N 3.39Å; W310-L312 PolarHBondContact O-N 3.09Å; W310-I313 HydrophobicContact CD2-CD1 4.11Å; W310-I313 HydrophobicContact CE3-CD1 3.4Å; W310-I313 HydrophobicContact CZ3-CD1 3.72Å; W310-I313 PolarHBondContact O-N 3.31Å; W310-I343 HydrophobicContact CD2-CD1 4.2Å; W310-I343 HydrophobicContact CE3-CD1 4.5Å; W310-I343 HydrophobicContact CH2-CD1 4.11Å; W310-I343 HydrophobicContact CZ2-CB 4.32Å; W310-I343 HydrophobicContact CZ2-CD1 3.8Å; W310-I343 HydrophobicContact CZ2-CG1 4.41Å; W310-I343 HydrophobicContact CZ3-CD1 4.45Å; W310-R347 HydrophobicContact CH2-CB 3.9Å; W310-R347 HydrophobicContact CZ2-CB 4.19Å; W310-F348 HydrophobicContact CH2-CB 4.35Å; W310-H351 HydrophobicContact CZ3-CB 4.12Å; W310-H351 AromaticContact CZ3-CD2 3.77Å |
| 311 | L | 93.5 | Very high | 92.3 | Very high | 61 Ų | 61 | 57.4 Ų | 57.4 | 32% | 0.319 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -64.7 | -23 | 179.6 | -69.4 | 175.8 | 0 | 0 | 0 | 114 | C275 L278 I303 Q307 F308 R309 P315 | C275-L311 HydrophobicContact CB-CD2 3.55Å; L278-L311 HydrophobicContact CD1-CD1 3.84Å; I303-L311 HydrophobicContact CD1-CD1 4.22Å; I303-L311 HydrophobicContact CG2-CD1 4.39Å; Q307-L311 VanDerWaalsContact O-CG 3.25Å; Q307-L311 WeakPolarHBondContact O-CG 3.41Å; Q307-L311 PolarHBondContact O-N 2.93Å; F308-L311 PolarHBondContact O-N 2.69Å; R309-L311 VanDerWaalsContact C-N 3.29Å; R309-L311 PolarHBondContact O-N 3.04Å; L311-P315 WeakPolarHBondContact O-CD 3.48Å |
| 312 | L | 94.7 | Very high | 92.4 | Very high | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -96.3 | -11.4 | -178 | -69.6 | -174.5 | 0 | 0 | 0 | 114.4 | A282 V288 A294 F308 R309 W310 P315 L316 I328 | A282-L312 HydrophobicContact CB-CD2 3.74Å; V288-L312 HydrophobicContact CB-CD1 4.02Å; V288-L312 HydrophobicContact CG1-CD1 3.93Å; V288-L312 HydrophobicContact CG1-CD2 4.37Å; V288-L312 HydrophobicContact CG2-CD1 4.29Å; A294-L312 HydrophobicContact CB-CD2 4.5Å; F308-L312 HydrophobicContact CD1-CD1 3.95Å; F308-L312 HydrophobicContact CE1-CD1 3.31Å; F308-L312 HydrophobicContact CE1-CG 4.34Å; F308-L312 HydrophobicContact CE2-CD1 4.16Å; F308-L312 HydrophobicContact CZ-CD1 3.44Å; F308-L312 VanDerWaalsContact CZ-CD1 3.44Å; F308-L312 HydrophobicContact CZ-CG 4.3Å; F308-L312 WeakPolarHBondContact O-CG 3.42Å; F308-L312 PolarHBondContact O-N 3.38Å; R309-L312 PolarHBondContact O-N 3.47Å; R309-L312 VanDerWaalsContact O-N 3.13Å; W310-L312 PolarHBondContact O-N 3.09Å; L312-P315 WeakPolarHBondContact O-CD 3.49Å; L312-L316 HydrophobicContact CB-CD1 4.14Å; L312-L316 WeakPolarHBondContact O-CB 3.27Å; L312-L316 WeakPolarHBondContact O-CD1 3.38Å; L312-L316 WeakPolarHBondContact O-CG 3.5Å; L312-L316 PolarHBondContact O-N 3.28Å; L312-L316 VanDerWaalsContact O-N 3.11Å; L312-I328 HydrophobicContact CB-CD1 3.71Å; L312-I328 HydrophobicContact CD1-CD1 4.18Å |
| 313 | I | 94.2 | Very high | 92.5 | Very high | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -58.6 | -59.1 | -177.2 | -68.5 | 165.6 | 0 | 0 | 0 | 110.6 | R309 W310 L316 V317 L325 M329 I343 F348 L352 L355 | R309-I313 WeakPolarHBondContact O-CG1 3.37Å; R309-I313 PolarHBondContact O-N 3.49Å; W310-I313 HydrophobicContact CD2-CD1 4.11Å; W310-I313 HydrophobicContact CE3-CD1 3.4Å; W310-I313 HydrophobicContact CZ3-CD1 3.72Å; W310-I313 PolarHBondContact O-N 3.31Å; I313-L316 PolarHBondContact O-N 3.4Å; I313-V317 HydrophobicContact CG2-CG2 4Å; I313-V317 WeakPolarHBondContact O-CB 3.32Å; I313-V317 VanDerWaalsContact O-CG2 3.23Å; I313-V317 WeakPolarHBondContact O-CG2 3.49Å; I313-V317 PolarHBondContact O-N 3.47Å; I313-L325 HydrophobicContact CG1-CD1 4.28Å; I313-M329 HydrophobicContact CD1-CE 3.98Å; I313-M329 HydrophobicContact CG1-CE 3.48Å; I313-M329 VanDerWaalsContact CG1-CE 3.48Å; I313-I343 HydrophobicContact CD1-CD1 4.04Å; I313-F348 HydrophobicContact CD1-CD2 3.71Å; I313-F348 HydrophobicContact CD1-CE2 3.84Å; I313-F348 HydrophobicContact CG1-CD2 4.41Å; I313-F348 HydrophobicContact CG1-CE2 4.04Å; I313-F348 HydrophobicContact CG2-CE2 4.39Å; I313-L352 HydrophobicContact CG2-CD2 3.99Å; I313-L355 HydrophobicContact CG2-CD1 3.97Å |
| 314 | E | 92 | Very high | 92.6 | Very high | 89 Ų | 89 | 54.1 Ų | 54.1 | 42% | 0.416 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.9 | -45.7 | -175.7 | 179.6 | 172.1 | -169.7 | 0 | 0 | 112.8 | L316 V317 Q318 L355 | E314-L316 VanDerWaalsContact C-N 3.33Å; E314-L316 PolarHBondContact O-N 2.96Å; E314-V317 PolarHBondContact O-N 2.89Å; E314-Q318 HydrophobicContact CG-CG 4.09Å; E314-Q318 VanDerWaalsContact O-CB 3.32Å; E314-Q318 WeakPolarHBondContact O-CB 3.28Å; E314-Q318 VanDerWaalsContact O-CG 3.26Å; E314-Q318 WeakPolarHBondContact O-CG 3.36Å; E314-Q318 PolarHBondContact O-N 3.25Å; E314-Q318 PolarHBondContact OE1-NE2 3.41Å; E314-L355 HydrophobicContact CB-CD1 4.28Å; E314-L355 HydrophobicContact CG-CD2 4.37Å |
| 315 | P | 92.2 | Very high | 92.7 | Very high | 8 Ų | 8 | 51.6 Ų | 51.6 | 5% | 0.052 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -53.3 | -43.6 | 172.1 | -28.8 | 34.4 | 0 | 0 | 0 | 115 | A282 R283 L311 L312 S319 | A282-P315 HydrophobicContact CB-CB 4.36Å; R283-P315 HydrophobicContact CG-CB 4.45Å; L311-P315 WeakPolarHBondContact O-CD 3.48Å; L312-P315 WeakPolarHBondContact O-CD 3.49Å; P315-S319 WeakPolarHBondContact O-CB 3.34Å; P315-S319 PolarHBondContact O-N 3.15Å; P315-S319 PolarHBondContact O-OG 3.47Å |
| 316 | L | 94.2 | Very high | 92.8 | Very high | 2 Ų | 2 | 50.4 Ų | 50.4 | 1% | 0.01 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -73.6 | -40.5 | -179.6 | -66.3 | 171 | 0 | 0 | 0 | 111.7 | V288 L312 I313 E314 S319 Q320 N321 D324 L325 I328 | V288-L316 HydrophobicContact CG1-CD2 4.27Å; V288-L316 HydrophobicContact CG2-CD1 4Å; V288-L316 HydrophobicContact CG2-CD2 4.07Å; L312-L316 HydrophobicContact CB-CD1 4.14Å; L312-L316 WeakPolarHBondContact O-CB 3.27Å; L312-L316 WeakPolarHBondContact O-CD1 3.38Å; L312-L316 WeakPolarHBondContact O-CG 3.5Å; L312-L316 PolarHBondContact O-N 3.28Å; L312-L316 VanDerWaalsContact O-N 3.11Å; I313-L316 PolarHBondContact O-N 3.4Å; E314-L316 VanDerWaalsContact C-N 3.33Å; E314-L316 PolarHBondContact O-N 2.96Å; L316-S319 CarbonylContact O-C 3.48Å; L316-S319 PolarHBondContact O-N 3.04Å; L316-Q320 PolarHBondContact O-N 3.24Å; L316-N321 HydrophobicContact CD2-CB 3.94Å; L316-N321 PolarHBondContact O-N 2.85Å; L316-D324 HydrophobicContact CD2-CB 4.11Å; L316-L325 HydrophobicContact CB-CB 4.35Å; L316-L325 HydrophobicContact CD1-CB 4.33Å; L316-L325 HydrophobicContact CD1-CD1 4.38Å; L316-I328 HydrophobicContact CD1-CD1 3.46Å; L316-I328 VanDerWaalsContact CD1-CD1 3.46Å; L316-I328 HydrophobicContact CD1-CG1 4.17Å |
| 317 | V | 92.9 | Very high | 92.9 | Very high | 14 Ų | 14 | 51 Ų | 51 | 9% | 0.085 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -61.1 | -49 | 175.4 | 166.9 | 0 | 0 | 0 | 0 | 110.8 | I313 E314 S319 Q320 W322 L325 L352 L355 V357 | I313-V317 HydrophobicContact CG2-CG2 4Å; I313-V317 WeakPolarHBondContact O-CB 3.32Å; I313-V317 VanDerWaalsContact O-CG2 3.23Å; I313-V317 WeakPolarHBondContact O-CG2 3.49Å; I313-V317 PolarHBondContact O-N 3.47Å; E314-V317 PolarHBondContact O-N 2.89Å; V317-S319 PolarHBondContact O-N 3.14Å; V317-Q320 PolarHBondContact O-N 3.25Å; V317-W322 HydrophobicContact CB-CZ3 4.48Å; V317-W322 HydrophobicContact CG1-CH2 4.33Å; V317-W322 HydrophobicContact CG1-CZ3 4.5Å; V317-W322 HydrophobicContact CG2-CZ3 4.12Å; V317-L325 HydrophobicContact CG2-CD2 4.22Å; V317-L352 HydrophobicContact CG2-CD2 3.89Å; V317-L355 HydrophobicContact CB-CD1 4.37Å; V317-L355 HydrophobicContact CG1-CB 4.09Å; V317-L355 HydrophobicContact CG1-CD1 4.3Å; V317-L355 HydrophobicContact CG2-CD1 4.23Å; V317-V357 HydrophobicContact CB-CG2 4.42Å; V317-V357 HydrophobicContact CG1-CG2 3.54Å; V317-V357 HydrophobicContact CG2-CG2 3.93Å |
| 318 | Q | 88.3 | Confident | 92.9 | Very high | 51 Ų | 51 | 46.5 Ų | 46.5 | 24% | 0.238 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.4 | -30.8 | 178.5 | -73.5 | 178.7 | -3.7 | 0 | 0 | 112.5 | T261 E314 Q320 | T261-Q318 HydrophobicContact CG2-CB 3.89Å; T261-Q318 HydrophobicContact CG2-CG 4.02Å; E314-Q318 HydrophobicContact CG-CG 4.09Å; E314-Q318 VanDerWaalsContact O-CB 3.32Å; E314-Q318 WeakPolarHBondContact O-CB 3.28Å; E314-Q318 VanDerWaalsContact O-CG 3.26Å; E314-Q318 WeakPolarHBondContact O-CG 3.36Å; E314-Q318 PolarHBondContact O-N 3.25Å; E314-Q318 PolarHBondContact OE1-NE2 3.41Å; Q318-Q320 VanDerWaalsContact C-N 3.32Å |
| 319 | S | 88.2 | Confident | 92.9 | Very high | 50 Ų | 50 | 45.1 Ų | 45.1 | 35% | 0.35 | 22% | 0.217 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -87.6 | 0.3 | 175.9 | -49.8 | 0 | 0 | 0 | 0 | 113.2 | P315 L316 V317 N321 | P315-S319 WeakPolarHBondContact O-CB 3.34Å; P315-S319 PolarHBondContact O-N 3.15Å; P315-S319 PolarHBondContact O-OG 3.47Å; L316-S319 CarbonylContact O-C 3.48Å; L316-S319 PolarHBondContact O-N 3.04Å; V317-S319 PolarHBondContact O-N 3.14Å; S319-N321 PolarHBondContact O-N 3.4Å |
| 320 | Q | 91.3 | Very high | 92.9 | Very high | 144 Ų | 144 | 44.2 Ų | 44.2 | 67% | 0.673 | 21% | 0.214 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 51.4 | 31.9 | -172.9 | -56.6 | -177.7 | 29 | 0 | 0 | 113.6 | L316 V317 Q318 W322 | L316-Q320 PolarHBondContact O-N 3.24Å; V317-Q320 PolarHBondContact O-N 3.25Å; Q318-Q320 VanDerWaalsContact C-N 3.32Å; Q320-W322 VanDerWaalsContact C-N 3.29Å; Q320-W322 HydrophobicContact CB-CZ2 4.04Å; Q320-W322 HydrophobicContact CG-CZ2 4.08Å; Q320-W322 VanDerWaalsContact O-CD1 3.28Å; Q320-W322 PolarHBondContact O-N 3.26Å; Q320-W322 VanDerWaalsContact O-N 3.07Å; Q320-W322 PolarHBondContact O-NE1 3.4Å |
| 321 | N | 93.1 | Very high | 92.6 | Very high | 29 Ų | 29 | 46.4 Ų | 46.4 | 16% | 0.155 | 23% | 0.226 | C | C | . | . | trans | -88.3 | 68.2 | -177.6 | -165.3 | -7.8 | 0 | 0 | 0 | 110.7 | Q286 L316 S319 D323 D324 L325 | Q286-N321 PolarHBondContact O-ND2 3.4Å; L316-N321 HydrophobicContact CD2-CB 3.94Å; L316-N321 PolarHBondContact O-N 2.85Å; S319-N321 PolarHBondContact O-N 3.4Å; N321-D323 VanDerWaalsContact C-N 3.33Å; N321-D323 PolarHBondContact O-N 3.23Å; N321-D324 PolarHBondContact O-N 3.47Å; N321-D324 PolarHBondContact OD1-N 3.11Å; N321-L325 PolarHBondContact O-N 3.27Å | ||
| 322 | W | 94 | Very high | 92.3 | Very high | 57 Ų | 57 | 49.9 Ų | 49.9 | 22% | 0.216 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -65.2 | -34.7 | -174.4 | -48.9 | 117.6 | 0 | 0 | 0 | 113 | V317 Q320 L325 E326 V357 P358 I361 | V317-W322 HydrophobicContact CB-CZ3 4.48Å; V317-W322 HydrophobicContact CG1-CH2 4.33Å; V317-W322 HydrophobicContact CG1-CZ3 4.5Å; V317-W322 HydrophobicContact CG2-CZ3 4.12Å; Q320-W322 VanDerWaalsContact C-N 3.29Å; Q320-W322 HydrophobicContact CB-CZ2 4.04Å; Q320-W322 HydrophobicContact CG-CZ2 4.08Å; Q320-W322 VanDerWaalsContact O-CD1 3.28Å; Q320-W322 PolarHBondContact O-N 3.26Å; Q320-W322 VanDerWaalsContact O-N 3.07Å; Q320-W322 PolarHBondContact O-NE1 3.4Å; W322-L325 HydrophobicContact CE3-CD2 4.01Å; W322-L325 HydrophobicContact CZ3-CD2 4.27Å; W322-L325 PolarHBondContact O-N 3.12Å; W322-E326 WeakPolarHBondContact O-CB 3.27Å; W322-E326 PolarHBondContact O-N 3.04Å; W322-V357 HydrophobicContact CH2-CG1 3.97Å; W322-V357 HydrophobicContact CH2-CG2 4.29Å; W322-V357 HydrophobicContact CZ3-CG1 3.87Å; W322-V357 HydrophobicContact CZ3-CG2 4.28Å; W322-P358 HydrophobicContact CZ2-CG 4.35Å; W322-I361 HydrophobicContact CB-CD1 4.42Å; W322-I361 HydrophobicContact CD2-CD1 4.09Å; W322-I361 HydrophobicContact CD2-CG1 4.09Å; W322-I361 HydrophobicContact CD2-CG2 4.42Å; W322-I361 HydrophobicContact CE3-CG1 4.27Å; W322-I361 HydrophobicContact CE3-CG2 3.87Å; W322-I361 HydrophobicContact CG-CD1 3.98Å; W322-I361 HydrophobicContact CZ3-CG2 4.19Å |
| 323 | D | 93.6 | Very high | 91.6 | Very high | 123 Ų | 123 | 55 Ų | 55 | 66% | 0.658 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -62.4 | -45.3 | 179.7 | -69.9 | -16.1 | 0 | 0 | 0 | 111.1 | N321 E326 F327 | N321-D323 VanDerWaalsContact C-N 3.33Å; N321-D323 PolarHBondContact O-N 3.23Å; D323-E326 PolarHBondContact O-N 3.08Å; D323-F327 WeakPolarHBondContact O-CB 3.33Å; D323-F327 PolarHBondContact O-N 3.18Å |
