| 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 | 30.8 | Very low | 26 | Very low | 240 Ų | 240 | 136.4 Ų | 136.4 | 100% | 1.182 | 82% | 0.822 | S | S | * | * | 0 | 111.6 | 0 | -160.6 | 171.2 | 174.2 | 0 | 0 | 105.7 | |||||
| 2 | S | 26.6 | Very low | 25.9 | Very low | 105 Ų | 105 | 132.9 Ų | 132.9 | 73% | 0.734 | 82% | 0.819 | S | S | * | * | cis | -170 | 152.9 | 5.7 | -86.6 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 3 | V | 27.1 | Very low | 25.9 | Very low | 118 Ų | 118 | 133.3 Ų | 133.3 | 72% | 0.715 | 82% | 0.82 | S | S | * | * | cis | -165.7 | 139.3 | -16.4 | 99.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 4 | T | 27.1 | Very low | 25.6 | Very low | 124 Ų | 124 | 135.6 Ų | 135.6 | 76% | 0.761 | 81% | 0.813 | S | S | * | * | trans | 59.3 | 166.1 | 158.5 | 58.7 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 5 | K | 26.8 | Very low | 25.5 | Very low | 183 Ų | 183 | 137.7 Ų | 137.7 | 80% | 0.796 | 82% | 0.817 | S | S | * | * | cis | 175.7 | 142 | -33.3 | -166.4 | -177.2 | -170.7 | -173.7 | 0 | 108.7 | ||||
| 6 | S | 23.7 | Very low | 25.5 | Very low | 99 Ų | 99 | 135.5 Ų | 135.5 | 69% | 0.692 | 80% | 0.8 | S | S | * | * | trans | 58.4 | 169.6 | 158.5 | 69.4 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 7 | T | 25.4 | Very low | 25.5 | Very low | 108 Ų | 108 | 136.6 Ų | 136.6 | 66% | 0.663 | 80% | 0.801 | S | S | * | * | cis | -153.6 | 152.8 | 4.7 | -21.6 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 8 | E | 23.7 | Very low | 25.5 | Very low | 185 Ų | 185 | 138.5 Ų | 138.5 | 86% | 0.864 | 80% | 0.803 | S | S | * | * | trans | 16.9 | 137.3 | 148.4 | -67.5 | 165.2 | 152 | 0 | 0 | 123.7 | ||||
| 9 | G | 23.3 | Very low | 26 | Very low | 82 Ų | 82 | 137 Ų | 137 | 85% | 0.845 | 80% | 0.801 | S | S | * | * | 116.1 | 100.9 | 117.1 | 0 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 10 | A | 27.4 | Very low | 26.2 | Very low | 107 Ų | 107 | 136.2 Ų | 136.2 | 88% | 0.884 | 80% | 0.8 | S | S | * | * | trans | -158.4 | 138.8 | 150.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 11 | V | 24 | Very low | 26.4 | Very low | 149 Ų | 149 | 135.4 Ų | 135.4 | 90% | 0.903 | 80% | 0.799 | S | S | * | * | trans | -125.7 | 130.7 | -171.9 | 171.5 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 12 | A | 25.2 | Very low | 26.5 | Very low | 95 Ų | 95 | 132.7 Ų | 132.7 | 79% | 0.785 | 78% | 0.784 | S | S | * | * | trans | -174.7 | 136.9 | 165.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 13 | V | 25.2 | Very low | 26.6 | Very low | 138 Ų | 138 | 133.1 Ų | 133.1 | 84% | 0.836 | 79% | 0.787 | S | S | * | * | cis | -141.1 | 140.8 | -21.8 | 159.9 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 14 | K | 22.1 | Very low | 26.8 | Very low | 165 Ų | 165 | 132.3 Ų | 132.3 | 72% | 0.717 | 79% | 0.792 | S | S | * | * | trans | -121.8 | 132.6 | 173.3 | -166.2 | -172.6 | -178.7 | -148.7 | 0 | 108.8 | D16 | K14-D16 VanDerWaalsContact CE-OD1 3.28Å; K14-D16 WeakPolarHBondContact CE-OD1 3.36Å; K14-D16 IonicContact NZ-OD1 3.84Å; K14-D16 PolarHBondContact NZ-OD1 2.9Å | ||
| 15 | L | 23.8 | Very low | 27 | Very low | 167 Ų | 167 | 135.3 Ų | 135.3 | 87% | 0.874 | 80% | 0.795 | S | S | * | * | trans | -132.9 | 118.8 | 167.1 | -146.5 | 80.4 | 0 | 0 | 0 | 108.5 | ||||
| 16 | D | 25.4 | Very low | 27 | Very low | 103 Ų | 103 | 136.3 Ų | 136.3 | 55% | 0.551 | 80% | 0.799 | S | S | * | * | trans | -73.8 | 159.6 | 176.8 | -53 | -70.8 | 0 | 0 | 0 | 109.8 | K14 | K14-D16 VanDerWaalsContact CE-OD1 3.28Å; K14-D16 WeakPolarHBondContact CE-OD1 3.36Å; K14-D16 IonicContact NZ-OD1 3.84Å; K14-D16 PolarHBondContact NZ-OD1 2.9Å | ||
| 17 | L | 25.6 | Very low | 27.4 | Very low | 155 Ų | 155 | 139.7 Ų | 139.7 | 81% | 0.812 | 81% | 0.809 | S | S | * | * | -176.3 | 164.1 | 80.1 | -110.9 | 117.4 | 0 | 0 | 0 | 114.2 | |||||
| 18 | M | 26 | Very low | 27.5 | Very low | 170 Ų | 170 | 143.4 Ų | 143.4 | 84% | 0.837 | 82% | 0.819 | S | S | * | * | trans | 86 | 124.4 | 155.8 | -127.2 | 67.6 | 168.2 | 0 | 0 | 119.4 | ||||
| 19 | S | 33.9 | Very low | 27.6 | Very low | 110 Ų | 110 | 142.2 Ų | 142.2 | 77% | 0.769 | 82% | 0.818 | S | S | * | * | trans | -109.5 | 150.1 | 179.6 | 48.4 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 20 | P | 30.5 | Very low | 27.6 | Very low | 120 Ų | 120 | 146.7 Ų | 146.7 | 78% | 0.779 | 81% | 0.814 | S | S | * | * | trans | -117.9 | 169.5 | 160.4 | 29.5 | -12.4 | 0 | 0 | 0 | 112.4 | ||||
| 21 | P | 30.7 | Very low | 27.4 | Very low | 121 Ų | 121 | 149.6 Ų | 149.6 | 79% | 0.786 | 82% | 0.815 | S | S | * | * | trans | -117.5 | -175.5 | -130.7 | 34 | -19.9 | 0 | 0 | 0 | 117.7 | S23 | P21-S23 PolarHBondContact O-N 3.45Š| ||
| 22 | E | 32.6 | Very low | 27.5 | Very low | 182 Ų | 182 | 146.8 Ų | 146.8 | 85% | 0.85 | 80% | 0.802 | S | S | * | * | trans | -51.5 | 107.9 | -175 | -61 | 179.3 | 107.6 | 0 | 0 | 115.3 | ||||
| 23 | S | 29.7 | Very low | 27.4 | Very low | 114 Ų | 114 | 148.2 Ų | 148.2 | 80% | 0.797 | 80% | 0.801 | S | S | * | * | trans | -144.8 | -11.3 | 156.1 | 54.1 | 0 | 0 | 0 | 0 | 113.8 | P21 K25 | P21-S23 PolarHBondContact O-N 3.45Å; S23-K25 VanDerWaalsContact C-N 3.3Å; S23-K25 PolarHBondContact O-N 3.28Å | ||
| 24 | A | 31.2 | Very low | 27.3 | Very low | 101 Ų | 101 | 150.6 Ų | 150.6 | 84% | 0.835 | 80% | 0.801 | S | S | * | * | trans | -82.8 | 53.4 | -178 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 25 | K | 29.7 | Very low | 27.6 | Very low | 187 Ų | 187 | 149.9 Ų | 149.9 | 81% | 0.813 | 80% | 0.804 | S | S | * | * | trans | -130.9 | 28.4 | 178 | -93.9 | -175.9 | -180 | 169.7 | 0 | 114.6 | S23 | S23-K25 VanDerWaalsContact C-N 3.3Å; S23-K25 PolarHBondContact O-N 3.28Å | ||