| 324 | D | 94 | Very high | 90.6 | Very high | 5 Ų | 5 | 60.1 Ų | 60.1 | 3% | 0.027 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -76.8 | -30.6 | 179.1 | -85.2 | 28.1 | 0 | 0 | 0 | 112.1 | S287 V288 K289 L316 N321 F327 I328 | S287-D324 VanDerWaalsContact C-OD2 3.3Å; S287-D324 WeakPolarHBondContact CA-OD2 3.4Å; S287-D324 VanDerWaalsContact CB-OD2 3.32Å; S287-D324 WeakPolarHBondContact CB-OD2 3.41Å; S287-D324 PolarHBondContact OG-OD2 3.45Å; V288-D324 HydrophobicContact CG2-CB 3.85Å; V288-D324 PolarHBondContact N-OD2 2.96Å; K289-D324 WeakPolarHBondContact CE-OD1 3.22Å; K289-D324 IonicContact NZ-OD1 3.73Å; L316-D324 HydrophobicContact CD2-CB 4.11Å; N321-D324 PolarHBondContact O-N 3.47Å; N321-D324 PolarHBondContact OD1-N 3.11Å; D324-F327 PolarHBondContact O-N 3.31Å; D324-I328 WeakPolarHBondContact O-CG1 3.35Å; D324-I328 WeakPolarHBondContact O-CG2 3.4Å; D324-I328 PolarHBondContact O-N 2.98Å |
| 325 | L | 95 | Very high | 89.7 | Confident | 0 Ų | 0 | 64.8 Ų | 64.8 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -59.7 | -46.7 | 168.7 | -178 | 66.6 | 0 | 0 | 0 | 110.8 | I313 L316 V317 N321 W322 I328 M329 F348 L352 | I313-L325 HydrophobicContact CG1-CD1 4.28Å; L316-L325 HydrophobicContact CB-CB 4.35Å; L316-L325 HydrophobicContact CD1-CB 4.33Å; L316-L325 HydrophobicContact CD1-CD1 4.38Å; V317-L325 HydrophobicContact CG2-CD2 4.22Å; N321-L325 PolarHBondContact O-N 3.27Å; W322-L325 HydrophobicContact CE3-CD2 4.01Å; W322-L325 HydrophobicContact CZ3-CD2 4.27Å; W322-L325 PolarHBondContact O-N 3.12Å; L325-I328 WeakPolarHBondContact O-CG1 3.48Å; L325-I328 PolarHBondContact O-N 3.3Å; L325-M329 HydrophobicContact CD1-CE 4.29Å; L325-M329 HydrophobicContact CD1-CG 4.06Å; L325-M329 HydrophobicContact CG-CG 4.46Å; L325-M329 VanDerWaalsContact O-CB 3.28Å; L325-M329 WeakPolarHBondContact O-CB 3.15Å; L325-M329 WeakPolarHBondContact O-CG 3.34Å; L325-M329 PolarHBondContact O-N 3.14Å; L325-M329 VanDerWaalsContact O-N 3.09Å; L325-F348 HydrophobicContact CD1-CE2 4.36Å; L325-F348 HydrophobicContact CD1-CZ 4.34Å; L325-F348 HydrophobicContact CD2-CZ 4.49Å; L325-F348 HydrophobicContact CG-CZ 4.46Å; L325-L352 HydrophobicContact CD2-CD2 4.13Å |
| 326 | E | 93.7 | Very high | 88.9 | Confident | 82 Ų | 82 | 66.1 Ų | 66.1 | 38% | 0.383 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62.5 | -43.6 | 175.6 | -169.8 | 175 | -154.1 | 0 | 0 | 111.4 | W322 D323 I328 M329 L330 | W322-E326 WeakPolarHBondContact O-CB 3.27Å; W322-E326 PolarHBondContact O-N 3.04Å; D323-E326 PolarHBondContact O-N 3.08Å; E326-I328 PolarHBondContact O-N 3.11Å; E326-M329 PolarHBondContact O-N 3.28Å; E326-L330 HydrophobicContact CG-CD1 3.36Å; E326-L330 HydrophobicContact CG-CG 3.86Å; E326-L330 VanDerWaalsContact O-CB 3.31Å; E326-L330 WeakPolarHBondContact O-CB 3.48Å; E326-L330 WeakPolarHBondContact O-CG 3.3Å; E326-L330 PolarHBondContact O-N 3.06Å; E326-L330 VanDerWaalsContact OE1-CD1 3.29Å; E326-L330 WeakPolarHBondContact OE1-CD1 3.35Å |
| 327 | F | 92.2 | Very high | 88 | Confident | 106 Ų | 106 | 77.5 Ų | 77.5 | 47% | 0.465 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -58.6 | -45 | 178.2 | 174.5 | -98.6 | 0 | 0 | 0 | 113.1 | K289 D323 D324 | K289-F327 HydrophobicContact CB-CE1 4.47Å; K289-F327 HydrophobicContact CG-CD1 4.26Å; K289-F327 HydrophobicContact CG-CE1 4.16Å; K289-F327 HydrophobicContact CG-CZ 4.45Å; D323-F327 WeakPolarHBondContact O-CB 3.33Å; D323-F327 PolarHBondContact O-N 3.18Å; D324-F327 PolarHBondContact O-N 3.31Å |
| 328 | I | 92.9 | Very high | 87.4 | Confident | 16 Ų | 16 | 86.2 Ų | 86.2 | 8% | 0.082 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -77.4 | -29.8 | -178.2 | 66.1 | 167.9 | 0 | 0 | 0 | 112.8 | V288 R309 L312 L316 D324 L325 E326 | V288-I328 HydrophobicContact CG2-CG2 3.6Å; R309-I328 VanDerWaalsContact CD-O 3.23Å; R309-I328 WeakPolarHBondContact CD-O 3.48Å; R309-I328 PolarHBondContact NE-O 2.88Å; L312-I328 HydrophobicContact CB-CD1 3.71Å; L312-I328 HydrophobicContact CD1-CD1 4.18Å; L316-I328 HydrophobicContact CD1-CD1 3.46Å; L316-I328 VanDerWaalsContact CD1-CD1 3.46Å; L316-I328 HydrophobicContact CD1-CG1 4.17Å; D324-I328 WeakPolarHBondContact O-CG1 3.35Å; D324-I328 WeakPolarHBondContact O-CG2 3.4Å; D324-I328 PolarHBondContact O-N 2.98Å; L325-I328 WeakPolarHBondContact O-CG1 3.48Å; L325-I328 PolarHBondContact O-N 3.3Å; E326-I328 PolarHBondContact O-N 3.11Å |
| 329 | M | 94.3 | Very high | 87.4 | Confident | 0 Ų | 0 | 87.4 Ų | 87.4 | 0% | 0 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -86.1 | -31.7 | -175.6 | -68.2 | -60 | 144.6 | 0 | 0 | 113.1 | R309 I313 L325 E326 V341 T342 I343 F348 | R309-M329 HydrophobicContact CB-CE 3.56Å; R309-M329 HydrophobicContact CB-SD 4.25Å; R309-M329 HydrophobicContact CG-CE 4.09Å; R309-M329 WeakPolarHBondContact O-CE 3.46Å; I313-M329 HydrophobicContact CD1-CE 3.98Å; I313-M329 HydrophobicContact CG1-CE 3.48Å; I313-M329 VanDerWaalsContact CG1-CE 3.48Å; L325-M329 HydrophobicContact CD1-CE 4.29Å; L325-M329 HydrophobicContact CD1-CG 4.06Å; L325-M329 HydrophobicContact CG-CG 4.46Å; L325-M329 VanDerWaalsContact O-CB 3.28Å; L325-M329 WeakPolarHBondContact O-CB 3.15Å; L325-M329 WeakPolarHBondContact O-CG 3.34Å; L325-M329 PolarHBondContact O-N 3.14Å; L325-M329 VanDerWaalsContact O-N 3.09Å; E326-M329 PolarHBondContact O-N 3.28Å; M329-V341 WeakPolarHBondContact O-CA 3.31Å; M329-T342 PolarHBondContact O-N 3.39Å; M329-T342 PolarHBondContact O-OG1 3.03Å; M329-T342 VanDerWaalsContact O-OG1 3.07Å; M329-I343 HydrophobicContact CE-CD1 4.27Å; M329-I343 HydrophobicContact SD-CD1 3.46Å; M329-I343 WeakPolarHBondContact SD-CD1 3.42Å; M329-I343 HydrophobicContact SD-CG1 3.96Å; M329-F348 HydrophobicContact CB-CZ 4.44Å; M329-F348 HydrophobicContact CG-CE1 4.23Å; M329-F348 HydrophobicContact CG-CE2 4.08Å; M329-F348 HydrophobicContact CG-CZ 3.71Å; M329-F348 HydrophobicContact SD-CD2 4.39Å; M329-F348 HydrophobicContact SD-CE2 4.06Å; M329-F348 HydrophobicContact SD-CZ 4.23Å |
| 330 | L | 93 | Very high | 87.5 | Confident | 17 Ų | 17 | 88.3 Ų | 88.3 | 9% | 0.089 | 41% | 0.412 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.4 | 126 | -175.8 | -59.9 | -170.2 | 0 | 0 | 0 | 111.9 | E326 M339 E340 V341 Y365 Y368 | E326-L330 HydrophobicContact CG-CD1 3.36Å; E326-L330 HydrophobicContact CG-CG 3.86Å; E326-L330 VanDerWaalsContact O-CB 3.31Å; E326-L330 WeakPolarHBondContact O-CB 3.48Å; E326-L330 WeakPolarHBondContact O-CG 3.3Å; E326-L330 PolarHBondContact O-N 3.06Å; E326-L330 VanDerWaalsContact OE1-CD1 3.29Å; E326-L330 WeakPolarHBondContact OE1-CD1 3.35Å; L330-M339 HydrophobicContact CB-CB 4.48Å; L330-M339 HydrophobicContact CB-CE 3.56Å; L330-M339 HydrophobicContact CD1-CB 4.45Å; L330-E340 WeakPolarHBondContact CA-O 3.38Å; L330-V341 HydrophobicContact CD2-CG2 3.68Å; L330-Y365 HydrophobicContact CD2-CD1 4.4Å; L330-Y365 HydrophobicContact CD2-CE1 4.2Å; L330-Y365 HydrophobicContact CG-CE1 4.43Å; L330-Y368 HydrophobicContact CD1-CE2 3.95Å; L330-Y368 WeakPolarHBondContact CD1-OH 3.42Å; L330-Y368 HydrophobicContact CD2-CD2 3.98Å; L330-Y368 HydrophobicContact CD2-CE1 4.42Å; L330-Y368 HydrophobicContact CD2-CE2 3.57Å; L330-Y368 HydrophobicContact CG-CE2 4.43Å |
| 331 | K | 88.3 | Confident | 87.4 | Confident | 120 Ų | 120 | 82.2 Ų | 82.2 | 52% | 0.522 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.6 | 146.9 | 170.1 | -171 | 171.8 | -179.8 | 177.5 | 0 | 110.1 | K333 M339 E340 T342 | K331-K333 PolarHBondContact O-N 3.15Å; K331-M339 CarbonylContact O-C 3.56Å; K331-M339 WeakPolarHBondContact O-CA 3.36Å; K331-E340 PolarHBondContact N-O 3.01Å; K331-E340 PolarHBondContact O-N 2.88Å; K331-T342 HydrophobicContact CB-CG2 3.33Å; K331-T342 HydrophobicContact CD-CG2 4.19Å; K331-T342 HydrophobicContact CG-CG2 4.42Å |
| 332 | K | 85.4 | Confident | 87.2 | Confident | 135 Ų | 135 | 82.5 Ų | 82.5 | 59% | 0.587 | 39% | 0.387 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -69.2 | 120.9 | 170 | -174.9 | 178.7 | 178.2 | -178.3 | 0 | 108.9 | S334 S336 M339 | K332-S334 PolarHBondContact O-N 2.84Å; K332-S336 WeakPolarHBondContact CE-O 3.39Å; K332-S336 WeakPolarHBondContact CG-O 3.45Å; K332-M339 HydrophobicContact CB-SD 4.09Å |
| 333 | K | 80.8 | Confident | 87.1 | Confident | 108 Ų | 108 | 80.1 Ų | 80.1 | 47% | 0.47 | 38% | 0.378 | S | S | . | . | P | Polyproline II helix | trans | -61.3 | 131.7 | 175.6 | -177.2 | 170.6 | -162.8 | 148.8 | 0 | 109.8 | K331 L335 S336 R338 E340 | K331-K333 PolarHBondContact O-N 3.15Å; K333-L335 PolarHBondContact O-N 3.13Å; K333-S336 PolarHBondContact O-N 3.01Å; K333-R338 PolarHBondContact N-O 3.19Å; K333-E340 HydrophobicContact CB-CG 4.27Å; K333-E340 VanDerWaalsContact CD-OE2 3.26Å; K333-E340 WeakPolarHBondContact CD-OE2 3.35Å; K333-E340 WeakPolarHBondContact CG-OE2 3.36Å; K333-E340 IonicContact NZ-OE2 3.17Å |
| 334 | S | 72.6 | Confident | 86.9 | Confident | 106 Ų | 106 | 76.5 Ų | 76.5 | 74% | 0.741 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.3 | 131.6 | 179.9 | -171.1 | 0 | 0 | 0 | 0 | 110.3 | K332 S336 | K332-S334 PolarHBondContact O-N 2.84Å; S334-S336 PolarHBondContact O-N 2.98Å |
| 335 | L | 73.9 | Confident | 86.8 | Confident | 188 Ų | 188 | 77.3 Ų | 77.3 | 98% | 0.984 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.4 | 4.4 | -176 | -56.5 | 166.3 | 0 | 0 | 0 | 116.8 | K333 | K333-L335 PolarHBondContact O-N 3.13Š|
| 336 | S | 74.6 | Confident | 86.4 | Confident | 35 Ų | 35 | 79.3 Ų | 79.3 | 25% | 0.245 | 38% | 0.378 | C | S | . | . | S | Bend | trans | -115.8 | 156.7 | 178 | -173.5 | 0 | 0 | 0 | 0 | 112.1 | K332 K333 S334 R338 | K332-S336 WeakPolarHBondContact CE-O 3.39Å; K332-S336 WeakPolarHBondContact CG-O 3.45Å; K333-S336 PolarHBondContact O-N 3.01Å; S334-S336 PolarHBondContact O-N 2.98Å; S336-R338 VanDerWaalsContact C-N 3.26Å; S336-R338 WeakPolarHBondContact OG-CB 3.36Å; S336-R338 WeakPolarHBondContact OG-CG 3.42Å; S336-R338 PolarHBondContact OG-N 3.26Å |
| 337 | R | 76 | Confident | 86.2 | Confident | 241 Ų | 241 | 81.8 Ų | 81.8 | 91% | 0.909 | 38% | 0.384 | S | S | * | . | S | Bend | trans | -83.1 | -6 | 164.8 | -66.1 | -174.5 | -174.4 | 178.3 | 1.5 | 112.3 | ||
| 338 | R | 80.8 | Confident | 86.3 | Confident | 197 Ų | 197 | 76.8 Ų | 76.8 | 74% | 0.743 | 36% | 0.362 | S | S | * | . | trans | -81.7 | 139.3 | -178.2 | -60.4 | -177.1 | -175.5 | 179.4 | 0.8 | 110.4 | K333 S336 | K333-R338 PolarHBondContact N-O 3.19Å; S336-R338 VanDerWaalsContact C-N 3.26Å; S336-R338 WeakPolarHBondContact OG-CB 3.36Å; S336-R338 WeakPolarHBondContact OG-CG 3.42Å; S336-R338 PolarHBondContact OG-N 3.26Å | ||
| 339 | M | 88.2 | Confident | 86.3 | Confident | 77 Ų | 77 | 76 Ų | 76 | 38% | 0.379 | 36% | 0.358 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.6 | 151.8 | 166.1 | -57.2 | -61.3 | -71.6 | 0 | 0 | 109 | L330 K331 K332 Y368 | L330-M339 HydrophobicContact CB-CB 4.48Å; L330-M339 HydrophobicContact CB-CE 3.56Å; L330-M339 HydrophobicContact CD1-CB 4.45Å; K331-M339 CarbonylContact O-C 3.56Å; K331-M339 WeakPolarHBondContact O-CA 3.36Å; K332-M339 HydrophobicContact CB-SD 4.09Å; M339-Y368 HydrophobicContact CB-CE1 3.91Å |
| 340 | E | 89.2 | Confident | 86.1 | Confident | 69 Ų | 69 | 78.5 Ų | 78.5 | 32% | 0.322 | 37% | 0.371 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.9 | 149.8 | 170.8 | 67.8 | -167 | 169 | 0 | 0 | 109.4 | L330 K331 K333 | L330-E340 WeakPolarHBondContact CA-O 3.38Å; K331-E340 PolarHBondContact N-O 3.01Å; K331-E340 PolarHBondContact O-N 2.88Å; K333-E340 HydrophobicContact CB-CG 4.27Å; K333-E340 VanDerWaalsContact CD-OE2 3.26Å; K333-E340 WeakPolarHBondContact CD-OE2 3.35Å; K333-E340 WeakPolarHBondContact CG-OE2 3.36Å; K333-E340 IonicContact NZ-OE2 3.17Å |
| 341 | V | 90.8 | Very high | 86.1 | Confident | 15 Ų | 15 | 80.3 Ų | 80.3 | 9% | 0.091 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.6 | 131.5 | 171 | 179.8 | 0 | 0 | 0 | 0 | 107.8 | M329 L330 I343 T345 F348 Y365 Y368 | M329-V341 WeakPolarHBondContact O-CA 3.31Å; L330-V341 HydrophobicContact CD2-CG2 3.68Å; V341-I343 VanDerWaalsContact C-N 3.3Å; V341-I343 HydrophobicContact CG1-CG1 3.87Å; V341-I343 PolarHBondContact O-N 2.93Å; V341-T345 HydrophobicContact CB-CG2 4.43Å; V341-T345 HydrophobicContact CG2-CG2 4.2Å; V341-F348 HydrophobicContact CG1-CD1 4.09Å; V341-Y365 HydrophobicContact CG2-CD1 4.22Å; V341-Y368 HydrophobicContact CG2-CD2 3.7Å; V341-Y368 HydrophobicContact CG2-CG 3.89Å |
| 342 | T | 88.5 | Confident | 86.4 | Confident | 35 Ų | 35 | 74.6 Ų | 74.6 | 22% | 0.215 | 35% | 0.354 | C | S | . | . | S | Bend | trans | -86.1 | 2.3 | -171.8 | 51.3 | 0 | 0 | 0 | 0 | 115.1 | R309 M329 K331 | R309-T342 WeakPolarHBondContact CD-OG1 3.16Å; R309-T342 PolarHBondContact NE-OG1 3.05Å; M329-T342 PolarHBondContact O-N 3.39Å; M329-T342 PolarHBondContact O-OG1 3.03Å; M329-T342 VanDerWaalsContact O-OG1 3.07Å; K331-T342 HydrophobicContact CB-CG2 3.33Å; K331-T342 HydrophobicContact CD-CG2 4.19Å; K331-T342 HydrophobicContact CG-CG2 4.42Å |
| 343 | I | 90.6 | Very high | 86.7 | Confident | 7 Ų | 7 | 71.2 Ų | 71.2 | 4% | 0.036 | 34% | 0.342 | C | S | . | . | S | Bend | trans | -129.6 | 162.8 | 176.7 | 60.1 | 174.3 | 0 | 0 | 0 | 108.5 | E306 R309 W310 I313 M329 V341 T345 F348 | E306-I343 HydrophobicContact CG-CG2 4.02Å; R309-I343 HydrophobicContact CB-CG2 4.16Å; W310-I343 HydrophobicContact CD2-CD1 4.2Å; W310-I343 HydrophobicContact CE3-CD1 4.5Å; W310-I343 HydrophobicContact CH2-CD1 4.11Å; W310-I343 HydrophobicContact CZ2-CB 4.32Å; W310-I343 HydrophobicContact CZ2-CD1 3.8Å; W310-I343 HydrophobicContact CZ2-CG1 4.41Å; W310-I343 HydrophobicContact CZ3-CD1 4.45Å; I313-I343 HydrophobicContact CD1-CD1 4.04Å; M329-I343 HydrophobicContact CE-CD1 4.27Å; M329-I343 HydrophobicContact SD-CD1 3.46Å; M329-I343 WeakPolarHBondContact SD-CD1 3.42Å; M329-I343 HydrophobicContact SD-CG1 3.96Å; V341-I343 VanDerWaalsContact C-N 3.3Å; V341-I343 HydrophobicContact CG1-CG1 3.87Å; V341-I343 PolarHBondContact O-N 2.93Å; I343-T345 PolarHBondContact O-N 3.19Å; I343-F348 HydrophobicContact CD1-CB 3.76Å; I343-F348 HydrophobicContact CD1-CD2 3.72Å; I343-F348 HydrophobicContact CD1-CG 3.83Å; I343-F348 HydrophobicContact CG1-CB 4.02Å; I343-F348 HydrophobicContact CG1-CG 4.29Å |
| 344 | P | 90 | Very high | 87.2 | Confident | 48 Ų | 48 | 69.7 Ų | 69.7 | 31% | 0.312 | 35% | 0.345 | S | S | . | . | trans | -51.2 | 113.4 | 177 | -28.1 | 36.2 | 0 | 0 | 0 | 111.5 | D346 R347 F348 | P344-D346 VanDerWaalsContact C-N 3.34Å; P344-D346 WeakPolarHBondContact CB-OD1 3.17Å; P344-D346 PolarHBondContact O-N 3.12Å; P344-R347 HydrophobicContact CB-CB 4.31Å; P344-R347 HydrophobicContact CB-CG 4.22Å; P344-R347 PolarHBondContact O-N 3.19Å; P344-F348 WeakPolarHBondContact O-CB 3.37Å; P344-F348 PolarHBondContact O-N 3.28Å | ||
| 345 | T | 91.3 | Very high | 88.1 | Confident | 22 Ų | 22 | 66.6 Ų | 66.6 | 14% | 0.135 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -69.2 | -35.4 | -164.3 | -57.3 | 0 | 0 | 0 | 0 | 111.6 | V341 I343 I349 I369 | V341-T345 HydrophobicContact CB-CG2 4.43Å; V341-T345 HydrophobicContact CG2-CG2 4.2Å; I343-T345 PolarHBondContact O-N 3.19Å; T345-I349 HydrophobicContact CG2-CD1 3.76Å; T345-I349 WeakPolarHBondContact O-CB 3.37Å; T345-I349 WeakPolarHBondContact O-CD1 3.39Å; T345-I349 VanDerWaalsContact O-CG1 3.26Å; T345-I349 WeakPolarHBondContact O-CG1 3.44Å; T345-I349 PolarHBondContact O-N 2.97Å; T345-I369 HydrophobicContact CG2-CG1 3.66Å |
| 346 | D | 88.2 | Confident | 88.8 | Confident | 42 Ų | 42 | 64.9 Ų | 64.9 | 23% | 0.225 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -58.1 | -54.5 | 172.9 | 62.6 | -36.9 | 0 | 0 | 0 | 112.7 | P344 F348 I349 L350 E374 I378 | P344-D346 VanDerWaalsContact C-N 3.34Å; P344-D346 WeakPolarHBondContact CB-OD1 3.17Å; P344-D346 PolarHBondContact O-N 3.12Å; D346-F348 VanDerWaalsContact C-N 3.3Å; D346-F348 PolarHBondContact O-N 3.34Å; D346-I349 PolarHBondContact O-N 3.27Å; D346-L350 WeakPolarHBondContact O-CB 3.47Å; D346-L350 WeakPolarHBondContact O-CG 3.16Å; D346-L350 PolarHBondContact O-N 3.21Å; D346-E374 HydrophobicContact CB-CG 4.22Å; D346-E374 WeakPolarHBondContact CB-OE1 3.47Å; D346-E374 VanDerWaalsContact CG-OE1 3.29Å; D346-I378 HydrophobicContact CB-CD1 3.51Å; D346-I378 HydrophobicContact CB-CG1 4.27Å |
| 347 | R | 89.7 | Confident | 89.7 | Confident | 134 Ų | 134 | 63.6 Ų | 63.6 | 51% | 0.506 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -63.4 | -41.5 | -179.5 | -62.9 | -173.4 | -177.8 | -174.4 | -1.6 | 110.4 | W310 P344 L350 H351 | W310-R347 HydrophobicContact CH2-CB 3.9Å; W310-R347 HydrophobicContact CZ2-CB 4.19Å; P344-R347 HydrophobicContact CB-CB 4.31Å; P344-R347 HydrophobicContact CB-CG 4.22Å; P344-R347 PolarHBondContact O-N 3.19Å; R347-L350 PolarHBondContact O-N 3.24Å; R347-H351 VanDerWaalsContact O-CB 3.23Å; R347-H351 WeakPolarHBondContact O-CB 3.49Å; R347-H351 PolarHBondContact O-N 3.03Å |
| 348 | F | 93.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -59.3 | -49.1 | 177.1 | 174.7 | -126.2 | 0 | 0 | 0 | 111.5 | W310 I313 L325 M329 V341 I343 P344 D346 H351 L352 Y365 | W310-F348 HydrophobicContact CH2-CB 4.35Å; I313-F348 HydrophobicContact CD1-CD2 3.71Å; I313-F348 HydrophobicContact CD1-CE2 3.84Å; I313-F348 HydrophobicContact CG1-CD2 4.41Å; I313-F348 HydrophobicContact CG1-CE2 4.04Å; I313-F348 HydrophobicContact CG2-CE2 4.39Å; L325-F348 HydrophobicContact CD1-CE2 4.36Å; L325-F348 HydrophobicContact CD1-CZ 4.34Å; L325-F348 HydrophobicContact CD2-CZ 4.49Å; L325-F348 HydrophobicContact CG-CZ 4.46Å; M329-F348 HydrophobicContact CB-CZ 4.44Å; M329-F348 HydrophobicContact CG-CE1 4.23Å; M329-F348 HydrophobicContact CG-CE2 4.08Å; M329-F348 HydrophobicContact CG-CZ 3.71Å; M329-F348 HydrophobicContact SD-CD2 4.39Å; M329-F348 HydrophobicContact SD-CE2 4.06Å; M329-F348 HydrophobicContact SD-CZ 4.23Å; V341-F348 HydrophobicContact CG1-CD1 4.09Å; I343-F348 HydrophobicContact CD1-CB 3.76Å; I343-F348 HydrophobicContact CD1-CD2 3.72Å; I343-F348 HydrophobicContact CD1-CG 3.83Å; I343-F348 HydrophobicContact CG1-CB 4.02Å; I343-F348 HydrophobicContact CG1-CG 4.29Å; P344-F348 WeakPolarHBondContact O-CB 3.37Å; P344-F348 PolarHBondContact O-N 3.28Å; D346-F348 VanDerWaalsContact C-N 3.3Å; D346-F348 PolarHBondContact O-N 3.34Å; F348-H351 PolarHBondContact O-N 3.47Å; F348-L352 HydrophobicContact CD1-CD1 4.39Å; F348-L352 HydrophobicContact CD2-CD2 4.48Å; F348-L352 HydrophobicContact CD2-CG 4.18Å; F348-L352 HydrophobicContact CE1-CD1 3.8Å; F348-L352 HydrophobicContact CE1-CG 4.46Å; F348-L352 HydrophobicContact CE2-CD1 3.95Å; F348-L352 HydrophobicContact CE2-CD2 3.72Å; F348-L352 HydrophobicContact CE2-CG 3.77Å; F348-L352 HydrophobicContact CZ-CD1 3.55Å; F348-L352 HydrophobicContact CZ-CD2 4.01Å; F348-L352 HydrophobicContact CZ-CG 3.93Å; F348-L352 WeakPolarHBondContact O-CG 3.47Å; F348-L352 PolarHBondContact O-N 2.99Å; F348-Y365 AromaticContact CE1-CD1 3.73Å; F348-Y365 HydrophobicContact CE1-CD1 3.73Å; F348-Y365 AromaticContact CE1-CD2 3.95Å; F348-Y365 HydrophobicContact CE1-CD2 3.95Å; F348-Y365 AromaticContact CE1-CE1 3.81Å; F348-Y365 HydrophobicContact CE1-CE1 3.81Å; F348-Y365 HydrophobicContact CE1-CE2 4.02Å; F348-Y365 AromaticContact CE1-CG 3.8Å; F348-Y365 HydrophobicContact CE1-CG 3.8Å; F348-Y365 AromaticContact CE1-CZ 3.95Å; F348-Y365 HydrophobicContact CZ-CD2 4.5Å; F348-Y365 HydrophobicContact CZ-CE1 4.36Å; F348-Y365 HydrophobicContact CZ-CE2 4.19Å |
| 349 | I | 93.2 | Very high | 91 | Very high | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -65 | -43.7 | -179.4 | -76 | 168.3 | 0 | 0 | 0 | 111.9 | T345 D346 H351 L352 N353 I362 L366 I369 I378 L382 | T345-I349 HydrophobicContact CG2-CD1 3.76Å; T345-I349 WeakPolarHBondContact O-CB 3.37Å; T345-I349 WeakPolarHBondContact O-CD1 3.39Å; T345-I349 VanDerWaalsContact O-CG1 3.26Å; T345-I349 WeakPolarHBondContact O-CG1 3.44Å; T345-I349 PolarHBondContact O-N 2.97Å; D346-I349 PolarHBondContact O-N 3.27Å; I349-H351 VanDerWaalsContact C-N 3.28Å; I349-H351 PolarHBondContact O-N 2.98Å; I349-L352 PolarHBondContact O-N 3.01Å; I349-N353 PolarHBondContact O-N 2.8Å; I349-I362 HydrophobicContact CG2-CG2 3.85Å; I349-L366 HydrophobicContact CD1-CD2 4.09Å; I349-L366 HydrophobicContact CG2-CD2 4.34Å; I349-I369 HydrophobicContact CD1-CD1 3.73Å; I349-I369 HydrophobicContact CD1-CG1 4.02Å; I349-I378 HydrophobicContact CG2-CG2 3.61Å; I349-L382 HydrophobicContact CG2-CD1 3.49Å; I349-L382 VanDerWaalsContact CG2-CD1 3.49Å |
| 350 | L | 90.3 | Very high | 91.1 | Very high | 52 Ų | 52 | 51.6 Ų | 51.6 | 27% | 0.272 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -62.9 | -37.8 | 175.3 | -69 | 173.2 | 0 | 0 | 0 | 111.4 | D346 R347 N353 S354 R381 L382 | D346-L350 WeakPolarHBondContact O-CB 3.47Å; D346-L350 WeakPolarHBondContact O-CG 3.16Å; D346-L350 PolarHBondContact O-N 3.21Å; R347-L350 PolarHBondContact O-N 3.24Å; L350-N353 PolarHBondContact O-N 2.89Å; L350-S354 PolarHBondContact O-N 2.98Å; L350-R381 HydrophobicContact CD2-CB 4.47Å; L350-L382 HydrophobicContact CD2-CD2 4.07Å; L350-L382 HydrophobicContact CD2-CG 4.48Å |
| 351 | H | 92.6 | Very high | 91.4 | Very high | 55 Ų | 55 | 49.5 Ų | 49.5 | 26% | 0.255 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -67.1 | -44.1 | 175.6 | -173.7 | 43.9 | 0 | 0 | 0 | 112.1 | W310 R347 F348 I349 N353 S354 L355 | W310-H351 HydrophobicContact CZ3-CB 4.12Å; W310-H351 AromaticContact CZ3-CD2 3.77Å; R347-H351 VanDerWaalsContact O-CB 3.23Å; R347-H351 WeakPolarHBondContact O-CB 3.49Å; R347-H351 PolarHBondContact O-N 3.03Å; F348-H351 PolarHBondContact O-N 3.47Å; I349-H351 VanDerWaalsContact C-N 3.28Å; I349-H351 PolarHBondContact O-N 2.98Å; H351-N353 VanDerWaalsContact C-N 3.27Å; H351-N353 PolarHBondContact O-N 3.48Å; H351-S354 WeakPolarHBondContact CA-OG 3.15Å; H351-S354 PolarHBondContact ND1-OG 3.42Å; H351-S354 WeakPolarHBondContact O-CA 3.4Å; H351-S354 WeakPolarHBondContact O-CB 3.49Å; H351-S354 PolarHBondContact O-N 3.31Å; H351-S354 PolarHBondContact O-OG 3.29Å; H351-L355 WeakPolarHBondContact O-CG 3.34Å; H351-L355 PolarHBondContact O-N 3.25Å; H351-L355 VanDerWaalsContact O-N 3.11Å |
| 352 | L | 94.4 | Very high | 91.5 | Very high | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -56.6 | -43.4 | 173 | -69.2 | -178.1 | 0 | 0 | 0 | 111.6 | I313 V317 L325 F348 I349 S354 L355 V357 I362 Y365 | I313-L352 HydrophobicContact CG2-CD2 3.99Å; V317-L352 HydrophobicContact CG2-CD2 3.89Å; L325-L352 HydrophobicContact CD2-CD2 4.13Å; F348-L352 HydrophobicContact CD1-CD1 4.39Å; F348-L352 HydrophobicContact CD2-CD2 4.48Å; F348-L352 HydrophobicContact CD2-CG 4.18Å; F348-L352 HydrophobicContact CE1-CD1 3.8Å; F348-L352 HydrophobicContact CE1-CG 4.46Å; F348-L352 HydrophobicContact CE2-CD1 3.95Å; F348-L352 HydrophobicContact CE2-CD2 3.72Å; F348-L352 HydrophobicContact CE2-CG 3.77Å; F348-L352 HydrophobicContact CZ-CD1 3.55Å; F348-L352 HydrophobicContact CZ-CD2 4.01Å; F348-L352 HydrophobicContact CZ-CG 3.93Å; F348-L352 WeakPolarHBondContact O-CG 3.47Å; F348-L352 PolarHBondContact O-N 2.99Å; I349-L352 PolarHBondContact O-N 3.01Å; L352-S354 VanDerWaalsContact C-N 3.31Å; L352-S354 PolarHBondContact O-N 3.14Å; L352-L355 PolarHBondContact O-N 3.03Å; L352-L355 VanDerWaalsContact O-N 3.14Å; L352-V357 HydrophobicContact CB-CB 4.12Å; L352-V357 HydrophobicContact CB-CG1 4.44Å; L352-V357 HydrophobicContact CB-CG2 4.01Å; L352-V357 HydrophobicContact CD2-CG2 3.97Å; L352-V357 VanDerWaalsContact O-CB 3.27Å; L352-V357 WeakPolarHBondContact O-CB 3.17Å; L352-V357 WeakPolarHBondContact O-CG2 3.39Å; L352-V357 PolarHBondContact O-N 2.76Å; L352-I362 HydrophobicContact CB-CG1 4.14Å; L352-Y365 HydrophobicContact CD1-CD2 3.83Å; L352-Y365 HydrophobicContact CD1-CE2 4Å |
| 353 | N | 92.4 | Very high | 91.7 | Very high | 64 Ų | 64 | 50.4 Ų | 50.4 | 34% | 0.342 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -63.2 | -37.4 | 175.7 | -175 | 78.3 | 0 | 0 | 0 | 112.4 | I349 L350 H351 L355 D356 I362 L382 | I349-N353 PolarHBondContact O-N 2.8Å; L350-N353 PolarHBondContact O-N 2.89Å; H351-N353 VanDerWaalsContact C-N 3.27Å; H351-N353 PolarHBondContact O-N 3.48Å; N353-L355 PolarHBondContact O-N 3.01Å; N353-D356 PolarHBondContact O-N 3.43Å; N353-I362 HydrophobicContact CB-CD1 3.97Å; N353-L382 HydrophobicContact CB-CD2 3.43Å; N353-L382 VanDerWaalsContact CB-CD2 3.43Å; N353-L382 WeakPolarHBondContact ND2-CD2 3.29Å |
| 354 | S | 90.9 | Very high | 91.7 | Very high | 76 Ų | 76 | 52 Ų | 52 | 53% | 0.531 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -66.2 | -20.7 | 175.6 | 75.7 | 0 | 0 | 0 | 0 | 113.8 | L350 H351 L352 D356 | L350-S354 PolarHBondContact O-N 2.98Å; H351-S354 WeakPolarHBondContact CA-OG 3.15Å; H351-S354 PolarHBondContact ND1-OG 3.42Å; H351-S354 WeakPolarHBondContact O-CA 3.4Å; H351-S354 WeakPolarHBondContact O-CB 3.49Å; H351-S354 PolarHBondContact O-N 3.31Å; H351-S354 PolarHBondContact O-OG 3.29Å; L352-S354 VanDerWaalsContact C-N 3.31Å; L352-S354 PolarHBondContact O-N 3.14Å; S354-D356 VanDerWaalsContact C-N 3.35Å |
| 355 | L | 90.6 | Very high | 91.9 | Very high | 42 Ų | 42 | 49.9 Ų | 49.9 | 22% | 0.22 | 26% | 0.26 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.5 | 14.8 | 176.1 | -63.2 | 176.1 | 0 | 0 | 0 | 112.8 | I313 E314 V317 H351 L352 N353 V357 | I313-L355 HydrophobicContact CG2-CD1 3.97Å; E314-L355 HydrophobicContact CB-CD1 4.28Å; E314-L355 HydrophobicContact CG-CD2 4.37Å; V317-L355 HydrophobicContact CB-CD1 4.37Å; V317-L355 HydrophobicContact CG1-CB 4.09Å; V317-L355 HydrophobicContact CG1-CD1 4.3Å; V317-L355 HydrophobicContact CG2-CD1 4.23Å; H351-L355 WeakPolarHBondContact O-CG 3.34Å; H351-L355 PolarHBondContact O-N 3.25Å; H351-L355 VanDerWaalsContact O-N 3.11Å; L352-L355 PolarHBondContact O-N 3.03Å; L352-L355 VanDerWaalsContact O-N 3.14Å; N353-L355 PolarHBondContact O-N 3.01Å; L355-V357 HydrophobicContact CB-CG2 4.2Å; L355-V357 PolarHBondContact O-N 3.39Å |