| 26 | K | 28.4 | Very low | 27.6 | Very low | 205 Ų | 205 | 149.7 Ų | 149.7 | 89% | 0.891 | 80% | 0.803 | S | S | * | * | trans | -135.2 | 60 | 169.8 | -98.2 | -171.7 | 174.5 | -178.9 | 0 | 111.7 | ||||
| 27 | L | 31 | Very low | 27.5 | Very low | 170 Ų | 170 | 154.1 Ų | 154.1 | 89% | 0.89 | 82% | 0.821 | S | S | * | * | trans | -141.9 | 44.8 | 173.2 | -153.3 | 87.8 | 0 | 0 | 0 | 112.5 | ||||
| 28 | E | 29 | Very low | 27.3 | Very low | 186 Ų | 186 | 152 Ų | 152 | 87% | 0.869 | 82% | 0.819 | S | S | * | * | trans | -160 | 71.3 | 171 | -122.3 | 174.6 | 169.8 | 0 | 0 | 112.1 | ||||
| 29 | N | 23.8 | Very low | 27.5 | Very low | 160 Ų | 160 | 149.7 Ų | 149.7 | 86% | 0.856 | 82% | 0.817 | S | S | * | * | trans | -174 | 109.6 | 148.2 | -118 | -65.1 | 0 | 0 | 0 | 110.3 | ||||
| 30 | K | 23.4 | Very low | 26.9 | Very low | 175 Ų | 175 | 149.8 Ų | 149.8 | 76% | 0.761 | 82% | 0.817 | S | S | * | * | 156.1 | 92.4 | 102.2 | -165.7 | 167.5 | -169.4 | 175.4 | 0 | 110.6 | S32 | K30-S32 PolarHBondContact O-N 3.19Š| |||
| 31 | D | 25 | Very low | 26.8 | Very low | 169 Ų | 169 | 153.3 Ų | 153.3 | 90% | 0.904 | 82% | 0.823 | S | S | * | * | trans | -59.4 | 125.1 | 160.1 | -77.6 | -54.5 | 0 | 0 | 0 | 109.8 | ||||
| 32 | S | 25.3 | Very low | 26.5 | Very low | 89 Ų | 89 | 152.7 Ų | 152.7 | 62% | 0.622 | 82% | 0.822 | S | S | * | * | trans | -173.5 | 128.3 | 149.8 | 42.1 | 0 | 0 | 0 | 0 | 112 | K30 | K30-S32 PolarHBondContact O-N 3.19Š| ||
| 33 | T | 23.1 | Very low | 26.5 | Very low | 126 Ų | 126 | 150.6 Ų | 150.6 | 77% | 0.773 | 82% | 0.824 | S | S | * | * | trans | 90.6 | 82 | 157.6 | -21.9 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 34 | F | 22.7 | Very low | 26.5 | Very low | 188 Ų | 188 | 148.7 Ų | 148.7 | 83% | 0.825 | 82% | 0.822 | S | S | * | * | 37.7 | 122 | 128.8 | -75.5 | -95.1 | 0 | 0 | 0 | 122.3 | |||||
| 35 | L | 27.9 | Very low | 26.5 | Very low | 150 Ų | 150 | 151.7 Ų | 151.7 | 79% | 0.785 | 82% | 0.823 | S | S | * | * | trans | 54.5 | 109.5 | 140.1 | -60 | 172.8 | 0 | 0 | 0 | 120.3 | ||||
| 36 | D | 24.2 | Very low | 26.5 | Very low | 162 Ų | 162 | 151.9 Ų | 151.9 | 87% | 0.866 | 82% | 0.824 | S | S | * | * | -167.8 | 136 | 105.8 | -104.2 | -18.4 | 0 | 0 | 0 | 111.3 | |||||
| 37 | E | 24.3 | Very low | 26.8 | Very low | 196 Ų | 196 | 151.5 Ų | 151.5 | 92% | 0.916 | 82% | 0.823 | S | S | * | * | trans | -78.3 | 125.6 | 176.3 | -75.1 | -176.2 | 117.2 | 0 | 0 | 111.5 | ||||
| 38 | S | 21.4 | Very low | 27.7 | Very low | 110 Ų | 110 | 149.7 Ų | 149.7 | 77% | 0.769 | 82% | 0.819 | S | S | * | * | trans | -96.6 | 118 | 171 | 53 | 0 | 0 | 0 | 0 | 111.4 | S40 | S38-S40 PolarHBondContact O-N 3.09Š| ||
| 39 | P | 28.8 | Very low | 29.4 | Very low | 123 Ų | 123 | 149.9 Ų | 149.9 | 80% | 0.799 | 82% | 0.817 | S | S | * | * | trans | -77.3 | 107.2 | 178.2 | 29.2 | -32.2 | 0 | 0 | 0 | 111.7 | ||||
| 40 | S | 23 | Very low | 32 | Very low | 111 Ų | 111 | 143.3 Ų | 143.3 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | 23.8 | 105 | 148.3 | 48.8 | 0 | 0 | 0 | 0 | 118.6 | S38 S42 | S38-S40 PolarHBondContact O-N 3.09Å; S40-S42 PolarHBondContact O-N 3.05Å | ||
| 41 | E | 26.8 | Very low | 35 | Very low | 194 Ų | 194 | 136.3 Ų | 136.3 | 91% | 0.907 | 76% | 0.757 | S | S | * | * | trans | -63.3 | 121.2 | 162.6 | -74.9 | -165.8 | 129 | 0 | 0 | 111.2 | ||||
| 42 | S | 25.2 | Very low | 38.2 | Very low | 109 Ų | 109 | 131 Ų | 131 | 76% | 0.762 | 73% | 0.731 | S | S | * | * | trans | -81.6 | 127.2 | 171.2 | 57.8 | 0 | 0 | 0 | 0 | 111.4 | S40 G44 | S40-S42 PolarHBondContact O-N 3.05Å; S42-G44 PolarHBondContact O-N 2.96Å | ||
| 43 | P | 32.4 | Very low | 41.2 | Very low | 138 Ų | 138 | 130.1 Ų | 130.1 | 90% | 0.896 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -80.7 | 106.3 | -179.7 | 31.3 | -32.9 | 0 | 0 | 0 | 110.8 | ||
| 44 | G | 29.2 | Very low | 44.3 | Very low | 73 Ų | 73 | 129.8 Ų | 129.8 | 75% | 0.753 | 71% | 0.714 | S | S | * | * | trans | -175.4 | -19.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 119.4 | S42 | S42-G44 PolarHBondContact O-N 2.96Š| ||
| 45 | L | 31.4 | Very low | 47.4 | Very low | 164 Ų | 164 | 125.2 Ų | 125.2 | 86% | 0.859 | 70% | 0.695 | S | S | * | * | trans | -95.9 | 105.2 | -178.4 | -162.8 | 66.6 | 0 | 0 | 0 | 111.7 | K47 | L45-K47 PolarHBondContact O-N 3.25Š| ||
| 46 | K | 30.7 | Very low | 50.3 | Low | 192 Ų | 192 | 118.1 Ų | 118.1 | 84% | 0.835 | 66% | 0.658 | S | S | * | * | trans | -55.1 | 106.3 | 165.1 | -76.9 | 177 | 177.9 | 170.6 | 0 | 108.2 | T48 | K46-T48 VanDerWaalsContact C-N 3.25Å; K46-T48 PolarHBondContact O-N 2.98Å | ||
| 47 | K | 34.7 | Very low | 53.5 | Low | 197 Ų | 197 | 112.2 Ų | 112.2 | 86% | 0.857 | 63% | 0.626 | S | S | * | * | trans | -59.7 | 89.1 | 170 | -87.4 | 177.1 | 175.7 | 164.3 | 0 | 108.9 | L45 K49 | L45-K47 PolarHBondContact O-N 3.25Å; K47-K49 PolarHBondContact O-N 3.22Å | ||
| 48 | T | 49.6 | Very low | 56.5 | Low | 131 Ų | 131 | 107.8 Ų | 107.8 | 80% | 0.804 | 61% | 0.608 | S | S | * | * | trans | -58.1 | 113.9 | 168.6 | -55.9 | 0 | 0 | 0 | 0 | 106.5 | K46 G50 | K46-T48 VanDerWaalsContact C-N 3.25Å; K46-T48 PolarHBondContact O-N 2.98Å; T48-G50 PolarHBondContact O-N 2.94Å | ||
| 49 | K | 64.9 | Low | 59.5 | Low | 191 Ų | 191 | 106 Ų | 106 | 83% | 0.83 | 59% | 0.587 | S | S | * | * | trans | -60.7 | 105.6 | -180 | -74.6 | -179.6 | 177.7 | 177.3 | 0 | 107.8 | K47 | K47-K49 PolarHBondContact O-N 3.22Š| ||