| 356 | D | 89.2 | Confident | 91.9 | Very high | 151 Ų | 151 | 48.8 Ų | 48.8 | 81% | 0.807 | 25% | 0.253 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.4 | 31.5 | -178.9 | -64.4 | -47.2 | 0 | 0 | 0 | 114 | N353 S354 | N353-D356 PolarHBondContact O-N 3.43Å; S354-D356 VanDerWaalsContact C-N 3.35Å |
| 357 | V | 93 | Very high | 91.8 | Very high | 9 Ų | 9 | 51.9 Ų | 51.9 | 6% | 0.055 | 27% | 0.265 | C | S | . | . | trans | -62.3 | 138.5 | 178.5 | 172.1 | 0 | 0 | 0 | 0 | 110.4 | V317 W322 L352 L355 K359 I361 I362 | V317-V357 HydrophobicContact CB-CG2 4.42Å; V317-V357 HydrophobicContact CG1-CG2 3.54Å; V317-V357 HydrophobicContact CG2-CG2 3.93Å; W322-V357 HydrophobicContact CH2-CG1 3.97Å; W322-V357 HydrophobicContact CH2-CG2 4.29Å; W322-V357 HydrophobicContact CZ3-CG1 3.87Å; W322-V357 HydrophobicContact CZ3-CG2 4.28Å; L352-V357 HydrophobicContact CB-CB 4.12Å; L352-V357 HydrophobicContact CB-CG1 4.44Å; L352-V357 HydrophobicContact CB-CG2 4.01Å; L352-V357 HydrophobicContact CD2-CG2 3.97Å; L352-V357 VanDerWaalsContact O-CB 3.27Å; L352-V357 WeakPolarHBondContact O-CB 3.17Å; L352-V357 WeakPolarHBondContact O-CG2 3.39Å; L352-V357 PolarHBondContact O-N 2.76Å; L355-V357 HydrophobicContact CB-CG2 4.2Å; L355-V357 PolarHBondContact O-N 3.39Å; V357-K359 PolarHBondContact O-N 3.26Å; V357-I361 HydrophobicContact CG1-CB 3.73Å; V357-I361 HydrophobicContact CG1-CG1 4.41Å; V357-I361 HydrophobicContact CG1-CG2 3.82Å; V357-I362 HydrophobicContact CB-CD1 4.36Å; V357-I362 HydrophobicContact CB-CG1 4.31Å; V357-I362 HydrophobicContact CG1-CG1 4.07Å | ||
| 358 | P | 93.3 | Very high | 91.8 | Very high | 58 Ų | 58 | 47.7 Ų | 47.7 | 38% | 0.377 | 25% | 0.249 | S | C | . | . | trans | -53.7 | 133.6 | 177.4 | -27.9 | 35.8 | 0 | 0 | 0 | 112.6 | W322 N360 I361 I362 | W322-P358 HydrophobicContact CZ2-CG 4.35Å; P358-N360 WeakPolarHBondContact CB-OD1 3.28Å; P358-N360 PolarHBondContact O-N 3.33Å; P358-N360 VanDerWaalsContact O-N 3.12Å; P358-I361 HydrophobicContact CB-CG1 4.28Å; P358-I361 WeakPolarHBondContact O-CB 3.27Å; P358-I361 PolarHBondContact O-N 3.1Å; P358-I362 PolarHBondContact O-N 3.37Å | ||
| 359 | K | 90.8 | Very high | 91.6 | Very high | 105 Ų | 105 | 47.8 Ų | 47.8 | 46% | 0.457 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -54 | -37.8 | -174.9 | -71 | -169.6 | 174.8 | -167.6 | 0 | 113.2 | V357 I361 I362 E363 | V357-K359 PolarHBondContact O-N 3.26Å; K359-I361 PolarHBondContact O-N 3.04Å; K359-I362 CarbonylContact O-C 3.6Å; K359-I362 WeakPolarHBondContact O-CB 3.32Å; K359-I362 PolarHBondContact O-N 3.01Å; K359-E363 VanDerWaalsContact O-CG 3.23Å; K359-E363 WeakPolarHBondContact O-CG 3.35Å; K359-E363 PolarHBondContact O-N 3.36Å |
| 360 | N | 91.9 | Very high | 91.1 | Very high | 99 Ų | 99 | 53 Ų | 53 | 53% | 0.529 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -60.3 | -29.5 | 177.5 | 65.9 | -64.2 | 0 | 0 | 0 | 113.6 | P358 S364 | P358-N360 WeakPolarHBondContact CB-OD1 3.28Å; P358-N360 PolarHBondContact O-N 3.33Å; P358-N360 VanDerWaalsContact O-N 3.12Å; N360-S364 PolarHBondContact O-N 3.32Å |
| 361 | I | 94.2 | Very high | 90.9 | Very high | 26 Ų | 26 | 54.1 Ų | 54.1 | 13% | 0.133 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -74.2 | -44.3 | 173.8 | -56.8 | -60.4 | 0 | 0 | 0 | 109.7 | W322 V357 P358 K359 E363 S364 Y365 | W322-I361 HydrophobicContact CB-CD1 4.42Å; W322-I361 HydrophobicContact CD2-CD1 4.09Å; W322-I361 HydrophobicContact CD2-CG1 4.09Å; W322-I361 HydrophobicContact CD2-CG2 4.42Å; W322-I361 HydrophobicContact CE3-CG1 4.27Å; W322-I361 HydrophobicContact CE3-CG2 3.87Å; W322-I361 HydrophobicContact CG-CD1 3.98Å; W322-I361 HydrophobicContact CZ3-CG2 4.19Å; V357-I361 HydrophobicContact CG1-CB 3.73Å; V357-I361 HydrophobicContact CG1-CG1 4.41Å; V357-I361 HydrophobicContact CG1-CG2 3.82Å; P358-I361 HydrophobicContact CB-CG1 4.28Å; P358-I361 WeakPolarHBondContact O-CB 3.27Å; P358-I361 PolarHBondContact O-N 3.1Å; K359-I361 PolarHBondContact O-N 3.04Å; I361-E363 VanDerWaalsContact C-N 3.33Å; I361-E363 PolarHBondContact O-N 2.77Å; I361-S364 WeakPolarHBondContact O-CB 3.14Å; I361-S364 PolarHBondContact O-N 3.44Å; I361-S364 VanDerWaalsContact O-N 3.13Å; I361-S364 PolarHBondContact O-OG 3.03Å; I361-Y365 HydrophobicContact CG2-CE2 3.98Å; I361-Y365 VanDerWaalsContact O-CD2 3.25Å; I361-Y365 WeakPolarHBondContact O-CD2 3.48Å |
| 362 | I | 93.5 | Very high | 90.6 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -60.5 | -43.3 | 176.4 | -61.7 | 173.7 | 0 | 0 | 0 | 111 | I349 L352 N353 V357 P358 K359 S364 Y365 L366 L382 M384 | I349-I362 HydrophobicContact CG2-CG2 3.85Å; L352-I362 HydrophobicContact CB-CG1 4.14Å; N353-I362 HydrophobicContact CB-CD1 3.97Å; V357-I362 HydrophobicContact CB-CD1 4.36Å; V357-I362 HydrophobicContact CB-CG1 4.31Å; V357-I362 HydrophobicContact CG1-CG1 4.07Å; P358-I362 PolarHBondContact O-N 3.37Å; K359-I362 CarbonylContact O-C 3.6Å; K359-I362 WeakPolarHBondContact O-CB 3.32Å; K359-I362 PolarHBondContact O-N 3.01Å; I362-S364 PolarHBondContact O-N 2.89Å; I362-Y365 PolarHBondContact O-N 3.34Å; I362-L366 PolarHBondContact O-N 3.4Å; I362-L382 HydrophobicContact CG2-CD1 3.93Å; I362-M384 HydrophobicContact CB-CE 4.44Å; I362-M384 HydrophobicContact CG2-CE 4.18Å; I362-M384 HydrophobicContact CG2-SD 3.94Å |
| 363 | E | 91.7 | Very high | 90.2 | Very high | 68 Ų | 68 | 60 Ų | 60 | 32% | 0.318 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -53.4 | -39.5 | 175.3 | -71 | 166.1 | -164.8 | 0 | 0 | 111.8 | K359 I361 Y365 L366 M384 E387 | K359-E363 VanDerWaalsContact O-CG 3.23Å; K359-E363 WeakPolarHBondContact O-CG 3.35Å; K359-E363 PolarHBondContact O-N 3.36Å; I361-E363 VanDerWaalsContact C-N 3.33Å; I361-E363 PolarHBondContact O-N 2.77Å; E363-Y365 PolarHBondContact O-N 2.72Å; E363-Y365 VanDerWaalsContact O-N 3.17Å; E363-L366 PolarHBondContact O-N 3.35Å; E363-M384 HydrophobicContact CB-CE 4.28Å; E363-M384 HydrophobicContact CG-CE 3.21Å; E363-E387 HydrophobicContact CB-CG 4.32Å; E363-E387 HydrophobicContact CG-CB 4.39Å; E363-E387 HydrophobicContact CG-CG 4Å |
| 364 | S | 91.6 | Very high | 89.9 | Confident | 40 Ų | 40 | 60 Ų | 60 | 28% | 0.28 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.8 | -23.5 | -179.8 | 84.5 | 0 | 0 | 0 | 0 | 113.5 | N360 I361 I362 K367 Y368 | N360-S364 PolarHBondContact O-N 3.32Å; I361-S364 WeakPolarHBondContact O-CB 3.14Å; I361-S364 PolarHBondContact O-N 3.44Å; I361-S364 VanDerWaalsContact O-N 3.13Å; I361-S364 PolarHBondContact O-OG 3.03Å; I362-S364 PolarHBondContact O-N 2.89Å; S364-K367 WeakPolarHBondContact O-CD 3.41Å; S364-K367 WeakPolarHBondContact O-CE 3.47Å; S364-K367 WeakPolarHBondContact O-CG 3.18Å; S364-K367 PolarHBondContact O-NZ 3.02Å; S364-Y368 WeakPolarHBondContact O-CE2 3.28Å |
| 365 | Y | 93.1 | Very high | 89.8 | Confident | 4 Ų | 4 | 56.4 Ų | 56.4 | 2% | 0.016 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -96.9 | -24.7 | 179.4 | -65.7 | -72.4 | 0 | 0 | 0 | 114.1 | L330 V341 F348 L352 I361 I362 E363 K367 Y368 | L330-Y365 HydrophobicContact CD2-CD1 4.4Å; L330-Y365 HydrophobicContact CD2-CE1 4.2Å; L330-Y365 HydrophobicContact CG-CE1 4.43Å; V341-Y365 HydrophobicContact CG2-CD1 4.22Å; F348-Y365 AromaticContact CE1-CD1 3.73Å; F348-Y365 HydrophobicContact CE1-CD1 3.73Å; F348-Y365 AromaticContact CE1-CD2 3.95Å; F348-Y365 HydrophobicContact CE1-CD2 3.95Å; F348-Y365 AromaticContact CE1-CE1 3.81Å; F348-Y365 HydrophobicContact CE1-CE1 3.81Å; F348-Y365 HydrophobicContact CE1-CE2 4.02Å; F348-Y365 AromaticContact CE1-CG 3.8Å; F348-Y365 HydrophobicContact CE1-CG 3.8Å; F348-Y365 AromaticContact CE1-CZ 3.95Å; F348-Y365 HydrophobicContact CZ-CD2 4.5Å; F348-Y365 HydrophobicContact CZ-CE1 4.36Å; F348-Y365 HydrophobicContact CZ-CE2 4.19Å; L352-Y365 HydrophobicContact CD1-CD2 3.83Å; L352-Y365 HydrophobicContact CD1-CE2 4Å; I361-Y365 HydrophobicContact CG2-CE2 3.98Å; I361-Y365 VanDerWaalsContact O-CD2 3.25Å; I361-Y365 WeakPolarHBondContact O-CD2 3.48Å; I362-Y365 PolarHBondContact O-N 3.34Å; E363-Y365 PolarHBondContact O-N 2.72Å; E363-Y365 VanDerWaalsContact O-N 3.17Å; Y365-K367 PolarHBondContact O-N 2.78Å; Y365-K367 VanDerWaalsContact O-N 3.11Å; Y365-Y368 HydrophobicContact CD1-CD2 4.07Å; Y365-Y368 HydrophobicContact CD1-CE2 4.09Å; Y365-Y368 WeakPolarHBondContact O-CB 3.41Å; Y365-Y368 WeakPolarHBondContact O-CD2 3.26Å; Y365-Y368 PolarHBondContact O-N 3.38Å |
| 366 | L | 91.3 | Very high | 89.6 | Confident | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -54.7 | -33.8 | 178.8 | -73.8 | 174 | 0 | 0 | 0 | 112.7 | I349 I362 E363 Y368 I369 L375 I378 V379 M384 E387 L391 | I349-L366 HydrophobicContact CD1-CD2 4.09Å; I349-L366 HydrophobicContact CG2-CD2 4.34Å; I362-L366 PolarHBondContact O-N 3.4Å; E363-L366 PolarHBondContact O-N 3.35Å; L366-Y368 PolarHBondContact O-N 3.4Å; L366-Y368 VanDerWaalsContact O-N 3.11Å; L366-I369 HydrophobicContact CD2-CD1 3.83Å; L366-I369 PolarHBondContact O-N 2.8Å; L366-I369 VanDerWaalsContact O-N 3.12Å; L366-L375 HydrophobicContact CB-CD1 4.39Å; L366-L375 HydrophobicContact CD2-CD1 4.21Å; L366-I378 HydrophobicContact CD2-CG2 4.05Å; L366-V379 HydrophobicContact CD1-CG1 3.95Å; L366-V379 HydrophobicContact CD2-CG1 3.79Å; L366-M384 HydrophobicContact CD1-CE 3.7Å; L366-M384 HydrophobicContact CD1-SD 4.32Å; L366-E387 HydrophobicContact CD1-CB 4.33Å; L366-E387 HydrophobicContact CD1-CG 3.99Å; L366-L391 HydrophobicContact CB-CD1 3.65Å; L366-L391 HydrophobicContact CD1-CD1 4.42Å |
| 367 | K | 87.1 | Confident | 89.5 | Confident | 107 Ų | 107 | 51 Ų | 51 | 47% | 0.465 | 26% | 0.263 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.5 | -17.9 | 178 | 74.5 | -168.8 | -178.1 | -161.6 | 0 | 114.3 | S364 Y365 L391 | S364-K367 WeakPolarHBondContact O-CD 3.41Å; S364-K367 WeakPolarHBondContact O-CE 3.47Å; S364-K367 WeakPolarHBondContact O-CG 3.18Å; S364-K367 PolarHBondContact O-NZ 3.02Å; Y365-K367 PolarHBondContact O-N 2.78Å; Y365-K367 VanDerWaalsContact O-N 3.11Å; K367-L391 HydrophobicContact CB-CD2 4.16Å |
| 368 | Y | 89.1 | Confident | 89.3 | Confident | 46 Ų | 46 | 50.8 Ų | 50.8 | 18% | 0.18 | 26% | 0.261 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.4 | -10.7 | 179.4 | -59.9 | -63.4 | 0 | 0 | 0 | 113.4 | L330 M339 V341 S364 Y365 L366 S370 | L330-Y368 HydrophobicContact CD1-CE2 3.95Å; L330-Y368 WeakPolarHBondContact CD1-OH 3.42Å; L330-Y368 HydrophobicContact CD2-CD2 3.98Å; L330-Y368 HydrophobicContact CD2-CE1 4.42Å; L330-Y368 HydrophobicContact CD2-CE2 3.57Å; L330-Y368 HydrophobicContact CG-CE2 4.43Å; M339-Y368 HydrophobicContact CB-CE1 3.91Å; V341-Y368 HydrophobicContact CG2-CD2 3.7Å; V341-Y368 HydrophobicContact CG2-CG 3.89Å; S364-Y368 WeakPolarHBondContact O-CE2 3.28Å; Y365-Y368 HydrophobicContact CD1-CD2 4.07Å; Y365-Y368 HydrophobicContact CD1-CE2 4.09Å; Y365-Y368 WeakPolarHBondContact O-CB 3.41Å; Y365-Y368 WeakPolarHBondContact O-CD2 3.26Å; Y365-Y368 PolarHBondContact O-N 3.38Å; L366-Y368 PolarHBondContact O-N 3.4Å; L366-Y368 VanDerWaalsContact O-N 3.11Å; Y368-S370 PolarHBondContact O-N 3.17Å; Y368-S370 VanDerWaalsContact O-N 3.16Å |
| 369 | I | 88.6 | Confident | 89 | Confident | 2 Ų | 2 | 48 Ų | 48 | 1% | 0.01 | 24% | 0.243 | C | C | . | . | trans | -69.2 | 113.1 | 172.8 | -57.7 | 163.9 | 0 | 0 | 0 | 108.4 | T345 I349 L366 D371 E374 L375 I378 K395 | T345-I369 HydrophobicContact CG2-CG1 3.66Å; I349-I369 HydrophobicContact CD1-CD1 3.73Å; I349-I369 HydrophobicContact CD1-CG1 4.02Å; L366-I369 HydrophobicContact CD2-CD1 3.83Å; L366-I369 PolarHBondContact O-N 2.8Å; L366-I369 VanDerWaalsContact O-N 3.12Å; I369-D371 VanDerWaalsContact CG2-O 3.31Å; I369-D371 WeakPolarHBondContact CG2-O 3.49Å; I369-E374 HydrophobicContact CG2-CB 4.16Å; I369-E374 HydrophobicContact CG2-CG 4.07Å; I369-L375 HydrophobicContact CB-CB 4.33Å; I369-L375 HydrophobicContact CB-CD1 4.36Å; I369-L375 HydrophobicContact CD1-CD1 3.79Å; I369-L375 HydrophobicContact CG2-CB 3.9Å; I369-I378 HydrophobicContact CD1-CD1 3.54Å; I369-I378 HydrophobicContact CD1-CG2 4.46Å; I369-I378 HydrophobicContact CG1-CD1 4.35Å; I369-K395 PolarHBondContact O-NZ 3.04Å | ||
| 370 | S | 83.6 | Confident | 88.7 | Confident | 109 Ų | 109 | 45.3 Ų | 45.3 | 76% | 0.762 | 23% | 0.233 | S | C | * | . | trans | -78.2 | -36.1 | -178.4 | 50.1 | 0 | 0 | 0 | 0 | 112.9 | Y368 | Y368-S370 PolarHBondContact O-N 3.17Å; Y368-S370 VanDerWaalsContact O-N 3.16Å | ||
| 371 | D | 86.5 | Confident | 88.5 | Confident | 75 Ų | 75 | 48.4 Ų | 48.4 | 40% | 0.401 | 24% | 0.237 | S | C | . | . | trans | -84.1 | 127.9 | -178.2 | -175.5 | 74.9 | 0 | 0 | 0 | 111 | I369 E373 E374 L375 | I369-D371 VanDerWaalsContact CG2-O 3.31Å; I369-D371 WeakPolarHBondContact CG2-O 3.49Å; D371-E373 WeakPolarHBondContact OD2-CA 3.29Å; D371-E373 WeakPolarHBondContact OD2-CB 3.46Å; D371-E373 PolarHBondContact OD2-N 3.39Å; D371-E374 HydrophobicContact CB-CB 3.89Å; D371-E374 WeakPolarHBondContact OD2-CB 3.23Å; D371-E374 PolarHBondContact OD2-N 2.72Å; D371-L375 WeakPolarHBondContact O-CB 3.46Å; D371-L375 PolarHBondContact O-N 3.1Å | ||
| 372 | D | 85 | Confident | 88.1 | Confident | 33 Ų | 33 | 47.6 Ų | 47.6 | 18% | 0.176 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -79.9 | -25.3 | -173.8 | -70.6 | -38.7 | 0 | 0 | 0 | 112.6 | I376 K395 N397 A400 | D372-I376 VanDerWaalsContact O-CD1 3.32Å; D372-I376 WeakPolarHBondContact O-CD1 3.42Å; D372-I376 WeakPolarHBondContact O-CG1 3.48Å; D372-I376 PolarHBondContact O-N 3.37Å; D372-I376 VanDerWaalsContact O-N 3.12Å; D372-K395 WeakPolarHBondContact OD1-CD 3.46Å; D372-K395 IonicContact OD1-NZ 3.64Å; D372-K395 PolarHBondContact OD1-NZ 2.94Å; D372-N397 PolarHBondContact OD2-ND2 3.05Å; D372-A400 HydrophobicContact CB-CB 3.89Å |
| 373 | E | 85.9 | Confident | 87.8 | Confident | 147 Ų | 147 | 52.7 Ų | 52.7 | 69% | 0.687 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -70.9 | -46.6 | 174 | -63.7 | -177.3 | -178 | 0 | 0 | 110.1 | D371 L375 I376 Q377 | D371-E373 WeakPolarHBondContact OD2-CA 3.29Å; D371-E373 WeakPolarHBondContact OD2-CB 3.46Å; D371-E373 PolarHBondContact OD2-N 3.39Å; E373-L375 VanDerWaalsContact C-N 3.34Å; E373-L375 PolarHBondContact O-N 3.26Å; E373-I376 PolarHBondContact O-N 3.22Å; E373-Q377 WeakPolarHBondContact O-CG 3.41Å; E373-Q377 PolarHBondContact O-N 3.21Å |
| 374 | E | 87.5 | Confident | 87.7 | Confident | 63 Ų | 63 | 49.9 Ų | 49.9 | 29% | 0.294 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -57.2 | -46.1 | 173.6 | -176 | 178.6 | -146.9 | 0 | 0 | 111.3 | D346 I369 D371 I376 Q377 I378 | D346-E374 HydrophobicContact CB-CG 4.22Å; D346-E374 WeakPolarHBondContact CB-OE1 3.47Å; D346-E374 VanDerWaalsContact CG-OE1 3.29Å; I369-E374 HydrophobicContact CG2-CB 4.16Å; I369-E374 HydrophobicContact CG2-CG 4.07Å; D371-E374 HydrophobicContact CB-CB 3.89Å; D371-E374 WeakPolarHBondContact OD2-CB 3.23Å; D371-E374 PolarHBondContact OD2-N 2.72Å; E374-I376 VanDerWaalsContact C-N 3.33Å; E374-I376 PolarHBondContact O-N 2.99Å; E374-Q377 PolarHBondContact O-N 3.11Å; E374-I378 HydrophobicContact CG-CD1 3.75Å; E374-I378 WeakPolarHBondContact O-CD1 3.48Å; E374-I378 WeakPolarHBondContact O-CG1 3.08Å; E374-I378 PolarHBondContact O-N 2.64Å |
| 375 | L | 88.7 | Confident | 87.5 | Confident | 1 Ų | 1 | 48.2 Ų | 48.2 | 1% | 0.005 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -55.5 | -48.7 | 175.2 | 174.8 | 63.9 | 0 | 0 | 0 | 111.2 | L366 I369 D371 E373 I378 V379 L391 | L366-L375 HydrophobicContact CB-CD1 4.39Å; L366-L375 HydrophobicContact CD2-CD1 4.21Å; I369-L375 HydrophobicContact CB-CB 4.33Å; I369-L375 HydrophobicContact CB-CD1 4.36Å; I369-L375 HydrophobicContact CD1-CD1 3.79Å; I369-L375 HydrophobicContact CG2-CB 3.9Å; D371-L375 WeakPolarHBondContact O-CB 3.46Å; D371-L375 PolarHBondContact O-N 3.1Å; E373-L375 VanDerWaalsContact C-N 3.34Å; E373-L375 PolarHBondContact O-N 3.26Å; L375-I378 PolarHBondContact O-N 3.36Å; L375-V379 HydrophobicContact CD1-CG1 3.93Å; L375-V379 WeakPolarHBondContact O-CG1 3.34Å; L375-V379 WeakPolarHBondContact O-CG2 2.96Å; L375-V379 PolarHBondContact O-N 2.92Å; L375-L391 HydrophobicContact CD1-CD1 3.9Å; L375-L391 HydrophobicContact CD2-CB 4.13Å; L375-L391 HydrophobicContact CD2-CD1 4.32Å |
| 376 | I | 86.3 | Confident | 87.3 | Confident | 2 Ų | 2 | 52.5 Ų | 52.5 | 1% | 0.01 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.5 | -42.2 | -179.9 | -70 | 165 | 0 | 0 | 0 | 111.2 | D372 E373 E374 V379 I380 A400 E403 L404 | D372-I376 VanDerWaalsContact O-CD1 3.32Å; D372-I376 WeakPolarHBondContact O-CD1 3.42Å; D372-I376 WeakPolarHBondContact O-CG1 3.48Å; D372-I376 PolarHBondContact O-N 3.37Å; D372-I376 VanDerWaalsContact O-N 3.12Å; E373-I376 PolarHBondContact O-N 3.22Å; E374-I376 VanDerWaalsContact C-N 3.33Å; E374-I376 PolarHBondContact O-N 2.99Å; I376-V379 VanDerWaalsContact O-CG2 3.29Å; I376-V379 WeakPolarHBondContact O-CG2 3.48Å; I376-I380 HydrophobicContact CG2-CD1 3.57Å; I376-I380 HydrophobicContact CG2-CG1 4.44Å; I376-I380 WeakPolarHBondContact O-CB 3.46Å; I376-I380 WeakPolarHBondContact O-CD1 3.41Å; I376-I380 WeakPolarHBondContact O-CG1 3.26Å; I376-I380 PolarHBondContact O-N 2.67Å; I376-I380 VanDerWaalsContact O-N 3.11Å; I376-A400 HydrophobicContact CD1-CB 3.94Å; I376-A400 WeakPolarHBondContact CD1-O 3.18Å; I376-E403 HydrophobicContact CD1-CB 3.82Å; I376-E403 HydrophobicContact CD1-CG 4.05Å; I376-L404 HydrophobicContact CG1-CB 4.45Å; I376-L404 HydrophobicContact CG2-CD1 4.3Å |
| 377 | Q | 86.8 | Confident | 87.1 | Confident | 77 Ų | 77 | 53.8 Ų | 53.8 | 36% | 0.36 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -62.2 | -45.8 | 177.6 | -70.6 | -56.4 | -35.1 | 0 | 0 | 111.7 | E373 E374 R381 | E373-Q377 WeakPolarHBondContact O-CG 3.41Å; E373-Q377 PolarHBondContact O-N 3.21Å; E374-Q377 PolarHBondContact O-N 3.11Å; Q377-R381 WeakPolarHBondContact O-CB 2.79Å; Q377-R381 VanDerWaalsContact O-CG 3.27Å; Q377-R381 WeakPolarHBondContact O-CG 3.43Å; Q377-R381 PolarHBondContact O-N 3.02Å |
| 378 | I | 88.6 | Confident | 87 | Confident | 5 Ų | 5 | 48.7 Ų | 48.7 | 3% | 0.026 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64.8 | -50.5 | -179.1 | -69.3 | 158.6 | 0 | 0 | 0 | 111.1 | D346 I349 L366 I369 E374 L375 I380 R381 L382 | D346-I378 HydrophobicContact CB-CD1 3.51Å; D346-I378 HydrophobicContact CB-CG1 4.27Å; I349-I378 HydrophobicContact CG2-CG2 3.61Å; L366-I378 HydrophobicContact CD2-CG2 4.05Å; I369-I378 HydrophobicContact CD1-CD1 3.54Å; I369-I378 HydrophobicContact CD1-CG2 4.46Å; I369-I378 HydrophobicContact CG1-CD1 4.35Å; E374-I378 HydrophobicContact CG-CD1 3.75Å; E374-I378 WeakPolarHBondContact O-CD1 3.48Å; E374-I378 WeakPolarHBondContact O-CG1 3.08Å; E374-I378 PolarHBondContact O-N 2.64Å; L375-I378 PolarHBondContact O-N 3.36Å; I378-I380 VanDerWaalsContact C-N 3.27Å; I378-I380 PolarHBondContact O-N 3.37Å; I378-R381 WeakPolarHBondContact O-CB 3.28Å; I378-R381 PolarHBondContact O-N 3.15Å; I378-R381 VanDerWaalsContact O-N 3.14Å; I378-L382 HydrophobicContact CG2-CD1 3.79Å; I378-L382 HydrophobicContact CG2-CG 4.2Å; I378-L382 WeakPolarHBondContact O-CB 2.99Å; I378-L382 VanDerWaalsContact O-CG 3.27Å; I378-L382 WeakPolarHBondContact O-CG 3.41Å; I378-L382 PolarHBondContact O-N 3.14Å |
| 379 | V | 86.9 | Confident | 87 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -65.2 | -30.4 | -177.4 | -63.7 | 0 | 0 | 0 | 0 | 112.9 | L366 L375 I376 N383 M384 A388 L404 | L366-V379 HydrophobicContact CD1-CG1 3.95Å; L366-V379 HydrophobicContact CD2-CG1 3.79Å; L375-V379 HydrophobicContact CD1-CG1 3.93Å; L375-V379 WeakPolarHBondContact O-CG1 3.34Å; L375-V379 WeakPolarHBondContact O-CG2 2.96Å; L375-V379 PolarHBondContact O-N 2.92Å; I376-V379 VanDerWaalsContact O-CG2 3.29Å; I376-V379 WeakPolarHBondContact O-CG2 3.48Å; V379-N383 PolarHBondContact O-N 3.37Å; V379-M384 HydrophobicContact CB-CB 4.46Å; V379-M384 PolarHBondContact O-N 3.32Å; V379-A388 HydrophobicContact CB-CB 3.74Å; V379-A388 HydrophobicContact CG1-CB 3.99Å; V379-A388 HydrophobicContact CG2-CB 3.3Å; V379-L404 HydrophobicContact CG2-CD1 4.35Å |
| 380 | I | 85.3 | Confident | 86.9 | Confident | 48 Ų | 48 | 50.4 Ų | 50.4 | 25% | 0.246 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -68.4 | -48.3 | 172.1 | -70.5 | 168.5 | 0 | 0 | 0 | 110.1 | I376 I378 L382 N383 L404 Q407 | I376-I380 HydrophobicContact CG2-CD1 3.57Å; I376-I380 HydrophobicContact CG2-CG1 4.44Å; I376-I380 WeakPolarHBondContact O-CB 3.46Å; I376-I380 WeakPolarHBondContact O-CD1 3.41Å; I376-I380 WeakPolarHBondContact O-CG1 3.26Å; I376-I380 PolarHBondContact O-N 2.67Å; I376-I380 VanDerWaalsContact O-N 3.11Å; I378-I380 VanDerWaalsContact C-N 3.27Å; I378-I380 PolarHBondContact O-N 3.37Å; I380-L382 PolarHBondContact O-N 2.89Å; I380-N383 PolarHBondContact O-N 3.36Å; I380-L404 HydrophobicContact CD1-CD1 4.37Å; I380-L404 HydrophobicContact CG1-CD1 4.2Å; I380-Q407 HydrophobicContact CD1-CB 3.38Å; I380-Q407 HydrophobicContact CD1-CG 4.21Å |
| 381 | R | 86.1 | Confident | 87.1 | Confident | 163 Ų | 163 | 45.5 Ų | 45.5 | 62% | 0.615 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -57.2 | -36.6 | 176 | -73.4 | 175.1 | -177.6 | -166.9 | -0.8 | 112.2 | L350 Q377 I378 | L350-R381 HydrophobicContact CD2-CB 4.47Å; Q377-R381 WeakPolarHBondContact O-CB 2.79Å; Q377-R381 VanDerWaalsContact O-CG 3.27Å; Q377-R381 WeakPolarHBondContact O-CG 3.43Å; Q377-R381 PolarHBondContact O-N 3.02Å; I378-R381 WeakPolarHBondContact O-CB 3.28Å; I378-R381 PolarHBondContact O-N 3.15Å; I378-R381 VanDerWaalsContact O-N 3.14Å |
| 382 | L | 87.6 | Confident | 87.1 | Confident | 9 Ų | 9 | 42 Ų | 42 | 5% | 0.047 | 20% | 0.198 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.7 | -4.9 | 179.3 | -63 | -172.7 | 0 | 0 | 0 | 114.5 | I349 L350 N353 I362 I378 I380 M384 | I349-L382 HydrophobicContact CG2-CD1 3.49Å; I349-L382 VanDerWaalsContact CG2-CD1 3.49Å; L350-L382 HydrophobicContact CD2-CD2 4.07Å; L350-L382 HydrophobicContact CD2-CG 4.48Å; N353-L382 HydrophobicContact CB-CD2 3.43Å; N353-L382 VanDerWaalsContact CB-CD2 3.43Å; N353-L382 WeakPolarHBondContact ND2-CD2 3.29Å; I362-L382 HydrophobicContact CG2-CD1 3.93Å; I378-L382 HydrophobicContact CG2-CD1 3.79Å; I378-L382 HydrophobicContact CG2-CG 4.2Å; I378-L382 WeakPolarHBondContact O-CB 2.99Å; I378-L382 VanDerWaalsContact O-CG 3.27Å; I378-L382 WeakPolarHBondContact O-CG 3.41Å; I378-L382 PolarHBondContact O-N 3.14Å; I380-L382 PolarHBondContact O-N 2.89Å; L382-M384 VanDerWaalsContact C-N 3.3Å; L382-M384 HydrophobicContact CB-CB 4.43Å; L382-M384 HydrophobicContact CB-CG 3.86Å; L382-M384 HydrophobicContact CB-SD 3.79Å; L382-M384 HydrophobicContact CD1-SD 3.83Å; L382-M384 HydrophobicContact CG-SD 4.49Å; L382-M384 PolarHBondContact O-N 3.06Å |
| 383 | N | 86.7 | Confident | 87.2 | Confident | 107 Ų | 107 | 40.8 Ų | 40.8 | 57% | 0.572 | 19% | 0.191 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 51.5 | 47.4 | -172.3 | -167.2 | 34.1 | 0 | 0 | 0 | 112.5 | V379 I380 | V379-N383 PolarHBondContact O-N 3.37Å; I380-N383 PolarHBondContact O-N 3.36Å |
| 384 | M | 88.7 | Confident | 87.2 | Confident | 9 Ų | 9 | 39 Ų | 39 | 4% | 0.044 | 18% | 0.183 | C | C | . | . | trans | -113.7 | 43.1 | -179.8 | -65.8 | 177.2 | 70.5 | 0 | 0 | 111.3 | I362 E363 L366 V379 L382 D386 E387 A388 | I362-M384 HydrophobicContact CB-CE 4.44Å; I362-M384 HydrophobicContact CG2-CE 4.18Å; I362-M384 HydrophobicContact CG2-SD 3.94Å; E363-M384 HydrophobicContact CB-CE 4.28Å; E363-M384 HydrophobicContact CG-CE 3.21Å; L366-M384 HydrophobicContact CD1-CE 3.7Å; L366-M384 HydrophobicContact CD1-SD 4.32Å; V379-M384 HydrophobicContact CB-CB 4.46Å; V379-M384 PolarHBondContact O-N 3.32Å; L382-M384 VanDerWaalsContact C-N 3.3Å; L382-M384 HydrophobicContact CB-CB 4.43Å; L382-M384 HydrophobicContact CB-CG 3.86Å; L382-M384 HydrophobicContact CB-SD 3.79Å; L382-M384 HydrophobicContact CD1-SD 3.83Å; L382-M384 HydrophobicContact CG-SD 4.49Å; L382-M384 PolarHBondContact O-N 3.06Å; M384-D386 PolarHBondContact O-N 3.42Å; M384-E387 PolarHBondContact O-N 3.07Å; M384-A388 PolarHBondContact O-N 3.13Å; M384-A388 VanDerWaalsContact O-N 3.12Å | ||
| 385 | V | 87.8 | Confident | 87 | Confident | 5 Ų | 5 | 39.6 Ų | 39.6 | 3% | 0.03 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -58.9 | -35.4 | -174.8 | 178.2 | 0 | 0 | 0 | 0 | 112.2 | E387 A388 V389 I408 K414 | V385-E387 PolarHBondContact O-N 3.4Å; V385-A388 WeakPolarHBondContact O-CB 3.13Å; V385-A388 PolarHBondContact O-N 3.48Å; V385-V389 HydrophobicContact CG1-CG2 4.41Å; V385-V389 WeakPolarHBondContact O-CG2 3.21Å; V385-V389 PolarHBondContact O-N 3.21Å; V385-I408 HydrophobicContact CB-CG2 4.47Å; V385-I408 HydrophobicContact CG1-CD1 4.27Å; V385-I408 HydrophobicContact CG1-CG2 3.81Å; V385-I408 HydrophobicContact CG2-CG2 3.74Å; V385-K414 HydrophobicContact CG1-CB 4.17Å; V385-K414 HydrophobicContact CG1-CG 4.35Å |