| 50 | G | 78.1 | Confident | 62.4 | Low | 21 Ų | 21 | 100.2 Ų | 100.2 | 22% | 0.216 | 55% | 0.549 | C | S | . | . | P | Polyproline II helix | trans | -56.1 | 157 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | T48 K285 K287 | T48-G50 PolarHBondContact O-N 2.94Å; G50-K285 CarbonylContact C-O 3.4Å; G50-K285 WeakPolarHBondContact CA-O 3.42Å; G50-K287 WeakPolarHBondContact O-CE 3.43Å; G50-K287 VanDerWaalsContact O-CG 3.3Å; G50-K287 WeakPolarHBondContact O-CG 3.36Å |
| 51 | I | 87.3 | Confident | 65.6 | Low | 29 Ų | 29 | 96 Ų | 96 | 15% | 0.149 | 52% | 0.519 | C | S | . | . | B | Isolated β-bridge | trans | -71.2 | 150.2 | -176.7 | 64.6 | 179.5 | 0 | 0 | 0 | 111.7 | Q55 A56 L282 K285 M286 K287 | I51-Q55 HydrophobicContact CB-CB 4.13Å; I51-A56 HydrophobicContact CD1-CB 3.79Å; I51-A56 HydrophobicContact CG1-CB 4.26Å; I51-L282 HydrophobicContact CD1-CD1 3.35Å; I51-L282 HydrophobicContact CD1-CG 4.26Å; I51-K285 HydrophobicContact CD1-CB 4.49Å; I51-K285 PolarHBondContact N-O 3.5Å; I51-M286 HydrophobicContact CD1-CG 4.15Å; I51-M286 HydrophobicContact CG1-CB 4.47Å; I51-M286 HydrophobicContact CG1-CG 3.93Å; I51-K287 PolarHBondContact O-N 3.47Å |
| 52 | T | 91.1 | Very high | 68.1 | Low | 56 Ų | 56 | 89.1 Ų | 89.1 | 34% | 0.344 | 49% | 0.486 | S | S | . | . | P | Polyproline II helix | trans | -79.1 | 167.1 | 174.5 | 69.8 | 0 | 0 | 0 | 0 | 111.9 | I54 Q55 A56 | T52-I54 VanDerWaalsContact C-N 3.35Å; T52-I54 PolarHBondContact O-N 3.46Å; T52-Q55 PolarHBondContact O-N 3.39Å; T52-Q55 WeakPolarHBondContact OG1-CB 3.35Å; T52-Q55 WeakPolarHBondContact OG1-CG 3.32Å; T52-Q55 PolarHBondContact OG1-N 2.83Å; T52-Q55 PolarHBondContact OG1-OE1 3.35Å; T52-A56 WeakPolarHBondContact O-CB 3.36Å; T52-A56 PolarHBondContact O-N 2.89Å |
| 53 | V | 89.3 | Confident | 70.7 | Confident | 72 Ų | 72 | 85.6 Ų | 85.6 | 44% | 0.436 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -54.1 | -48.1 | 175.6 | 169.3 | 0 | 0 | 0 | 0 | 111.9 | A56 L57 M286 I295 | V53-A56 PolarHBondContact O-N 3.32Å; V53-L57 PolarHBondContact O-N 2.74Å; V53-M286 HydrophobicContact CG2-CE 4.33Å; V53-I295 HydrophobicContact CB-CD1 4.13Å; V53-I295 HydrophobicContact CG1-CD1 3.75Å; V53-I295 HydrophobicContact CG1-CG1 3.95Å; V53-I295 HydrophobicContact CG2-CD1 4.15Å |
| 54 | I | 88 | Confident | 73.2 | Confident | 119 Ų | 119 | 79.4 Ų | 79.4 | 61% | 0.61 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -67.7 | -40.5 | 179.9 | -62.2 | 169.5 | 0 | 0 | 0 | 110.8 | T52 A56 L57 I58 | T52-I54 VanDerWaalsContact C-N 3.35Å; T52-I54 PolarHBondContact O-N 3.46Å; I54-A56 VanDerWaalsContact C-N 3.35Å; I54-A56 PolarHBondContact O-N 3.18Å; I54-L57 PolarHBondContact O-N 2.94Å; I54-I58 HydrophobicContact CG2-CD1 3.86Å; I54-I58 HydrophobicContact CG2-CG1 4.47Å; I54-I58 VanDerWaalsContact O-CG1 3.3Å; I54-I58 WeakPolarHBondContact O-CG1 3.4Å; I54-I58 PolarHBondContact O-N 3.28Å |
| 55 | Q | 87.3 | Confident | 75.5 | Confident | 92 Ų | 92 | 77.2 Ų | 77.2 | 43% | 0.43 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.7 | -42.1 | 174.6 | -73.9 | 171.1 | -24.5 | 0 | 0 | 111.5 | I51 T52 I58 H59 | I51-Q55 HydrophobicContact CB-CB 4.13Å; T52-Q55 PolarHBondContact O-N 3.39Å; T52-Q55 WeakPolarHBondContact OG1-CB 3.35Å; T52-Q55 WeakPolarHBondContact OG1-CG 3.32Å; T52-Q55 PolarHBondContact OG1-N 2.83Å; T52-Q55 PolarHBondContact OG1-OE1 3.35Å; Q55-I58 PolarHBondContact O-N 3.17Å; Q55-H59 WeakPolarHBondContact O-CB 3.33Å; Q55-H59 PolarHBondContact O-CD2 3.41Å; Q55-H59 PolarHBondContact O-N 2.84Å |
| 56 | A | 89 | Confident | 77.7 | Confident | 0 Ų | 0 | 70.1 Ų | 70.1 | 0% | 0 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -62.1 | -44 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | I51 T52 V53 I54 H59 L60 M286 I295 | I51-A56 HydrophobicContact CD1-CB 3.79Å; I51-A56 HydrophobicContact CG1-CB 4.26Å; T52-A56 WeakPolarHBondContact O-CB 3.36Å; T52-A56 PolarHBondContact O-N 2.89Å; V53-A56 PolarHBondContact O-N 3.32Å; I54-A56 VanDerWaalsContact C-N 3.35Å; I54-A56 PolarHBondContact O-N 3.18Å; A56-H59 PolarHBondContact O-N 2.68Å; A56-L60 WeakPolarHBondContact O-CB 3.41Å; A56-L60 PolarHBondContact O-N 3.04Å; A56-M286 HydrophobicContact CB-CE 4.22Å; A56-M286 HydrophobicContact CB-CG 4.07Å; A56-M286 HydrophobicContact CB-SD 3.94Å; A56-I295 HydrophobicContact CB-CD1 4.34Å; A56-I295 HydrophobicContact CB-CG2 4.39Å |
| 57 | L | 90.8 | Very high | 80.2 | Confident | 38 Ų | 38 | 61.1 Ų | 61.1 | 20% | 0.199 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -59.4 | -47.4 | 174.5 | -176.2 | 64.7 | 0 | 0 | 0 | 111.9 | V53 I54 H59 L60 V61 I295 L298 I302 | V53-L57 PolarHBondContact O-N 2.74Å; I54-L57 PolarHBondContact O-N 2.94Å; L57-H59 PolarHBondContact O-N 3.09Å; L57-L60 PolarHBondContact O-N 2.77Å; L57-V61 HydrophobicContact CD1-CG2 4.39Å; L57-V61 WeakPolarHBondContact O-CG2 3.49Å; L57-V61 PolarHBondContact O-N 3.46Å; L57-I295 HydrophobicContact CB-CG2 4Å; L57-I295 HydrophobicContact CD1-CG2 4.16Å; L57-L298 HydrophobicContact CD1-CB 4.39Å; L57-L298 HydrophobicContact CD1-CD2 4.28Å; L57-L298 HydrophobicContact CD1-CG 4.12Å; L57-L298 HydrophobicContact CD2-CD2 3.91Å; L57-L298 HydrophobicContact CD2-CG 4.43Å; L57-I302 HydrophobicContact CD1-CD1 4.44Å |
| 58 | I | 87.3 | Confident | 82.6 | Confident | 104 Ų | 104 | 52 Ų | 52 | 53% | 0.533 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -61.5 | -43.2 | 177.2 | -68.9 | 166.5 | 0 | 0 | 0 | 110.9 | I54 Q55 K62 | I54-I58 HydrophobicContact CG2-CD1 3.86Å; I54-I58 HydrophobicContact CG2-CG1 4.47Å; I54-I58 VanDerWaalsContact O-CG1 3.3Å; I54-I58 WeakPolarHBondContact O-CG1 3.4Å; I54-I58 PolarHBondContact O-N 3.28Å; Q55-I58 PolarHBondContact O-N 3.17Å; I58-K62 WeakPolarHBondContact O-CB 3.43Å; I58-K62 PolarHBondContact O-N 2.99Å |