| 386 | D | 88.2 | Confident | 86.9 | Confident | 95 Ų | 95 | 44.6 Ų | 44.6 | 51% | 0.508 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -61.8 | -44.5 | -179.4 | -63.9 | -14.8 | 0 | 0 | 0 | 111.7 | M384 V389 K390 K414 | M384-D386 PolarHBondContact O-N 3.42Å; D386-V389 PolarHBondContact O-N 2.93Å; D386-K390 PolarHBondContact O-N 3.32Å; D386-K414 WeakPolarHBondContact OD1-CD 3.44Å; D386-K414 WeakPolarHBondContact OD1-CE 3.5Å; D386-K414 WeakPolarHBondContact OD1-CG 3.39Å |
| 387 | E | 87.2 | Confident | 86.9 | Confident | 27 Ų | 27 | 46.4 Ų | 46.4 | 13% | 0.126 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -71.5 | -35.1 | 177.6 | -165 | 62.2 | -155.6 | 0 | 0 | 111.1 | E363 L366 M384 V385 V389 K390 L391 | E363-E387 HydrophobicContact CB-CG 4.32Å; E363-E387 HydrophobicContact CG-CB 4.39Å; E363-E387 HydrophobicContact CG-CG 4Å; L366-E387 HydrophobicContact CD1-CB 4.33Å; L366-E387 HydrophobicContact CD1-CG 3.99Å; M384-E387 PolarHBondContact O-N 3.07Å; V385-E387 PolarHBondContact O-N 3.4Å; E387-V389 PolarHBondContact O-N 2.85Å; E387-K390 WeakPolarHBondContact O-CB 3.26Å; E387-K390 PolarHBondContact O-N 3.27Å; E387-K390 IonicContact OE1-NZ 2.7Å; E387-K390 PolarHBondContact OE1-NZ 3.3Å; E387-K390 IonicContact OE2-NZ 2.67Å; E387-K390 PolarHBondContact OE2-NZ 2.73Å; E387-L391 HydrophobicContact CG-CD1 4.24Å; E387-L391 HydrophobicContact CG-CG 4.46Å; E387-L391 WeakPolarHBondContact O-CB 3.3Å; E387-L391 WeakPolarHBondContact O-CG 3.41Å; E387-L391 PolarHBondContact O-N 3.46Å |
| 388 | A | 85.4 | Confident | 87.1 | Confident | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -58.9 | -46.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | V379 M384 V385 K390 L391 C392 L404 | V379-A388 HydrophobicContact CB-CB 3.74Å; V379-A388 HydrophobicContact CG1-CB 3.99Å; V379-A388 HydrophobicContact CG2-CB 3.3Å; M384-A388 PolarHBondContact O-N 3.13Å; M384-A388 VanDerWaalsContact O-N 3.12Å; V385-A388 WeakPolarHBondContact O-CB 3.13Å; V385-A388 PolarHBondContact O-N 3.48Å; A388-K390 VanDerWaalsContact C-N 3.33Å; A388-K390 PolarHBondContact O-N 2.92Å; A388-L391 PolarHBondContact O-N 2.62Å; A388-C392 WeakPolarHBondContact O-CB 3.49Å; A388-C392 PolarHBondContact O-N 3.1Å; A388-C392 PolarHBondContact O-SG 2.95Å; A388-L404 HydrophobicContact CB-CD1 4.08Å; A388-L404 HydrophobicContact CB-CD2 3.69Å |
| 389 | V | 89.4 | Confident | 87.2 | Confident | 2 Ų | 2 | 51.1 Ų | 51.1 | 1% | 0.012 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58.3 | -49.3 | 175.8 | 172.5 | 0 | 0 | 0 | 0 | 109.6 | V385 D386 E387 L391 C392 L393 L404 K414 I418 Y421 | V385-V389 HydrophobicContact CG1-CG2 4.41Å; V385-V389 WeakPolarHBondContact O-CG2 3.21Å; V385-V389 PolarHBondContact O-N 3.21Å; D386-V389 PolarHBondContact O-N 2.93Å; E387-V389 PolarHBondContact O-N 2.85Å; V389-L391 PolarHBondContact O-N 2.97Å; V389-C392 PolarHBondContact O-N 3.45Å; V389-L393 HydrophobicContact CG1-CD1 3.78Å; V389-L393 HydrophobicContact CG1-CG 4.31Å; V389-L393 WeakPolarHBondContact O-CG 3.31Å; V389-L393 PolarHBondContact O-N 3.4Å; V389-L404 HydrophobicContact CG2-CD2 3.7Å; V389-K414 HydrophobicContact CG2-CB 4.4Å; V389-I418 HydrophobicContact CG1-CG1 4.43Å; V389-I418 HydrophobicContact CG2-CD1 3.67Å; V389-I418 HydrophobicContact CG2-CG1 3.62Å; V389-Y421 HydrophobicContact CG1-CE2 4.46Å |
| 390 | K | 87.7 | Confident | 87.3 | Confident | 82 Ų | 82 | 51.3 Ų | 51.3 | 36% | 0.357 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -57.1 | -47.3 | 178.1 | 178.6 | 175.7 | 155.7 | -135.8 | 0 | 112.2 | D386 E387 A388 L393 E394 | D386-K390 PolarHBondContact O-N 3.32Å; E387-K390 WeakPolarHBondContact O-CB 3.26Å; E387-K390 PolarHBondContact O-N 3.27Å; E387-K390 IonicContact OE1-NZ 2.7Å; E387-K390 PolarHBondContact OE1-NZ 3.3Å; E387-K390 IonicContact OE2-NZ 2.67Å; E387-K390 PolarHBondContact OE2-NZ 2.73Å; A388-K390 VanDerWaalsContact C-N 3.33Å; A388-K390 PolarHBondContact O-N 2.92Å; K390-L393 PolarHBondContact O-N 2.92Å; K390-E394 WeakPolarHBondContact CE-OE1 3.4Å; K390-E394 WeakPolarHBondContact O-CG 3.36Å; K390-E394 PolarHBondContact O-N 2.78Å |
| 391 | L | 85.9 | Confident | 87.6 | Confident | 6 Ų | 6 | 49 Ų | 49 | 3% | 0.031 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -64.4 | -42.8 | 178.4 | -71.1 | 170.7 | 0 | 0 | 0 | 112.6 | L366 K367 L375 E387 A388 V389 L393 E394 K395 | L366-L391 HydrophobicContact CB-CD1 3.65Å; L366-L391 HydrophobicContact CD1-CD1 4.42Å; K367-L391 HydrophobicContact CB-CD2 4.16Å; L375-L391 HydrophobicContact CD1-CD1 3.9Å; L375-L391 HydrophobicContact CD2-CB 4.13Å; L375-L391 HydrophobicContact CD2-CD1 4.32Å; E387-L391 HydrophobicContact CG-CD1 4.24Å; E387-L391 HydrophobicContact CG-CG 4.46Å; E387-L391 WeakPolarHBondContact O-CB 3.3Å; E387-L391 WeakPolarHBondContact O-CG 3.41Å; E387-L391 PolarHBondContact O-N 3.46Å; A388-L391 PolarHBondContact O-N 2.62Å; V389-L391 PolarHBondContact O-N 2.97Å; L391-L393 VanDerWaalsContact C-N 3.28Å; L391-L393 PolarHBondContact O-N 3.29Å; L391-E394 PolarHBondContact O-N 3.43Å; L391-K395 WeakPolarHBondContact O-CB 3.36Å; L391-K395 WeakPolarHBondContact O-CG 3.49Å; L391-K395 PolarHBondContact O-N 3.22Å |
| 392 | C | 86.8 | Confident | 87.9 | Confident | 1 Ų | 1 | 46.7 Ų | 46.7 | 1% | 0.007 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61 | -38.4 | 175.1 | -69.1 | 0 | 0 | 0 | 0 | 111.8 | A388 V389 R396 N397 L401 | A388-C392 WeakPolarHBondContact O-CB 3.49Å; A388-C392 PolarHBondContact O-N 3.1Å; A388-C392 PolarHBondContact O-SG 2.95Å; V389-C392 PolarHBondContact O-N 3.45Å; C392-R396 WeakPolarHBondContact O-CA 3.44Å; C392-R396 PolarHBondContact O-N 3.47Å; C392-N397 PolarHBondContact O-N 2.9Å; C392-L401 HydrophobicContact CB-CB 4.23Å; C392-L401 HydrophobicContact CB-CD1 4.16Å |
| 393 | L | 88.4 | Confident | 88.1 | Confident | 8 Ų | 8 | 50.3 Ų | 50.3 | 4% | 0.042 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -69.8 | -42.9 | 177.1 | -65.3 | 170.9 | 0 | 0 | 0 | 112 | V389 K390 L391 R396 L401 Y421 W429 V433 | V389-L393 HydrophobicContact CG1-CD1 3.78Å; V389-L393 HydrophobicContact CG1-CG 4.31Å; V389-L393 WeakPolarHBondContact O-CG 3.31Å; V389-L393 PolarHBondContact O-N 3.4Å; K390-L393 PolarHBondContact O-N 2.92Å; L391-L393 VanDerWaalsContact C-N 3.28Å; L391-L393 PolarHBondContact O-N 3.29Å; L393-R396 PolarHBondContact O-N 3.43Å; L393-R396 VanDerWaalsContact O-N 3.11Å; L393-L401 HydrophobicContact CD2-CD2 4.17Å; L393-Y421 HydrophobicContact CD1-CD1 4.2Å; L393-Y421 HydrophobicContact CD1-CD2 3.97Å; L393-Y421 HydrophobicContact CD1-CE1 3.72Å; L393-Y421 HydrophobicContact CD1-CE2 3.49Å; L393-Y421 VanDerWaalsContact CD1-CE2 3.49Å; L393-Y421 HydrophobicContact CD1-CG 4.31Å; L393-Y421 HydrophobicContact CD2-CD1 3.46Å; L393-Y421 VanDerWaalsContact CD2-CD1 3.46Å; L393-Y421 HydrophobicContact CD2-CD2 3.99Å; L393-Y421 HydrophobicContact CD2-CE1 3.78Å; L393-Y421 HydrophobicContact CD2-CE2 4.3Å; L393-Y421 HydrophobicContact CD2-CG 3.58Å; L393-Y421 HydrophobicContact CG-CD1 4.48Å; L393-Y421 HydrophobicContact CG-CE1 4.4Å; L393-Y421 HydrophobicContact CG-CE2 4.5Å; L393-W429 HydrophobicContact CD2-CD2 3.78Å; L393-W429 HydrophobicContact CD2-CE3 3.55Å; L393-W429 HydrophobicContact CD2-CG 4.24Å; L393-W429 HydrophobicContact CD2-CH2 4.45Å; L393-W429 HydrophobicContact CD2-CZ3 3.91Å; L393-V433 HydrophobicContact CB-CG2 3.76Å; L393-V433 HydrophobicContact CD1-CG2 4.1Å |
| 394 | E | 84.8 | Confident | 88.2 | Confident | 110 Ų | 110 | 45.2 Ų | 45.2 | 51% | 0.514 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -62.7 | -44.3 | 175.4 | -75.4 | 179.4 | -175.6 | 0 | 0 | 111.7 | K390 L391 R396 | K390-E394 WeakPolarHBondContact CE-OE1 3.4Å; K390-E394 WeakPolarHBondContact O-CG 3.36Å; K390-E394 PolarHBondContact O-N 2.78Å; L391-E394 PolarHBondContact O-N 3.43Å; E394-R396 PolarHBondContact O-N 2.82Å |
| 395 | K | 83.9 | Confident | 88.4 | Confident | 74 Ų | 74 | 47.5 Ų | 47.5 | 32% | 0.322 | 23% | 0.225 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -71.4 | -12.1 | 173.7 | -68.9 | -174 | -179.2 | -170.3 | 0 | 113.2 | I369 D372 L391 N397 | I369-K395 PolarHBondContact O-NZ 3.04Å; D372-K395 WeakPolarHBondContact OD1-CD 3.46Å; D372-K395 IonicContact OD1-NZ 3.64Å; D372-K395 PolarHBondContact OD1-NZ 2.94Å; L391-K395 WeakPolarHBondContact O-CB 3.36Å; L391-K395 WeakPolarHBondContact O-CG 3.49Å; L391-K395 PolarHBondContact O-N 3.22Å; K395-N397 HydrophobicContact CB-CB 4.49Å; K395-N397 PolarHBondContact O-N 3.04Å |
| 396 | R | 86.7 | Confident | 88.5 | Confident | 107 Ų | 107 | 50.9 Ų | 50.9 | 40% | 0.404 | 25% | 0.249 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.1 | 33.9 | -175.6 | -64.2 | 174.8 | 163.7 | -159.6 | -14.8 | 113.1 | C392 L393 E394 V426 | C392-R396 WeakPolarHBondContact O-CA 3.44Å; C392-R396 PolarHBondContact O-N 3.47Å; L393-R396 PolarHBondContact O-N 3.43Å; L393-R396 VanDerWaalsContact O-N 3.11Å; E394-R396 PolarHBondContact O-N 2.82Å; R396-V426 HydrophobicContact CB-CG1 3.75Å; R396-V426 HydrophobicContact CG-CG1 4.05Å |
| 397 | N | 87 | Confident | 88.5 | Confident | 39 Ų | 39 | 49.3 Ų | 49.3 | 21% | 0.209 | 24% | 0.239 | C | C | . | . | trans | -95.4 | 102.1 | -177.8 | -170.2 | -19.8 | 0 | 0 | 0 | 111.2 | D372 C392 K395 N399 A400 L401 | D372-N397 PolarHBondContact OD2-ND2 3.05Å; C392-N397 PolarHBondContact O-N 2.9Å; K395-N397 HydrophobicContact CB-CB 4.49Å; K395-N397 PolarHBondContact O-N 3.04Å; N397-N399 VanDerWaalsContact C-N 3.35Å; N397-N399 WeakPolarHBondContact OD1-CB 3.23Å; N397-N399 PolarHBondContact OD1-N 3.1Å; N397-A400 HydrophobicContact CB-CB 3.83Å; N397-A400 VanDerWaalsContact CG-CB 3.5Å; N397-A400 PolarHBondContact OD1-N 3.43Å; N397-L401 WeakPolarHBondContact O-CB 3.04Å; N397-L401 PolarHBondContact O-N 3.2Å; N397-L401 VanDerWaalsContact O-N 3.14Å | ||
| 398 | I | 90.3 | Very high | 88.5 | Confident | 65 Ų | 65 | 48.2 Ų | 48.2 | 33% | 0.333 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -64.1 | -39.4 | 177 | -49.9 | 175.4 | 0 | 0 | 0 | 111.9 | L401 K402 L422 V426 W429 | I398-L401 PolarHBondContact O-N 3.43Å; I398-K402 HydrophobicContact CG2-CD 4.22Å; I398-K402 HydrophobicContact CG2-CG 4.42Å; I398-K402 WeakPolarHBondContact O-CG 3.27Å; I398-K402 PolarHBondContact O-N 2.95Å; I398-L422 HydrophobicContact CG2-CD2 3.83Å; I398-V426 HydrophobicContact CD1-CG2 3.22Å; I398-V426 HydrophobicContact CG1-CG2 3.27Å; I398-W429 HydrophobicContact CB-CH2 4.37Å; I398-W429 HydrophobicContact CG1-CH2 3.9Å; I398-W429 HydrophobicContact CG1-CZ2 4.22Å |
| 399 | N | 91.1 | Very high | 88.3 | Confident | 116 Ų | 116 | 51.6 Ų | 51.6 | 62% | 0.62 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -68.6 | -44.2 | -175.7 | -64.8 | -23.5 | 0 | 0 | 0 | 110.2 | N397 L401 K402 E403 | N397-N399 VanDerWaalsContact C-N 3.35Å; N397-N399 WeakPolarHBondContact OD1-CB 3.23Å; N397-N399 PolarHBondContact OD1-N 3.1Å; N399-L401 VanDerWaalsContact C-N 3.31Å; N399-L401 PolarHBondContact O-N 3.5Å; N399-K402 WeakPolarHBondContact O-CB 3.45Å; N399-K402 PolarHBondContact O-N 2.95Å; N399-E403 WeakPolarHBondContact O-CB 3.37Å; N399-E403 PolarHBondContact O-N 2.76Å |
| 400 | A | 89.3 | Confident | 87.9 | Confident | 5 Ų | 5 | 54.6 Ų | 54.6 | 4% | 0.041 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -58.8 | -43 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | D372 I376 N397 K402 E403 L404 | D372-A400 HydrophobicContact CB-CB 3.89Å; I376-A400 HydrophobicContact CD1-CB 3.94Å; I376-A400 WeakPolarHBondContact CD1-O 3.18Å; N397-A400 HydrophobicContact CB-CB 3.83Å; N397-A400 VanDerWaalsContact CG-CB 3.5Å; N397-A400 PolarHBondContact OD1-N 3.43Å; A400-K402 PolarHBondContact O-N 3.38Å; A400-E403 PolarHBondContact O-N 3.13Å; A400-L404 WeakPolarHBondContact O-CB 3.46Å; A400-L404 PolarHBondContact O-N 3.43Å |
| 401 | L | 91 | Very high | 87.7 | Confident | 0 Ų | 0 | 57.6 Ų | 57.6 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65.8 | -36.9 | 178.4 | -171.9 | 63.6 | 0 | 0 | 0 | 112.8 | C392 L393 N397 I398 N399 M405 I418 L422 W429 | C392-L401 HydrophobicContact CB-CB 4.23Å; C392-L401 HydrophobicContact CB-CD1 4.16Å; L393-L401 HydrophobicContact CD2-CD2 4.17Å; N397-L401 WeakPolarHBondContact O-CB 3.04Å; N397-L401 PolarHBondContact O-N 3.2Å; N397-L401 VanDerWaalsContact O-N 3.14Å; I398-L401 PolarHBondContact O-N 3.43Å; N399-L401 VanDerWaalsContact C-N 3.31Å; N399-L401 PolarHBondContact O-N 3.5Å; L401-M405 PolarHBondContact O-N 3.11Å; L401-I418 HydrophobicContact CD1-CB 4.36Å; L401-I418 HydrophobicContact CD1-CG1 3.95Å; L401-I418 HydrophobicContact CD1-CG2 3.75Å; L401-I418 HydrophobicContact CD2-CG2 4.32Å; L401-I418 HydrophobicContact CG-CG2 3.71Å; L401-L422 HydrophobicContact CB-CD2 4.32Å; L401-L422 HydrophobicContact CD2-CD2 3.85Å; L401-L422 HydrophobicContact CD2-CG 4.04Å; L401-L422 HydrophobicContact CG-CD2 4.12Å; L401-L422 HydrophobicContact CG-CG 4.32Å; L401-W429 HydrophobicContact CD2-CH2 3.64Å; L401-W429 HydrophobicContact CD2-CZ2 3.92Å; L401-W429 HydrophobicContact CD2-CZ3 4.33Å |