| 59 | H | 85.9 | Confident | 84.7 | Confident | 73 Ų | 73 | 45.9 Ų | 45.9 | 34% | 0.338 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -66.1 | -37.3 | 177.2 | -78.3 | -59.2 | 0 | 0 | 0 | 113 | Q55 A56 L57 G63 L282 | Q55-H59 WeakPolarHBondContact O-CB 3.33Å; Q55-H59 PolarHBondContact O-CD2 3.41Å; Q55-H59 PolarHBondContact O-N 2.84Å; A56-H59 PolarHBondContact O-N 2.68Å; L57-H59 PolarHBondContact O-N 3.09Å; H59-G63 PolarHBondContact O-N 3.28Å; H59-L282 HydrophobicContact CB-CD1 3.59Å; H59-L282 HydrophobicContact CB-CD2 4.38Å |
| 60 | L | 89.3 | Confident | 86 | Confident | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -66.8 | -49.4 | 176.3 | 179.1 | 64.5 | 0 | 0 | 0 | 111.3 | A56 L57 G63 N64 L282 L296 | A56-L60 WeakPolarHBondContact O-CB 3.41Å; A56-L60 PolarHBondContact O-N 3.04Å; L57-L60 PolarHBondContact O-N 2.77Å; L60-G63 PolarHBondContact O-N 2.94Å; L60-N64 PolarHBondContact O-N 2.91Å; L60-N64 PolarHBondContact O-ND2 3.03Å; L60-L282 HydrophobicContact CB-CD2 3.78Å; L60-L282 HydrophobicContact CD1-CD2 4.4Å; L60-L296 HydrophobicContact CD1-CD1 4.13Å; L60-L296 HydrophobicContact CD2-CD1 4.02Å |
| 61 | V | 88.5 | Confident | 86.8 | Confident | 23 Ų | 23 | 36 Ų | 36 | 14% | 0.139 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.7 | -48.8 | 176.8 | 173 | 0 | 0 | 0 | 0 | 110 | L57 G63 N64 M65 I302 V303 | L57-V61 HydrophobicContact CD1-CG2 4.39Å; L57-V61 WeakPolarHBondContact O-CG2 3.49Å; L57-V61 PolarHBondContact O-N 3.46Å; V61-G63 VanDerWaalsContact C-N 3.27Å; V61-G63 PolarHBondContact O-N 2.87Å; V61-N64 PolarHBondContact O-N 3.5Å; V61-M65 HydrophobicContact CG1-CG 4.22Å; V61-M65 HydrophobicContact CG1-SD 3.6Å; V61-M65 WeakPolarHBondContact O-CG 3.4Å; V61-M65 PolarHBondContact O-N 3.34Å; V61-I302 HydrophobicContact CG2-CG2 4.33Å; V61-V303 HydrophobicContact CG1-CG2 4.45Å; V61-V303 HydrophobicContact CG2-CG2 4.37Å |
| 62 | K | 81.2 | Confident | 87.2 | Confident | 50 Ų | 50 | 34.6 Ų | 34.6 | 22% | 0.217 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -54.5 | -41.1 | 172.9 | 170.1 | 172.6 | 162.7 | 159.7 | 0 | 112.4 | I58 N64 M65 S225 N229 | I58-K62 WeakPolarHBondContact O-CB 3.43Å; I58-K62 PolarHBondContact O-N 2.99Å; K62-N64 PolarHBondContact O-N 3.4Å; K62-M65 PolarHBondContact O-N 3.22Å; K62-M65 VanDerWaalsContact O-N 3.14Å; K62-S225 PolarHBondContact NZ-O 2.96Å; K62-S225 PolarHBondContact NZ-OG 3.49Å; K62-N229 HydrophobicContact CD-CB 3.79Å; K62-N229 WeakPolarHBondContact CD-OD1 3.48Å; K62-N229 WeakPolarHBondContact CE-ND2 3.47Å; K62-N229 WeakPolarHBondContact CE-OD1 3.28Å; K62-N229 HydrophobicContact CG-CB 4.37Å; K62-N229 WeakPolarHBondContact CG-OD1 3.47Å; K62-N229 PolarHBondContact NZ-ND2 3.27Å |
| 63 | G | 79.1 | Confident | 87.4 | Confident | 35 Ų | 35 | 31.9 Ų | 31.9 | 36% | 0.361 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -63.5 | -21.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | H59 L60 V61 | H59-G63 PolarHBondContact O-N 3.28Å; L60-G63 PolarHBondContact O-N 2.94Å; V61-G63 VanDerWaalsContact C-N 3.27Å; V61-G63 PolarHBondContact O-N 2.87Å |
| 64 | N | 84.6 | Confident | 87.7 | Confident | 7 Ų | 7 | 29.4 Ų | 29.4 | 4% | 0.037 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -94.3 | -28.6 | 172.7 | -71.7 | -95.5 | 0 | 0 | 0 | 112 | L60 V61 K62 G66 S275 V303 Y307 | L60-N64 PolarHBondContact O-N 2.91Å; L60-N64 PolarHBondContact O-ND2 3.03Å; V61-N64 PolarHBondContact O-N 3.5Å; K62-N64 PolarHBondContact O-N 3.4Å; N64-G66 PolarHBondContact O-N 3.1Å; N64-S275 VanDerWaalsContact CG-OG 3.29Å; N64-S275 VanDerWaalsContact ND2-CB 3.28Å; N64-S275 WeakPolarHBondContact ND2-CB 3.48Å; N64-S275 PolarHBondContact ND2-OG 2.92Å; N64-S275 WeakPolarHBondContact OD1-CB 3.24Å; N64-S275 PolarHBondContact OD1-OG 3.5Å; N64-V303 HydrophobicContact CB-CB 4.4Å; N64-V303 HydrophobicContact CB-CG1 3.73Å; N64-V303 HydrophobicContact CB-CG2 3.7Å; N64-Y307 PolarHBondContact O-OH 2.89Å |
| 65 | M | 78.2 | Confident | 88.1 | Confident | 28 Ų | 28 | 23.8 Ų | 23.8 | 14% | 0.138 | 13% | 0.132 | C | C | . | . | trans | -76.7 | 61.3 | -177.3 | -66.3 | -176.7 | 73.5 | 0 | 0 | 114.2 | V61 K62 L233 L236 L306 | V61-M65 HydrophobicContact CG1-CG 4.22Å; V61-M65 HydrophobicContact CG1-SD 3.6Å; V61-M65 WeakPolarHBondContact O-CG 3.4Å; V61-M65 PolarHBondContact O-N 3.34Å; K62-M65 PolarHBondContact O-N 3.22Å; K62-M65 VanDerWaalsContact O-N 3.14Å; M65-L233 HydrophobicContact CE-CD1 3.6Å; M65-L233 HydrophobicContact SD-CD1 4.28Å; M65-L236 HydrophobicContact CE-CD2 3.34Å; M65-L306 HydrophobicContact CE-CD2 3.74Å; M65-L306 HydrophobicContact CG-CD2 4.38Å; M65-L306 HydrophobicContact SD-CD2 4.04Å | ||
| 66 | G | 76.8 | Confident | 88.6 | Confident | 15 Ų | 15 | 19.4 Ų | 19.4 | 16% | 0.155 | 11% | 0.112 | C | C | . | . | S | Bend | trans | -92.7 | -152.4 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | N64 G68 I69 | N64-G66 PolarHBondContact O-N 3.1Å; G66-G68 VanDerWaalsContact C-N 3.3Å; G66-G68 PolarHBondContact O-N 3.36Å; G66-I69 WeakPolarHBondContact O-CG2 3.27Å |
| 67 | T | 83 | Confident | 88.9 | Confident | 3 Ų | 3 | 21.9 Ų | 21.9 | 2% | 0.018 | 12% | 0.122 | C | C | . | . | S | Bend | trans | -71.5 | -20.8 | 173.4 | 47.7 | 0 | 0 | 0 | 0 | 113.7 | I69 L70 V161 Y162 F165 I347 | T67-I69 VanDerWaalsContact C-N 3.31Å; T67-I69 PolarHBondContact O-N 2.72Å; T67-L70 WeakPolarHBondContact O-CB 3.35Å; T67-L70 PolarHBondContact O-N 3.1Å; T67-V161 WeakPolarHBondContact OG1-CG1 3.36Å; T67-Y162 HydrophobicContact CG2-CD1 3.69Å; T67-Y162 HydrophobicContact CG2-CE1 3.77Å; T67-Y162 WeakPolarHBondContact OG1-CE1 3.15Å; T67-F165 HydrophobicContact CG2-CB 4.27Å; T67-F165 HydrophobicContact CG2-CD1 4.08Å; T67-F165 HydrophobicContact CG2-CD2 3.91Å; T67-F165 HydrophobicContact CG2-CE1 4.43Å; T67-F165 HydrophobicContact CG2-CE2 4.26Å; T67-F165 HydrophobicContact CG2-CG 3.81Å; T67-I347 HydrophobicContact CG2-CD1 3.63Å; T67-I347 HydrophobicContact CG2-CG1 4.01Å |
| 68 | G | 86.2 | Confident | 89.2 | Confident | 4 Ų | 4 | 21 Ų | 21 | 4% | 0.041 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -53.1 | -45.5 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | G66 L70 G71 L72 S272 | G66-G68 VanDerWaalsContact C-N 3.3Å; G66-G68 PolarHBondContact O-N 3.36Å; G68-L70 PolarHBondContact O-N 3.12Å; G68-L70 VanDerWaalsContact O-N 3.12Å; G68-G71 PolarHBondContact O-N 2.73Å; G68-L72 PolarHBondContact O-N 3.19Å; G68-S272 WeakPolarHBondContact CA-OG 3.41Å; G68-S272 PolarHBondContact O-OG 3.4Å |
| 69 | I | 92.7 | Very high | 89.6 | Confident | 3 Ų | 3 | 16.2 Ų | 16.2 | 2% | 0.015 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -54.8 | -33 | 176.9 | -167.9 | 172.5 | 0 | 0 | 0 | 113.7 | G66 T67 L72 L236 L306 Y307 I310 | G66-I69 WeakPolarHBondContact O-CG2 3.27Å; T67-I69 VanDerWaalsContact C-N 3.31Å; T67-I69 PolarHBondContact O-N 2.72Å; I69-L72 HydrophobicContact CG1-CD1 4.46Å; I69-L72 PolarHBondContact O-N 3.49Å; I69-L236 HydrophobicContact CD1-CD1 4.07Å; I69-L236 HydrophobicContact CD1-CD2 3.65Å; I69-L306 HydrophobicContact CD1-CD1 4.46Å; I69-L306 HydrophobicContact CD1-CD2 3.7Å; I69-L306 HydrophobicContact CD1-CG 3.67Å; I69-Y307 HydrophobicContact CB-CD1 4.23Å; I69-Y307 HydrophobicContact CB-CE1 3.9Å; I69-Y307 HydrophobicContact CD1-CD1 4.01Å; I69-Y307 HydrophobicContact CD1-CE1 4.11Å; I69-Y307 HydrophobicContact CG1-CD1 3.9Å; I69-Y307 HydrophobicContact CG1-CE1 4.04Å; I69-I310 HydrophobicContact CD1-CB 4.48Å; I69-I310 HydrophobicContact CD1-CG1 4.23Å; I69-I310 HydrophobicContact CG1-CB 4.32Å; I69-I310 HydrophobicContact CG1-CG2 4.17Å |
| 70 | L | 92.6 | Very high | 90 | Very high | 0 Ų | 0 | 12.7 Ų | 12.7 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -77 | -24.2 | -179.6 | -58.8 | 177.6 | 0 | 0 | 0 | 112.3 | T67 G68 F165 L236 I239 S325 I326 Y343 | T67-L70 WeakPolarHBondContact O-CB 3.35Å; T67-L70 PolarHBondContact O-N 3.1Å; G68-L70 PolarHBondContact O-N 3.12Å; G68-L70 VanDerWaalsContact O-N 3.12Å; L70-F165 HydrophobicContact CD1-CE2 3.49Å; L70-F165 VanDerWaalsContact CD1-CE2 3.49Å; L70-F165 HydrophobicContact CD1-CZ 3.56Å; L70-L236 HydrophobicContact CD2-CD1 4.32Å; L70-I239 HydrophobicContact CD2-CD1 4.07Å; L70-S325 WeakPolarHBondContact CB-OG 3.38Å; L70-S325 CarbonylContact O-C 3.38Å; L70-S325 WeakPolarHBondContact O-CA 3.11Å; L70-I326 WeakPolarHBondContact O-CG1 3.37Å; L70-I326 PolarHBondContact O-N 3.02Å; L70-Y343 HydrophobicContact CD1-CD1 4.03Å; L70-Y343 HydrophobicContact CD1-CE1 3.76Å; L70-Y343 HydrophobicContact CG-CE1 4.5Å |
| 71 | G | 93.7 | Very high | 90.3 | Very high | 4 Ų | 4 | 14 Ų | 14 | 4% | 0.041 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -84.7 | -14 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | G68 S73 L74 A75 | G68-G71 PolarHBondContact O-N 2.73Å; G71-S73 VanDerWaalsContact C-N 3.28Å; G71-S73 PolarHBondContact O-N 2.89Å; G71-L74 PolarHBondContact O-N 2.98Å; G71-L74 VanDerWaalsContact O-N 3.16Å; G71-A75 PolarHBondContact O-N 2.74Å; G71-A75 VanDerWaalsContact O-N 3.12Å |
| 72 | L | 96.2 | Very high | 90.5 | Very high | 0 Ų | 0 | 17.7 Ų | 17.7 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -62.2 | -27.7 | -173.9 | -75.4 | 178.7 | 0 | 0 | 0 | 114.6 | G68 I69 A75 V76 L88 S272 Y307 | G68-L72 PolarHBondContact O-N 3.19Å; I69-L72 HydrophobicContact CG1-CD1 4.46Å; I69-L72 PolarHBondContact O-N 3.49Å; L72-A75 HydrophobicContact CD2-CB 4.47Å; L72-A75 WeakPolarHBondContact O-CB 3.44Å; L72-A75 PolarHBondContact O-N 2.71Å; L72-V76 WeakPolarHBondContact O-CG2 3.22Å; L72-V76 PolarHBondContact O-N 3.35Å; L72-L88 HydrophobicContact CD2-CD2 3.89Å; L72-S272 WeakPolarHBondContact CD2-OG 3.36Å; L72-Y307 VanDerWaalsContact CD1-CB 3.42Å; L72-Y307 HydrophobicContact CD1-CD1 3.69Å; L72-Y307 HydrophobicContact CD1-CD2 3.79Å; L72-Y307 HydrophobicContact CD1-CE1 4.38Å; L72-Y307 HydrophobicContact CD1-CE2 4.47Å; L72-Y307 HydrophobicContact CD1-CG 3.35Å |
| 73 | S | 96.1 | Very high | 91.3 | Very high | 0 Ų | 0 | 17.5 Ų | 17.5 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -69.7 | -36.7 | 176.4 | -62.9 | 0 | 0 | 0 | 0 | 113 | G71 A75 V76 K77 I310 G311 G314 I326 | G71-S73 VanDerWaalsContact C-N 3.28Å; G71-S73 PolarHBondContact O-N 2.89Å; S73-A75 VanDerWaalsContact C-N 3.31Å; S73-V76 PolarHBondContact O-N 3.49Å; S73-K77 PolarHBondContact O-N 2.84Å; S73-I310 PolarHBondContact OG-O 2.69Å; S73-I310 VanDerWaalsContact OG-O 3.09Å; S73-G311 WeakPolarHBondContact CA-O 3.47Å; S73-G311 WeakPolarHBondContact CB-O 3.2Å; S73-G311 PolarHBondContact OG-O 3.19Å; S73-G314 VanDerWaalsContact OG-CA 3.3Å; S73-G314 WeakPolarHBondContact OG-CA 3.39Å; S73-I326 VanDerWaalsContact OG-CD1 3.26Å; S73-I326 WeakPolarHBondContact OG-CD1 3.41Å |
| 74 | L | 95.9 | Very high | 92.1 | Very high | 20 Ų | 20 | 15.9 Ų | 15.9 | 11% | 0.105 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -67.8 | -35.6 | 169.9 | 177.9 | 61.7 | 0 | 0 | 0 | 110.8 | G71 K77 N78 I322 A324 D401 | G71-L74 PolarHBondContact O-N 2.98Å; G71-L74 VanDerWaalsContact O-N 3.16Å; L74-K77 HydrophobicContact CD1-CB 4.48Å; L74-K77 HydrophobicContact CD1-CD 4.18Å; L74-K77 WeakPolarHBondContact O-CB 3.36Å; L74-K77 PolarHBondContact O-N 3.19Å; L74-N78 PolarHBondContact O-N 2.94Å; L74-I322 HydrophobicContact CB-CG1 4.46Å; L74-I322 HydrophobicContact CD1-CG2 4.12Å; L74-A324 HydrophobicContact CD2-CB 4.34Å; L74-D401 HydrophobicContact CD2-CB 3.53Å |