| 402 | K | 92.4 | Very high | 87.6 | Confident | 113 Ų | 113 | 59.3 Ų | 59.3 | 49% | 0.491 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -65.9 | -42.9 | 173.8 | -76.9 | 174.1 | 175.9 | 177.4 | 0 | 111.8 | I398 N399 A400 M405 S406 L422 | I398-K402 HydrophobicContact CG2-CD 4.22Å; I398-K402 HydrophobicContact CG2-CG 4.42Å; I398-K402 WeakPolarHBondContact O-CG 3.27Å; I398-K402 PolarHBondContact O-N 2.95Å; N399-K402 WeakPolarHBondContact O-CB 3.45Å; N399-K402 PolarHBondContact O-N 2.95Å; A400-K402 PolarHBondContact O-N 3.38Å; K402-M405 WeakPolarHBondContact O-CB 3.42Å; K402-M405 PolarHBondContact O-N 3.26Å; K402-S406 PolarHBondContact O-N 2.96Å; K402-L422 HydrophobicContact CG-CD1 4.05Å; K402-L422 HydrophobicContact CG-CD2 3.77Å |
| 403 | E | 91 | Very high | 87.5 | Confident | 85 Ų | 85 | 68 Ų | 68 | 40% | 0.397 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -67.9 | -39.5 | 179 | -171.7 | 58.4 | -148.2 | 0 | 0 | 111.4 | I376 N399 A400 M405 S406 Q407 | I376-E403 HydrophobicContact CD1-CB 3.82Å; I376-E403 HydrophobicContact CD1-CG 4.05Å; N399-E403 WeakPolarHBondContact O-CB 3.37Å; N399-E403 PolarHBondContact O-N 2.76Å; A400-E403 PolarHBondContact O-N 3.13Å; E403-M405 VanDerWaalsContact C-N 3.3Å; E403-M405 PolarHBondContact O-N 3.45Å; E403-S406 PolarHBondContact O-N 3.06Å; E403-S406 PolarHBondContact O-OG 3.26Å; E403-Q407 WeakPolarHBondContact O-CG 3.49Å; E403-Q407 PolarHBondContact O-N 3.01Å; E403-Q407 VanDerWaalsContact O-N 3.15Å; E403-Q407 PolarHBondContact OE1-NE2 3.29Å |
| 404 | L | 89.7 | Confident | 87.5 | Confident | 0 Ų | 0 | 69.3 Ų | 69.3 | 0% | 0 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -59.5 | -42 | 169.8 | -175.6 | 65.3 | 0 | 0 | 0 | 111.3 | I376 V379 I380 A388 V389 A400 S406 Q407 I408 I418 | I376-L404 HydrophobicContact CG1-CB 4.45Å; I376-L404 HydrophobicContact CG2-CD1 4.3Å; V379-L404 HydrophobicContact CG2-CD1 4.35Å; I380-L404 HydrophobicContact CD1-CD1 4.37Å; I380-L404 HydrophobicContact CG1-CD1 4.2Å; A388-L404 HydrophobicContact CB-CD1 4.08Å; A388-L404 HydrophobicContact CB-CD2 3.69Å; V389-L404 HydrophobicContact CG2-CD2 3.7Å; A400-L404 WeakPolarHBondContact O-CB 3.46Å; A400-L404 PolarHBondContact O-N 3.43Å; L404-S406 VanDerWaalsContact C-N 3.33Å; L404-S406 PolarHBondContact O-N 3.27Å; L404-Q407 PolarHBondContact O-N 3.25Å; L404-I408 HydrophobicContact CD1-CG2 3.76Å; L404-I408 HydrophobicContact CG-CG2 4.13Å; L404-I408 WeakPolarHBondContact O-CG1 3.35Å; L404-I408 VanDerWaalsContact O-CG2 3.26Å; L404-I408 WeakPolarHBondContact O-CG2 3.24Å; L404-I408 PolarHBondContact O-N 3.18Å; L404-I418 HydrophobicContact CD2-CD1 4.3Å; L404-I418 HydrophobicContact CG-CD1 4.44Å |
| 405 | M | 91.5 | Very high | 87.7 | Confident | 58 Ų | 58 | 66.5 Ų | 66.5 | 29% | 0.286 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -63.4 | -35.9 | 178.2 | -167.5 | 177.6 | 178.1 | 0 | 0 | 113.3 | L401 K402 E403 K415 I418 L422 | L401-M405 PolarHBondContact O-N 3.11Å; K402-M405 WeakPolarHBondContact O-CB 3.42Å; K402-M405 PolarHBondContact O-N 3.26Å; E403-M405 VanDerWaalsContact C-N 3.3Å; E403-M405 PolarHBondContact O-N 3.45Å; M405-K415 WeakPolarHBondContact O-CE 3.24Å; M405-K415 PolarHBondContact O-NZ 3.04Å; M405-I418 HydrophobicContact CB-CG2 3.79Å; M405-I418 HydrophobicContact CG-CG2 4.02Å; M405-I418 HydrophobicContact SD-CG2 3.98Å; M405-L422 HydrophobicContact SD-CD1 3.62Å |
| 406 | S | 91 | Very high | 87.9 | Confident | 76 Ų | 76 | 71.5 Ų | 71.5 | 53% | 0.531 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -71.3 | -36.8 | 179.8 | 69.1 | 0 | 0 | 0 | 0 | 111.6 | K402 E403 L404 | K402-S406 PolarHBondContact O-N 2.96Å; E403-S406 PolarHBondContact O-N 3.06Å; E403-S406 PolarHBondContact O-OG 3.26Å; L404-S406 VanDerWaalsContact C-N 3.33Å; L404-S406 PolarHBondContact O-N 3.27Å |
| 407 | Q | 88.1 | Confident | 87.9 | Confident | 61 Ų | 61 | 68.4 Ų | 68.4 | 29% | 0.285 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -89.9 | -25.2 | -174.5 | -61.8 | -172.6 | 37.6 | 0 | 0 | 115 | I380 E403 L404 | I380-Q407 HydrophobicContact CD1-CB 3.38Å; I380-Q407 HydrophobicContact CD1-CG 4.21Å; E403-Q407 WeakPolarHBondContact O-CG 3.49Å; E403-Q407 PolarHBondContact O-N 3.01Å; E403-Q407 VanDerWaalsContact O-N 3.15Å; E403-Q407 PolarHBondContact OE1-NE2 3.29Å; L404-Q407 PolarHBondContact O-N 3.25Å |
| 408 | I | 86.6 | Confident | 88.1 | Confident | 4 Ų | 4 | 66.5 Ų | 66.5 | 2% | 0.021 | 35% | 0.348 | C | S | . | . | S | Bend | trans | -70.8 | 148.8 | -179.9 | 64.1 | -174.3 | 0 | 0 | 0 | 112.3 | V385 L404 K415 I418 | V385-I408 HydrophobicContact CB-CG2 4.47Å; V385-I408 HydrophobicContact CG1-CD1 4.27Å; V385-I408 HydrophobicContact CG1-CG2 3.81Å; V385-I408 HydrophobicContact CG2-CG2 3.74Å; L404-I408 HydrophobicContact CD1-CG2 3.76Å; L404-I408 HydrophobicContact CG-CG2 4.13Å; L404-I408 WeakPolarHBondContact O-CG1 3.35Å; L404-I408 VanDerWaalsContact O-CG2 3.26Å; L404-I408 WeakPolarHBondContact O-CG2 3.24Å; L404-I408 PolarHBondContact O-N 3.18Å; I408-K415 HydrophobicContact CD1-CG 3.56Å; I408-K415 HydrophobicContact CG1-CD 4.29Å; I408-K415 HydrophobicContact CG1-CG 3.79Å; I408-K415 WeakPolarHBondContact O-CE 3.34Å; I408-K415 PolarHBondContact O-NZ 2.84Å; I408-I418 HydrophobicContact CD1-CD1 3.42Å; I408-I418 VanDerWaalsContact CD1-CD1 3.42Å |
| 409 | P | 82.1 | Confident | 88.1 | Confident | 72 Ų | 72 | 66.4 Ų | 66.4 | 47% | 0.468 | 35% | 0.353 | S | S | . | . | trans | -53.6 | 140.9 | 178.7 | -27.9 | 35.4 | 0 | 0 | 0 | 113.3 | N411 H412 K415 | P409-N411 WeakPolarHBondContact CB-OD1 3.43Å; P409-N411 PolarHBondContact O-N 3Å; P409-N411 VanDerWaalsContact O-N 3.09Å; P409-H412 VanDerWaalsContact O-CB 3.24Å; P409-H412 WeakPolarHBondContact O-CB 3.36Å; P409-H412 PolarHBondContact O-N 3.41Å; P409-K415 WeakPolarHBondContact O-CE 3.33Å | ||
| 410 | G | 80.8 | Confident | 88.1 | Confident | 65 Ų | 65 | 65 Ų | 65 | 67% | 0.67 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | -28.9 | -176.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 411 | N | 83 | Confident | 88.1 | Confident | 145 Ų | 145 | 64.9 Ų | 64.9 | 78% | 0.775 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.1 | 1.5 | 179.3 | 62.7 | -13.1 | 0 | 0 | 0 | 114 | P409 Q413 | P409-N411 WeakPolarHBondContact CB-OD1 3.43Å; P409-N411 PolarHBondContact O-N 3Å; P409-N411 VanDerWaalsContact O-N 3.09Å; N411-Q413 PolarHBondContact O-N 3.46Å |
| 412 | H | 84 | Confident | 88.1 | Confident | 42 Ų | 42 | 67.4 Ų | 67.4 | 19% | 0.194 | 35% | 0.354 | C | S | . | . | trans | -67.3 | 130.4 | -176.6 | -162.6 | -79.9 | 0 | 0 | 0 | 111.5 | P409 K414 K415 | P409-H412 VanDerWaalsContact O-CB 3.24Å; P409-H412 WeakPolarHBondContact O-CB 3.36Å; P409-H412 PolarHBondContact O-N 3.41Å; H412-K414 WeakPolarHBondContact ND1-CB 3.46Å; H412-K414 PolarHBondContact ND1-N 2.84Å; H412-K414 PolarHBondContact O-N 2.93Å; H412-K415 PolarHBondContact O-N 3.11Å | ||
| 413 | Q | 85.8 | Confident | 88 | Confident | 184 Ų | 184 | 66.1 Ų | 66.1 | 86% | 0.86 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.7 | -36.1 | -174.3 | -66.7 | -178 | -7.8 | 0 | 0 | 112.7 | N411 K415 | N411-Q413 PolarHBondContact O-N 3.46Å; Q413-K415 VanDerWaalsContact C-N 3.28Å; Q413-K415 PolarHBondContact O-N 3.26Å |
| 414 | K | 86.6 | Confident | 88 | Confident | 34 Ų | 34 | 63.4 Ų | 63.4 | 15% | 0.148 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -66.2 | -15 | 177.7 | -65.7 | -66.4 | -175.5 | 174 | 0 | 115.5 | V385 D386 V389 H412 K416 E417 I418 | V385-K414 HydrophobicContact CG1-CB 4.17Å; V385-K414 HydrophobicContact CG1-CG 4.35Å; D386-K414 WeakPolarHBondContact OD1-CD 3.44Å; D386-K414 WeakPolarHBondContact OD1-CE 3.5Å; D386-K414 WeakPolarHBondContact OD1-CG 3.39Å; V389-K414 HydrophobicContact CG2-CB 4.4Å; H412-K414 WeakPolarHBondContact ND1-CB 3.46Å; H412-K414 PolarHBondContact ND1-N 2.84Å; H412-K414 PolarHBondContact O-N 2.93Å; K414-K416 VanDerWaalsContact C-N 3.26Å; K414-K416 PolarHBondContact O-N 2.64Å; K414-E417 HydrophobicContact CD-CB 4.42Å; K414-E417 WeakPolarHBondContact CD-OE2 3.44Å; K414-E417 WeakPolarHBondContact CE-OE2 2.96Å; K414-E417 IonicContact NZ-OE1 3.71Å; K414-E417 IonicContact NZ-OE2 2.67Å; K414-E417 PolarHBondContact NZ-OE2 3.18Å; K414-E417 PolarHBondContact O-N 3.22Å; K414-E417 VanDerWaalsContact O-N 3.11Å; K414-I418 HydrophobicContact CB-CD1 4.35Å; K414-I418 VanDerWaalsContact O-CG1 3.31Å; K414-I418 WeakPolarHBondContact O-CG1 3.35Å; K414-I418 PolarHBondContact O-N 3.03Å |
| 415 | K | 88.8 | Confident | 87.9 | Confident | 52 Ų | 52 | 67.2 Ų | 67.2 | 23% | 0.226 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -58.1 | -39.1 | 178.1 | -85.2 | -162 | 178.9 | -164.9 | 0 | 112.6 | M405 I408 P409 H412 Q413 S419 | M405-K415 WeakPolarHBondContact O-CE 3.24Å; M405-K415 PolarHBondContact O-NZ 3.04Å; I408-K415 HydrophobicContact CD1-CG 3.56Å; I408-K415 HydrophobicContact CG1-CD 4.29Å; I408-K415 HydrophobicContact CG1-CG 3.79Å; I408-K415 WeakPolarHBondContact O-CE 3.34Å; I408-K415 PolarHBondContact O-NZ 2.84Å; P409-K415 WeakPolarHBondContact O-CE 3.33Å; H412-K415 PolarHBondContact O-N 3.11Å; Q413-K415 VanDerWaalsContact C-N 3.28Å; Q413-K415 PolarHBondContact O-N 3.26Å; K415-S419 WeakPolarHBondContact O-CB 3.47Å; K415-S419 PolarHBondContact O-N 3.47Å |
| 416 | K | 88.2 | Confident | 87.6 | Confident | 179 Ų | 179 | 66.1 Ų | 66.1 | 78% | 0.778 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -65.9 | -41.6 | 177.4 | -68.3 | -176.6 | -179.4 | 178.5 | 0 | 111.6 | K414 S419 H420 | K414-K416 VanDerWaalsContact C-N 3.26Å; K414-K416 PolarHBondContact O-N 2.64Å; K416-S419 PolarHBondContact O-N 3.03Å; K416-H420 PolarHBondContact O-N 3.25Å |
| 417 | E | 88.6 | Confident | 87.3 | Confident | 41 Ų | 41 | 66.2 Ų | 66.2 | 19% | 0.192 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -65.7 | -47.5 | 177.7 | 177.3 | 169 | -170.5 | 0 | 0 | 111.3 | K414 S419 H420 Y421 Q436 | K414-E417 HydrophobicContact CD-CB 4.42Å; K414-E417 WeakPolarHBondContact CD-OE2 3.44Å; K414-E417 WeakPolarHBondContact CE-OE2 2.96Å; K414-E417 IonicContact NZ-OE1 3.71Å; K414-E417 IonicContact NZ-OE2 2.67Å; K414-E417 PolarHBondContact NZ-OE2 3.18Å; K414-E417 PolarHBondContact O-N 3.22Å; K414-E417 VanDerWaalsContact O-N 3.11Å; E417-S419 VanDerWaalsContact C-N 3.33Å; E417-S419 PolarHBondContact O-N 3.37Å; E417-H420 WeakPolarHBondContact O-CB 3.45Å; E417-H420 PolarHBondContact O-N 3.4Å; E417-Y421 HydrophobicContact CG-CD2 3.78Å; E417-Y421 HydrophobicContact CG-CE2 3.37Å; E417-Y421 WeakPolarHBondContact O-CD2 3.33Å; E417-Y421 PolarHBondContact O-N 2.9Å; E417-Y421 WeakPolarHBondContact OE1-CE2 3.21Å; E417-Q436 PolarHBondContact OE1-NE2 3.46Å |
| 418 | I | 90.8 | Very high | 87 | Confident | 0 Ų | 0 | 67.6 Ų | 67.6 | 0% | 0 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -59 | -45.2 | 175.3 | -65 | 164.2 | 0 | 0 | 0 | 110.9 | V389 L401 L404 M405 I408 K414 H420 Y421 L422 | V389-I418 HydrophobicContact CG1-CG1 4.43Å; V389-I418 HydrophobicContact CG2-CD1 3.67Å; V389-I418 HydrophobicContact CG2-CG1 3.62Å; L401-I418 HydrophobicContact CD1-CB 4.36Å; L401-I418 HydrophobicContact CD1-CG1 3.95Å; L401-I418 HydrophobicContact CD1-CG2 3.75Å; L401-I418 HydrophobicContact CD2-CG2 4.32Å; L401-I418 HydrophobicContact CG-CG2 3.71Å; L404-I418 HydrophobicContact CD2-CD1 4.3Å; L404-I418 HydrophobicContact CG-CD1 4.44Å; M405-I418 HydrophobicContact CB-CG2 3.79Å; M405-I418 HydrophobicContact CG-CG2 4.02Å; M405-I418 HydrophobicContact SD-CG2 3.98Å; I408-I418 HydrophobicContact CD1-CD1 3.42Å; I408-I418 VanDerWaalsContact CD1-CD1 3.42Å; K414-I418 HydrophobicContact CB-CD1 4.35Å; K414-I418 VanDerWaalsContact O-CG1 3.31Å; K414-I418 WeakPolarHBondContact O-CG1 3.35Å; K414-I418 PolarHBondContact O-N 3.03Å; I418-H420 PolarHBondContact O-N 3.18Å; I418-Y421 PolarHBondContact O-N 3.15Å; I418-L422 HydrophobicContact CG2-CD1 3.78Å; I418-L422 HydrophobicContact CG2-CG 4.2Å; I418-L422 WeakPolarHBondContact O-CB 3.5Å; I418-L422 WeakPolarHBondContact O-CG 3.37Å; I418-L422 PolarHBondContact O-N 3.16Å |