| 75 | A | 96.6 | Very high | 92.7 | Very high | 1 Ų | 1 | 16.7 Ų | 16.7 | 1% | 0.008 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -59.7 | -47.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | G71 L72 S73 K77 N78 A79 F265 T268 | G71-A75 PolarHBondContact O-N 2.74Å; G71-A75 VanDerWaalsContact O-N 3.12Å; L72-A75 HydrophobicContact CD2-CB 4.47Å; L72-A75 WeakPolarHBondContact O-CB 3.44Å; L72-A75 PolarHBondContact O-N 2.71Å; S73-A75 VanDerWaalsContact C-N 3.31Å; A75-K77 VanDerWaalsContact C-N 3.32Å; A75-K77 PolarHBondContact O-N 3.13Å; A75-N78 WeakPolarHBondContact O-CA 3.38Å; A75-N78 WeakPolarHBondContact O-CB 3.47Å; A75-N78 PolarHBondContact O-N 3.34Å; A75-A79 PolarHBondContact O-N 3.2Å; A75-A79 VanDerWaalsContact O-N 3.14Å; A75-F265 HydrophobicContact CB-CD2 3.73Å; A75-F265 HydrophobicContact CB-CE2 4.42Å; A75-F265 VanDerWaalsContact O-CD2 3.25Å; A75-F265 WeakPolarHBondContact O-CD2 3.31Å; A75-T268 HydrophobicContact CB-CG2 3.67Å |
| 76 | V | 97.2 | Very high | 93.7 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -62.2 | -38.1 | 177.2 | 175.1 | 0 | 0 | 0 | 0 | 111.2 | L72 S73 N78 A79 G80 L88 Y315 | L72-V76 WeakPolarHBondContact O-CG2 3.22Å; L72-V76 PolarHBondContact O-N 3.35Å; S73-V76 PolarHBondContact O-N 3.49Å; V76-N78 VanDerWaalsContact C-N 3.31Å; V76-N78 PolarHBondContact O-N 2.94Å; V76-A79 PolarHBondContact O-N 2.83Å; V76-G80 CarbonylContact O-C 3.59Å; V76-G80 PolarHBondContact O-N 2.88Å; V76-L88 HydrophobicContact CG2-CD1 3.9Å; V76-Y315 HydrophobicContact CG1-CD1 3.82Å; V76-Y315 HydrophobicContact CG1-CG 4.32Å |
| 77 | K | 95.9 | Very high | 94.6 | Very high | 51 Ų | 51 | 19.6 Ų | 19.6 | 22% | 0.222 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -55.8 | -44.8 | 168.9 | 176.7 | 174 | 171.4 | -171 | 0 | 112.3 | S73 L74 A75 A79 A257 Y315 D320 I322 | S73-K77 PolarHBondContact O-N 2.84Å; L74-K77 HydrophobicContact CD1-CB 4.48Å; L74-K77 HydrophobicContact CD1-CD 4.18Å; L74-K77 WeakPolarHBondContact O-CB 3.36Å; L74-K77 PolarHBondContact O-N 3.19Å; A75-K77 VanDerWaalsContact C-N 3.32Å; A75-K77 PolarHBondContact O-N 3.13Å; K77-A79 PolarHBondContact O-N 3.34Å; K77-A257 WeakPolarHBondContact O-CB 3.49Å; K77-Y315 HydrophobicContact CB-CD2 3.59Å; K77-Y315 HydrophobicContact CB-CE2 3.45Å; K77-Y315 VanDerWaalsContact CB-CE2 3.45Å; K77-Y315 HydrophobicContact CB-CG 4.22Å; K77-Y315 HydrophobicContact CD-CE2 4.02Å; K77-Y315 HydrophobicContact CG-CD2 4.18Å; K77-Y315 HydrophobicContact CG-CE2 3.56Å; K77-D320 VanDerWaalsContact CE-OD1 3.25Å; K77-D320 WeakPolarHBondContact CE-OD1 3.38Å; K77-D320 PolarHBondContact NZ-O 3.25Å; K77-D320 IonicContact NZ-OD1 3.55Å; K77-I322 HydrophobicContact CB-CG2 4.03Å; K77-I322 HydrophobicContact CD-CG2 3.38Å; K77-I322 HydrophobicContact CG-CG2 4.32Å |
| 78 | N | 95.3 | Very high | 95.3 | Very high | 21 Ų | 21 | 19.4 Ų | 19.4 | 11% | 0.112 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -68.6 | -16.2 | -179.2 | -72.4 | -13.9 | 0 | 0 | 0 | 114.2 | L74 A75 V76 T261 Y262 F265 | L74-N78 PolarHBondContact O-N 2.94Å; A75-N78 WeakPolarHBondContact O-CA 3.38Å; A75-N78 WeakPolarHBondContact O-CB 3.47Å; A75-N78 PolarHBondContact O-N 3.34Å; V76-N78 VanDerWaalsContact C-N 3.31Å; V76-N78 PolarHBondContact O-N 2.94Å; N78-T261 CarbonylContact O-C 3.52Å; N78-T261 WeakPolarHBondContact O-CB 3.28Å; N78-T261 PolarHBondContact O-OG1 2.75Å; N78-Y262 PolarHBondContact O-N 3.06Å; N78-F265 HydrophobicContact CB-CB 4.25Å |
| 79 | A | 96.1 | Very high | 95.9 | Very high | 2 Ų | 2 | 23 Ų | 23 | 2% | 0.017 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -106.6 | -28.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | A75 V76 K77 M83 A257 Y262 F265 | A75-A79 PolarHBondContact O-N 3.2Å; A75-A79 VanDerWaalsContact O-N 3.14Å; V76-A79 PolarHBondContact O-N 2.83Å; K77-A79 PolarHBondContact O-N 3.34Å; A79-M83 WeakPolarHBondContact O-CB 3.45Å; A79-A257 VanDerWaalsContact C-CB 3.41Å; A79-A257 PolarHBondContact O-N 3.16Å; A79-Y262 HydrophobicContact CB-CD2 4.11Å; A79-Y262 HydrophobicContact CB-CE2 4.38Å; A79-F265 HydrophobicContact CB-CB 4.03Å; A79-F265 HydrophobicContact CB-CD1 4.12Å; A79-F265 HydrophobicContact CB-CD2 3.84Å; A79-F265 HydrophobicContact CB-CE2 4.38Å; A79-F265 HydrophobicContact CB-CG 3.69Å |
| 80 | G | 95.1 | Very high | 96.1 | Very high | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 14% | 0.14 | C | C | . | . | trans | 103.5 | 156.7 | -172.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | V76 L82 M83 G84 P254 L255 | V76-G80 CarbonylContact O-C 3.59Å; V76-G80 PolarHBondContact O-N 2.88Å; G80-L82 VanDerWaalsContact C-N 3.28Å; G80-L82 PolarHBondContact O-N 3.42Å; G80-M83 PolarHBondContact O-N 2.92Å; G80-G84 WeakPolarHBondContact O-CA 3.16Å; G80-G84 PolarHBondContact O-N 3.39Å; G80-P254 CarbonylContact C-O 3.59Å; G80-P254 VanDerWaalsContact CA-O 3.25Å; G80-P254 WeakPolarHBondContact CA-O 3.5Å; G80-L255 CarbonylContact C-O 3.55Å | ||
| 81 | I | 94.4 | Very high | 96.3 | Very high | 26 Ų | 26 | 26.3 Ų | 26.3 | 13% | 0.133 | 14% | 0.141 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -24.8 | -168.8 | -170.9 | 62 | 0 | 0 | 0 | 113.9 | P85 L253 P254 L255 T312 Y315 L316 | I81-P85 WeakPolarHBondContact O-CD 3.43Å; I81-P85 WeakPolarHBondContact O-CG 3.48Å; I81-L253 HydrophobicContact CB-CB 4.46Å; I81-L253 HydrophobicContact CG2-CB 4.26Å; I81-P254 PolarHBondContact N-O 3.48Å; I81-L255 PolarHBondContact N-O 3.24Å; I81-T312 HydrophobicContact CD1-CG2 3.61Å; I81-Y315 HydrophobicContact CB-CD1 4.23Å; I81-Y315 HydrophobicContact CB-CE1 4.09Å; I81-Y315 HydrophobicContact CD1-CD1 3.84Å; I81-L316 HydrophobicContact CD1-CD1 4.46Å; I81-L316 HydrophobicContact CD1-CD2 3.58Å; I81-L316 HydrophobicContact CD1-CG 3.7Å; I81-L316 HydrophobicContact CG1-CD2 3.93Å |
| 82 | L | 94.5 | Very high | 96.5 | Very high | 102 Ų | 102 | 26.1 Ų | 26.1 | 53% | 0.534 | 14% | 0.139 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -94.9 | -46.6 | 174.5 | 178.9 | 64 | 0 | 0 | 0 | 111.6 | G80 P85 L86 L255 | G80-L82 VanDerWaalsContact C-N 3.28Å; G80-L82 PolarHBondContact O-N 3.42Å; L82-P85 WeakPolarHBondContact O-CD 3.48Å; L82-P85 WeakPolarHBondContact O-CG 3.4Å; L82-L86 WeakPolarHBondContact O-CB 3.34Å; L82-L86 PolarHBondContact O-N 3.32Å; L82-L255 HydrophobicContact CB-CB 4.15Å; L82-L255 WeakPolarHBondContact CB-O 3.33Å; L82-L255 HydrophobicContact CD2-CD2 4.33Å; L82-L255 PolarHBondContact N-O 3.12Å |
| 83 | M | 96 | Very high | 96.5 | Very high | 46 Ų | 46 | 31.5 Ų | 31.5 | 23% | 0.227 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -69.9 | -35.1 | -175.2 | -171.2 | 61.8 | -178.9 | 0 | 0 | 112.4 | A79 G80 S87 L255 V256 Y262 | A79-M83 WeakPolarHBondContact O-CB 3.45Å; G80-M83 PolarHBondContact O-N 2.92Å; M83-S87 WeakPolarHBondContact O-CB 3.45Å; M83-S87 PolarHBondContact O-N 3.06Å; M83-S87 PolarHBondContact O-OG 3Å; M83-L255 PolarHBondContact N-O 3.49Å; M83-L255 VanDerWaalsContact N-O 3.16Å; M83-V256 HydrophobicContact CB-CG1 4.27Å; M83-V256 HydrophobicContact CB-CG2 4.31Å; M83-V256 HydrophobicContact CG-CG1 4.48Å; M83-Y262 HydrophobicContact CE-CE2 3.94Å; M83-Y262 HydrophobicContact CG-CE2 4.1Å |
| 84 | G | 97.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -56.2 | -62.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | G80 L86 S87 L88 | G80-G84 WeakPolarHBondContact O-CA 3.16Å; G80-G84 PolarHBondContact O-N 3.39Å; G84-L86 PolarHBondContact O-N 3.4Å; G84-S87 PolarHBondContact O-N 2.95Å; G84-L88 WeakPolarHBondContact O-CG 3.48Å; G84-L88 PolarHBondContact O-N 3.02Å |
| 85 | P | 97.5 | Very high | 96.6 | Very high | 25 Ų | 25 | 32 Ų | 32 | 16% | 0.162 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.9 | -37.4 | -179.8 | 21.7 | -32.4 | 0 | 0 | 0 | 113.6 | I81 L82 S87 L88 L89 I308 | I81-P85 WeakPolarHBondContact O-CD 3.43Å; I81-P85 WeakPolarHBondContact O-CG 3.48Å; L82-P85 WeakPolarHBondContact O-CD 3.48Å; L82-P85 WeakPolarHBondContact O-CG 3.4Å; P85-S87 VanDerWaalsContact C-N 3.33Å; P85-S87 PolarHBondContact O-N 3.02Å; P85-L88 PolarHBondContact O-N 2.71Å; P85-L89 PolarHBondContact O-N 3.28Å; P85-I308 HydrophobicContact CB-CG2 3.93Å |
| 86 | L | 97.9 | Very high | 96.6 | Very high | 97 Ų | 97 | 32.8 Ų | 32.8 | 51% | 0.508 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -60.3 | -45.2 | 174 | 177.5 | 64 | 0 | 0 | 0 | 111 | L82 G84 L89 V90 | L82-L86 WeakPolarHBondContact O-CB 3.34Å; L82-L86 PolarHBondContact O-N 3.32Å; G84-L86 PolarHBondContact O-N 3.4Å; L86-L89 WeakPolarHBondContact O-CB 3.46Å; L86-L89 PolarHBondContact O-N 3.35Å; L86-V90 WeakPolarHBondContact O-CG2 3.23Å; L86-V90 PolarHBondContact O-N 2.98Å; L86-V90 VanDerWaalsContact O-N 3.09Å |
| 87 | S | 97.1 | Very high | 96.6 | Very high | 6 Ų | 6 | 35.7 Ų | 35.7 | 4% | 0.042 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -69.6 | -38.6 | 179.5 | -55.3 | 0 | 0 | 0 | 0 | 111.5 | M83 G84 P85 L89 V90 M91 Y262 F265 | M83-S87 WeakPolarHBondContact O-CB 3.45Å; M83-S87 PolarHBondContact O-N 3.06Å; M83-S87 PolarHBondContact O-OG 3Å; G84-S87 PolarHBondContact O-N 2.95Å; P85-S87 VanDerWaalsContact C-N 3.33Å; P85-S87 PolarHBondContact O-N 3.02Å; S87-L89 VanDerWaalsContact C-N 3.3Å; S87-L89 PolarHBondContact O-N 3.22Å; S87-V90 PolarHBondContact O-N 3.09Å; S87-M91 WeakPolarHBondContact O-CB 3.28Å; S87-M91 VanDerWaalsContact O-CG 3.25Å; S87-M91 WeakPolarHBondContact O-CG 3.49Å; S87-M91 PolarHBondContact O-N 3.42Å; S87-Y262 PolarHBondContact OG-OH 3.29Å; S87-F265 VanDerWaalsContact CB-CZ 3.47Å |
| 88 | L | 97.9 | Very high | 96.6 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -60 | -39 | 173.3 | -72.8 | 176.7 | 0 | 0 | 0 | 112.2 | L72 V76 G84 P85 G92 F265 A269 F273 I308 | L72-L88 HydrophobicContact CD2-CD2 3.89Å; V76-L88 HydrophobicContact CG2-CD1 3.9Å; G84-L88 WeakPolarHBondContact O-CG 3.48Å; G84-L88 PolarHBondContact O-N 3.02Å; P85-L88 PolarHBondContact O-N 2.71Å; L88-G92 PolarHBondContact O-N 3.29Å; L88-F265 HydrophobicContact CD2-CE2 3.73Å; L88-F265 HydrophobicContact CD2-CZ 3.84Å; L88-F265 HydrophobicContact CG-CE2 3.78Å; L88-F265 HydrophobicContact CG-CZ 3.88Å; L88-A269 HydrophobicContact CD2-CB 3.76Å; L88-F273 HydrophobicContact CD2-CE2 4.31Å; L88-F273 WeakPolarHBondContact O-CE2 3.41Å; L88-I308 HydrophobicContact CB-CG1 3.79Å; L88-I308 HydrophobicContact CD1-CG1 4.47Å |
| 89 | L | 98.3 | Very high | 96.7 | Very high | 78 Ų | 78 | 32.4 Ų | 32.4 | 41% | 0.408 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -62.8 | -48.8 | 174.1 | -178.5 | 61.3 | 0 | 0 | 0 | 111.4 | P85 L86 S87 G92 L93 T304 I308 | P85-L89 PolarHBondContact O-N 3.28Å; L86-L89 WeakPolarHBondContact O-CB 3.46Å; L86-L89 PolarHBondContact O-N 3.35Å; S87-L89 VanDerWaalsContact C-N 3.3Å; S87-L89 PolarHBondContact O-N 3.22Å; L89-G92 PolarHBondContact O-N 3.47Å; L89-L93 HydrophobicContact CD1-CD1 4.44Å; L89-L93 HydrophobicContact CG-CD1 4.31Å; L89-L93 VanDerWaalsContact O-CG 3.32Å; L89-L93 WeakPolarHBondContact O-CG 3.35Å; L89-L93 PolarHBondContact O-N 3.35Å; L89-T304 HydrophobicContact CD1-CG2 4.12Å; L89-I308 HydrophobicContact CB-CD1 3.8Å; L89-I308 HydrophobicContact CD1-CD1 4.18Å |