| 419 | S | 90.1 | Very high | 86.9 | Confident | 62 Ų | 62 | 67.6 Ų | 67.6 | 43% | 0.434 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -59.3 | -35.5 | 175.9 | -173.7 | 0 | 0 | 0 | 0 | 112.4 | K415 K416 E417 S423 | K415-S419 WeakPolarHBondContact O-CB 3.47Å; K415-S419 PolarHBondContact O-N 3.47Å; K416-S419 PolarHBondContact O-N 3.03Å; E417-S419 VanDerWaalsContact C-N 3.33Å; E417-S419 PolarHBondContact O-N 3.37Å; S419-S423 PolarHBondContact O-N 3.08Å |
| 420 | H | 89.8 | Confident | 86.2 | Confident | 86 Ų | 86 | 70.4 Ų | 70.4 | 40% | 0.398 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -66.9 | -47.9 | 175.4 | -177.4 | 62.9 | 0 | 0 | 0 | 111.1 | K416 E417 I418 L422 S423 V424 F432 | K416-H420 PolarHBondContact O-N 3.25Å; E417-H420 WeakPolarHBondContact O-CB 3.45Å; E417-H420 PolarHBondContact O-N 3.4Å; I418-H420 PolarHBondContact O-N 3.18Å; H420-L422 VanDerWaalsContact C-N 3.31Å; H420-L422 PolarHBondContact O-N 3.37Å; H420-S423 WeakPolarHBondContact O-CB 3.2Å; H420-S423 PolarHBondContact O-N 3.02Å; H420-S423 PolarHBondContact O-OG 3.05Å; H420-V424 PolarHBondContact O-N 2.89Å; H420-F432 AromaticContact CD2-CE1 3.83Å; H420-F432 AromaticContact NE2-CE1 3.21Å; H420-F432 WeakPolarHBondContact NE2-CE1 3.29Å; H420-F432 AromaticContact NE2-CZ 3.41Å; H420-F432 WeakPolarHBondContact NE2-CZ 3.44Å |
| 421 | Y | 90 | Very high | 85.3 | Confident | 4 Ų | 4 | 71.7 Ų | 71.7 | 2% | 0.016 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -59.5 | -40.3 | 176 | -75.6 | -67.4 | 0 | 0 | 0 | 113.1 | V389 L393 E417 I418 S423 V424 W429 F432 | V389-Y421 HydrophobicContact CG1-CE2 4.46Å; L393-Y421 HydrophobicContact CD1-CD1 4.2Å; L393-Y421 HydrophobicContact CD1-CD2 3.97Å; L393-Y421 HydrophobicContact CD1-CE1 3.72Å; L393-Y421 HydrophobicContact CD1-CE2 3.49Å; L393-Y421 VanDerWaalsContact CD1-CE2 3.49Å; L393-Y421 HydrophobicContact CD1-CG 4.31Å; L393-Y421 HydrophobicContact CD2-CD1 3.46Å; L393-Y421 VanDerWaalsContact CD2-CD1 3.46Å; L393-Y421 HydrophobicContact CD2-CD2 3.99Å; L393-Y421 HydrophobicContact CD2-CE1 3.78Å; L393-Y421 HydrophobicContact CD2-CE2 4.3Å; L393-Y421 HydrophobicContact CD2-CG 3.58Å; L393-Y421 HydrophobicContact CG-CD1 4.48Å; L393-Y421 HydrophobicContact CG-CE1 4.4Å; L393-Y421 HydrophobicContact CG-CE2 4.5Å; E417-Y421 HydrophobicContact CG-CD2 3.78Å; E417-Y421 HydrophobicContact CG-CE2 3.37Å; E417-Y421 WeakPolarHBondContact O-CD2 3.33Å; E417-Y421 PolarHBondContact O-N 2.9Å; E417-Y421 WeakPolarHBondContact OE1-CE2 3.21Å; I418-Y421 PolarHBondContact O-N 3.15Å; Y421-S423 PolarHBondContact O-N 3.45Å; Y421-V424 WeakPolarHBondContact O-CG2 3.34Å; Y421-V424 PolarHBondContact O-N 3.09Å; Y421-W429 HydrophobicContact CD1-CG 4.32Å; Y421-W429 PolarHBondContact O-NE1 2.92Å; Y421-F432 HydrophobicContact CD1-CB 4.47Å; Y421-F432 HydrophobicContact CE1-CB 3.37Å; Y421-F432 HydrophobicContact CE1-CD1 4.48Å; Y421-F432 HydrophobicContact CE1-CD2 4.3Å; Y421-F432 AromaticContact CE1-CG 3.84Å; Y421-F432 HydrophobicContact CE1-CG 3.84Å; Y421-F432 WeakPolarHBondContact OH-CB 3.16Å |
| 422 | L | 91.5 | Very high | 84.2 | Confident | 52 Ų | 52 | 67.2 Ų | 67.2 | 27% | 0.272 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -69.7 | -16.3 | 176.9 | -68.4 | 174.8 | 0 | 0 | 0 | 113.5 | I398 L401 K402 M405 I418 H420 | I398-L422 HydrophobicContact CG2-CD2 3.83Å; L401-L422 HydrophobicContact CB-CD2 4.32Å; L401-L422 HydrophobicContact CD2-CD2 3.85Å; L401-L422 HydrophobicContact CD2-CG 4.04Å; L401-L422 HydrophobicContact CG-CD2 4.12Å; L401-L422 HydrophobicContact CG-CG 4.32Å; K402-L422 HydrophobicContact CG-CD1 4.05Å; K402-L422 HydrophobicContact CG-CD2 3.77Å; M405-L422 HydrophobicContact SD-CD1 3.62Å; I418-L422 HydrophobicContact CG2-CD1 3.78Å; I418-L422 HydrophobicContact CG2-CG 4.2Å; I418-L422 WeakPolarHBondContact O-CB 3.5Å; I418-L422 WeakPolarHBondContact O-CG 3.37Å; I418-L422 PolarHBondContact O-N 3.16Å; H420-L422 VanDerWaalsContact C-N 3.31Å; H420-L422 PolarHBondContact O-N 3.37Å |
| 423 | S | 90.8 | Very high | 83 | Confident | 86 Ų | 86 | 67 Ų | 67 | 60% | 0.601 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -86.7 | -17.2 | 177.1 | 76.3 | 0 | 0 | 0 | 0 | 114.2 | S419 H420 Y421 | S419-S423 PolarHBondContact O-N 3.08Å; H420-S423 WeakPolarHBondContact O-CB 3.2Å; H420-S423 PolarHBondContact O-N 3.02Å; H420-S423 PolarHBondContact O-OG 3.05Å; Y421-S423 PolarHBondContact O-N 3.45Å |
| 424 | V | 89.8 | Confident | 81.3 | Confident | 28 Ų | 28 | 62.5 Ų | 62.5 | 17% | 0.17 | 34% | 0.341 | C | S | . | . | S | Bend | trans | -108.2 | 148 | -178.6 | -64.2 | 0 | 0 | 0 | 0 | 111.4 | H420 Y421 V426 W429 F432 | H420-V424 PolarHBondContact O-N 2.89Å; Y421-V424 WeakPolarHBondContact O-CG2 3.34Å; Y421-V424 PolarHBondContact O-N 3.09Å; V424-V426 PolarHBondContact O-N 3.32Å; V424-W429 PolarHBondContact O-NE1 3.35Å; V424-F432 HydrophobicContact CG2-CE2 4.26Å |
| 425 | P | 88.1 | Confident | 79.4 | Confident | 81 Ų | 81 | 69.9 Ų | 69.9 | 53% | 0.526 | 37% | 0.368 | S | S | . | . | trans | -56.2 | 138.5 | 174.7 | -24.6 | 33.4 | 0 | 0 | 0 | 112.3 | A427 Q428 | P425-A427 PolarHBondContact O-N 3.48Å; P425-Q428 WeakPolarHBondContact O-CB 3.41Å; P425-Q428 PolarHBondContact O-N 3.34Å | ||
| 426 | V | 86.1 | Confident | 77.4 | Confident | 35 Ų | 35 | 73.1 Ų | 73.1 | 21% | 0.212 | 38% | 0.384 | C | S | . | . | G | 310 helix | trans | -51.1 | -31.9 | 179.8 | 177.5 | 0 | 0 | 0 | 0 | 113.7 | R396 I398 V424 Q428 W429 | R396-V426 HydrophobicContact CB-CG1 3.75Å; R396-V426 HydrophobicContact CG-CG1 4.05Å; I398-V426 HydrophobicContact CD1-CG2 3.22Å; I398-V426 HydrophobicContact CG1-CG2 3.27Å; V424-V426 PolarHBondContact O-N 3.32Å; V426-Q428 PolarHBondContact O-N 2.97Å; V426-W429 HydrophobicContact CB-CD2 4.37Å; V426-W429 HydrophobicContact CG1-CD2 4.21Å; V426-W429 HydrophobicContact CG1-CE3 4.09Å; V426-W429 HydrophobicContact CG1-CZ3 4.46Å; V426-W429 HydrophobicContact CG2-CD2 4.38Å; V426-W429 HydrophobicContact CG2-CH2 4.18Å; V426-W429 HydrophobicContact CG2-CZ2 3.9Å; V426-W429 WeakPolarHBondContact O-CB 3.37Å; V426-W429 PolarHBondContact O-N 3.29Å; V426-W429 VanDerWaalsContact O-N 3.13Å |
| 427 | A | 83.2 | Confident | 74.9 | Confident | 77 Ų | 77 | 69.6 Ų | 69.6 | 64% | 0.636 | 38% | 0.378 | S | S | * | . | G | 310 helix | trans | -56.9 | -31.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | P425 | P425-A427 PolarHBondContact O-N 3.48Š|
| 428 | Q | 83.3 | Confident | 72.1 | Confident | 91 Ų | 91 | 80 Ų | 80 | 43% | 0.425 | 42% | 0.423 | S | S | . | . | G | 310 helix | trans | -85.2 | -12.2 | -178.5 | -62.9 | -179.2 | -10.6 | 0 | 0 | 113.2 | P425 V426 K430 D431 F432 | P425-Q428 WeakPolarHBondContact O-CB 3.41Å; P425-Q428 PolarHBondContact O-N 3.34Å; V426-Q428 PolarHBondContact O-N 2.97Å; Q428-K430 PolarHBondContact O-N 2.82Å; Q428-K430 VanDerWaalsContact O-N 3.15Å; Q428-D431 PolarHBondContact O-N 3.47Å; Q428-D431 VanDerWaalsContact O-N 3.11Å; Q428-F432 VanDerWaalsContact O-CD2 3.3Å; Q428-F432 WeakPolarHBondContact O-CD2 3.37Å |
| 429 | W | 83.8 | Confident | 71.2 | Confident | 3 Ų | 3 | 84 Ų | 84 | 1% | 0.011 | 44% | 0.444 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.5 | -29.2 | -176.7 | -66.8 | 2.7 | 0 | 0 | 0 | 113.3 | L393 I398 L401 Y421 V424 V426 D431 F432 V433 | L393-W429 HydrophobicContact CD2-CD2 3.78Å; L393-W429 HydrophobicContact CD2-CE3 3.55Å; L393-W429 HydrophobicContact CD2-CG 4.24Å; L393-W429 HydrophobicContact CD2-CH2 4.45Å; L393-W429 HydrophobicContact CD2-CZ3 3.91Å; I398-W429 HydrophobicContact CB-CH2 4.37Å; I398-W429 HydrophobicContact CG1-CH2 3.9Å; I398-W429 HydrophobicContact CG1-CZ2 4.22Å; L401-W429 HydrophobicContact CD2-CH2 3.64Å; L401-W429 HydrophobicContact CD2-CZ2 3.92Å; L401-W429 HydrophobicContact CD2-CZ3 4.33Å; Y421-W429 HydrophobicContact CD1-CG 4.32Å; Y421-W429 PolarHBondContact O-NE1 2.92Å; V424-W429 PolarHBondContact O-NE1 3.35Å; V426-W429 HydrophobicContact CB-CD2 4.37Å; V426-W429 HydrophobicContact CG1-CD2 4.21Å; V426-W429 HydrophobicContact CG1-CE3 4.09Å; V426-W429 HydrophobicContact CG1-CZ3 4.46Å; V426-W429 HydrophobicContact CG2-CD2 4.38Å; V426-W429 HydrophobicContact CG2-CH2 4.18Å; V426-W429 HydrophobicContact CG2-CZ2 3.9Å; V426-W429 WeakPolarHBondContact O-CB 3.37Å; V426-W429 PolarHBondContact O-N 3.29Å; V426-W429 VanDerWaalsContact O-N 3.13Å; W429-D431 PolarHBondContact O-N 3.29Å; W429-F432 PolarHBondContact O-N 3.18Å; W429-F432 VanDerWaalsContact O-N 3.08Å; W429-V433 PolarHBondContact O-N 3.41Å |
| 430 | K | 67 | Low | 70.2 | Confident | 132 Ų | 132 | 85.2 Ų | 85.2 | 57% | 0.574 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -58.2 | -35.2 | 177.4 | -86 | -172.3 | 171.2 | -179.7 | 0 | 112.9 | Q428 F432 C434 | Q428-K430 PolarHBondContact O-N 2.82Å; Q428-K430 VanDerWaalsContact O-N 3.15Å; K430-F432 PolarHBondContact O-N 3.09Å; K430-C434 PolarHBondContact O-N 2.87Å |
| 431 | D | 62 | Low | 69.1 | Low | 91 Ų | 91 | 85.1 Ų | 85.1 | 49% | 0.487 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -70.3 | -18.5 | -178.4 | -63.4 | -27.4 | 0 | 0 | 0 | 112.3 | Q428 W429 R435 | Q428-D431 PolarHBondContact O-N 3.47Å; Q428-D431 VanDerWaalsContact O-N 3.11Å; W429-D431 PolarHBondContact O-N 3.29Å; D431-R435 WeakPolarHBondContact O-CD 3.29Å; D431-R435 WeakPolarHBondContact O-CG 3.4Å; D431-R435 PolarHBondContact O-NE 2.95Å; D431-R435 VanDerWaalsContact O-NE 3.15Å |
| 432 | F | 59.3 | Low | 67.9 | Low | 52 Ų | 52 | 89.9 Ų | 89.9 | 23% | 0.228 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -96 | -39.1 | -177.8 | -71.2 | -84.7 | 0 | 0 | 0 | 112.5 | H420 Y421 V424 Q428 W429 K430 C434 R435 | H420-F432 AromaticContact CD2-CE1 3.83Å; H420-F432 AromaticContact NE2-CE1 3.21Å; H420-F432 WeakPolarHBondContact NE2-CE1 3.29Å; H420-F432 AromaticContact NE2-CZ 3.41Å; H420-F432 WeakPolarHBondContact NE2-CZ 3.44Å; Y421-F432 HydrophobicContact CD1-CB 4.47Å; Y421-F432 HydrophobicContact CE1-CB 3.37Å; Y421-F432 HydrophobicContact CE1-CD1 4.48Å; Y421-F432 HydrophobicContact CE1-CD2 4.3Å; Y421-F432 AromaticContact CE1-CG 3.84Å; Y421-F432 HydrophobicContact CE1-CG 3.84Å; Y421-F432 WeakPolarHBondContact OH-CB 3.16Å; V424-F432 HydrophobicContact CG2-CE2 4.26Å; Q428-F432 VanDerWaalsContact O-CD2 3.3Å; Q428-F432 WeakPolarHBondContact O-CD2 3.37Å; W429-F432 PolarHBondContact O-N 3.18Å; W429-F432 VanDerWaalsContact O-N 3.08Å; K430-F432 PolarHBondContact O-N 3.09Å; F432-C434 VanDerWaalsContact C-N 3.3Å; F432-C434 PolarHBondContact O-N 2.97Å; F432-R435 PolarHBondContact O-N 3.18Å; F432-R435 VanDerWaalsContact O-N 3.14Å |
| 433 | V | 58.9 | Low | 66.4 | Low | 38 Ų | 38 | 92.3 Ų | 92.3 | 23% | 0.23 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -63 | -37.5 | 177.2 | 179.8 | 0 | 0 | 0 | 0 | 111.4 | L393 W429 R435 | L393-V433 HydrophobicContact CB-CG2 3.76Å; L393-V433 HydrophobicContact CD1-CG2 4.1Å; W429-V433 PolarHBondContact O-N 3.41Å; V433-R435 VanDerWaalsContact C-N 3.3Å; V433-R435 PolarHBondContact O-N 3.27Å |
| 434 | C | 51.2 | Low | 64.8 | Low | 89 Ų | 89 | 92.7 Ų | 92.7 | 60% | 0.601 | 48% | 0.477 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.1 | -12.6 | 177.3 | -72.1 | 0 | 0 | 0 | 0 | 114.3 | K430 F432 | K430-C434 PolarHBondContact O-N 2.87Å; F432-C434 VanDerWaalsContact C-N 3.3Å; F432-C434 PolarHBondContact O-N 2.97Å |
| 435 | R | 45.8 | Very low | 63 | Low | 188 Ų | 188 | 97.3 Ų | 97.3 | 71% | 0.709 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.3 | -10.1 | -176.9 | -76.9 | 178.2 | -166.2 | -175.5 | 5.8 | 114.3 | D431 F432 V433 | D431-R435 WeakPolarHBondContact O-CD 3.29Å; D431-R435 WeakPolarHBondContact O-CG 3.4Å; D431-R435 PolarHBondContact O-NE 2.95Å; D431-R435 VanDerWaalsContact O-NE 3.15Å; F432-R435 PolarHBondContact O-N 3.18Å; F432-R435 VanDerWaalsContact O-N 3.14Å; V433-R435 VanDerWaalsContact C-N 3.3Å; V433-R435 PolarHBondContact O-N 3.27Å |
| 436 | Q | 47.1 | Very low | 61 | Low | 121 Ų | 121 | 98.5 Ų | 98.5 | 57% | 0.565 | 50% | 0.497 | S | S | * | . | S | Bend | trans | -103.4 | 2.6 | -179.9 | -66.5 | -171.1 | 10.6 | 0 | 0 | 114.1 | E417 | E417-Q436 PolarHBondContact OE1-NE2 3.46Š|
| 437 | T | 35.9 | Very low | 59 | Low | 105 Ų | 105 | 103.8 Ų | 103.8 | 64% | 0.644 | 52% | 0.521 | S | S | * | . | trans | -102.7 | 27.3 | -176.3 | 32.2 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 438 | F | 30.2 | Very low | 56.7 | Low | 259 Ų | 259 | 106.3 Ų | 106.3 | 100% | 1.136 | 51% | 0.51 | S | S | * | . | trans | -130.6 | 0 | 169.7 | -75.7 | -77.4 | 0 | 0 | 0 | 112.1 |
Retrieved 438 of 438 residues in 141.4 ms
(Link to these results)