| 90 | V | 97.6 | Very high | 96.7 | Very high | 68 Ų | 68 | 33.8 Ų | 33.8 | 41% | 0.412 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -61.9 | -47.7 | 178.6 | 172 | 0 | 0 | 0 | 0 | 111.3 | L86 S87 G92 L93 I94 | L86-V90 WeakPolarHBondContact O-CG2 3.23Å; L86-V90 PolarHBondContact O-N 2.98Å; L86-V90 VanDerWaalsContact O-N 3.09Å; S87-V90 PolarHBondContact O-N 3.09Å; V90-G92 VanDerWaalsContact C-N 3.34Å; V90-G92 PolarHBondContact O-N 3.23Å; V90-L93 PolarHBondContact O-N 2.95Å; V90-I94 HydrophobicContact CG1-CD1 3.72Å; V90-I94 HydrophobicContact CG1-CG1 4.44Å; V90-I94 VanDerWaalsContact O-CG1 3.29Å; V90-I94 WeakPolarHBondContact O-CG1 3.44Å; V90-I94 PolarHBondContact O-N 3.17Å |
| 91 | M | 96.4 | Very high | 96.7 | Very high | 5 Ų | 5 | 33.8 Ų | 33.8 | 3% | 0.025 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64.2 | -38 | 178.7 | -62.3 | -43.6 | -64.4 | 0 | 0 | 111.9 | S87 I94 A95 F266 I270 F273 L417 | S87-M91 WeakPolarHBondContact O-CB 3.28Å; S87-M91 VanDerWaalsContact O-CG 3.25Å; S87-M91 WeakPolarHBondContact O-CG 3.49Å; S87-M91 PolarHBondContact O-N 3.42Å; M91-I94 PolarHBondContact O-N 3.28Å; M91-A95 VanDerWaalsContact O-CB 3.26Å; M91-A95 WeakPolarHBondContact O-CB 3.4Å; M91-A95 PolarHBondContact O-N 3.44Å; M91-F266 HydrophobicContact CE-CD2 4.08Å; M91-F266 HydrophobicContact CE-CE2 3.54Å; M91-F266 HydrophobicContact CE-CZ 4.35Å; M91-F266 HydrophobicContact SD-CD2 4.47Å; M91-F266 HydrophobicContact SD-CE2 4.36Å; M91-I270 HydrophobicContact CE-CD1 3.45Å; M91-I270 VanDerWaalsContact CE-CD1 3.45Å; M91-I270 HydrophobicContact CE-CG1 3.78Å; M91-F273 HydrophobicContact CB-CD2 4.27Å; M91-F273 HydrophobicContact CB-CE2 4.23Å; M91-L417 HydrophobicContact CE-CD1 3.92Å |
| 92 | G | 96.6 | Very high | 96.8 | Very high | 1 Ų | 1 | 32.6 Ų | 32.6 | 1% | 0.01 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -64.9 | -40.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | L88 L89 V90 C96 F273 | L88-G92 PolarHBondContact O-N 3.29Å; L89-G92 PolarHBondContact O-N 3.47Å; V90-G92 VanDerWaalsContact C-N 3.34Å; V90-G92 PolarHBondContact O-N 3.23Å; G92-C96 VanDerWaalsContact O-CB 3.23Å; G92-C96 WeakPolarHBondContact O-CB 3.08Å; G92-C96 PolarHBondContact O-N 3.18Å; G92-F273 VanDerWaalsContact CA-CZ 3.41Å |
| 93 | L | 97.3 | Very high | 96.8 | Very high | 113 Ų | 113 | 27.8 Ų | 27.8 | 59% | 0.592 | 15% | 0.148 | S | C | * | . | H | α-helix | trans | -64.7 | -44.7 | 173.7 | -71.2 | 172.1 | 0 | 0 | 0 | 111.9 | L89 V90 C96 H97 | L89-L93 HydrophobicContact CD1-CD1 4.44Å; L89-L93 HydrophobicContact CG-CD1 4.31Å; L89-L93 VanDerWaalsContact O-CG 3.32Å; L89-L93 WeakPolarHBondContact O-CG 3.35Å; L89-L93 PolarHBondContact O-N 3.35Å; V90-L93 PolarHBondContact O-N 2.95Å; L93-C96 PolarHBondContact O-N 3.45Å; L93-H97 WeakPolarHBondContact O-CB 3.2Å; L93-H97 PolarHBondContact O-N 2.89Å |
| 94 | I | 96.9 | Very high | 96.8 | Very high | 28 Ų | 28 | 30 Ų | 30 | 14% | 0.144 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -64.7 | -46.8 | 177.7 | -65.7 | 168.8 | 0 | 0 | 0 | 110.7 | V90 M91 C96 H97 C98 L417 I444 L447 | V90-I94 HydrophobicContact CG1-CD1 3.72Å; V90-I94 HydrophobicContact CG1-CG1 4.44Å; V90-I94 VanDerWaalsContact O-CG1 3.29Å; V90-I94 WeakPolarHBondContact O-CG1 3.44Å; V90-I94 PolarHBondContact O-N 3.17Å; M91-I94 PolarHBondContact O-N 3.28Å; I94-C96 PolarHBondContact O-N 3.02Å; I94-H97 WeakPolarHBondContact O-CB 3.43Å; I94-H97 PolarHBondContact O-N 3.19Å; I94-H97 VanDerWaalsContact O-N 3.17Å; I94-C98 PolarHBondContact O-N 2.91Å; I94-C98 PolarHBondContact O-SG 2.86Å; I94-L417 HydrophobicContact CG2-CD2 3.54Å; I94-I444 HydrophobicContact CG2-CD1 4.48Å; I94-I444 HydrophobicContact CG2-CG1 4.29Å; I94-I444 HydrophobicContact CG2-CG2 3.65Å; I94-L447 HydrophobicContact CD1-CD2 3.87Å |
| 95 | A | 95.9 | Very high | 96.6 | Very high | 1 Ų | 1 | 30 Ų | 30 | 1% | 0.008 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -60.3 | -44.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | M91 H97 C98 M99 F273 | M91-A95 VanDerWaalsContact O-CB 3.26Å; M91-A95 WeakPolarHBondContact O-CB 3.4Å; M91-A95 PolarHBondContact O-N 3.44Å; A95-H97 PolarHBondContact O-N 3.3Å; A95-C98 PolarHBondContact O-N 3.48Å; A95-M99 HydrophobicContact CB-CE 4.47Å; A95-M99 VanDerWaalsContact O-CG 3.31Å; A95-M99 WeakPolarHBondContact O-CG 3.39Å; A95-M99 PolarHBondContact O-N 2.99Å; A95-F273 HydrophobicContact CB-CB 3.94Å; A95-F273 HydrophobicContact CB-CG 4.38Å |
| 96 | C | 96.6 | Very high | 96.5 | Very high | 18 Ų | 18 | 29 Ų | 29 | 12% | 0.122 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -58.3 | -46.7 | 173.4 | -173.6 | 0 | 0 | 0 | 0 | 111.5 | G92 L93 I94 C98 M99 H100 M300 | G92-C96 VanDerWaalsContact O-CB 3.23Å; G92-C96 WeakPolarHBondContact O-CB 3.08Å; G92-C96 PolarHBondContact O-N 3.18Å; L93-C96 PolarHBondContact O-N 3.45Å; I94-C96 PolarHBondContact O-N 3.02Å; C96-C98 PolarHBondContact O-N 3.23Å; C96-M99 PolarHBondContact O-N 3.48Å; C96-H100 PolarHBondContact O-CD2 3.45Å; C96-H100 VanDerWaalsContact O-CD2 3.23Å; C96-H100 PolarHBondContact O-N 2.94Å; C96-M300 HydrophobicContact CB-CB 3.95Å; C96-M300 HydrophobicContact CB-CG 4.2Å |
| 97 | H | 97.1 | Very high | 96.2 | Very high | 61 Ų | 61 | 26.7 Ų | 26.7 | 28% | 0.282 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -59.6 | -43.7 | 176.7 | -175.5 | 77 | 0 | 0 | 0 | 112.4 | L93 I94 A95 H100 I101 E424 K440 | L93-H97 WeakPolarHBondContact O-CB 3.2Å; L93-H97 PolarHBondContact O-N 2.89Å; I94-H97 WeakPolarHBondContact O-CB 3.43Å; I94-H97 PolarHBondContact O-N 3.19Å; I94-H97 VanDerWaalsContact O-N 3.17Å; A95-H97 PolarHBondContact O-N 3.3Å; H97-H100 CarbonylContact O-C 3.55Å; H97-H100 WeakPolarHBondContact O-CB 3.48Å; H97-H100 PolarHBondContact O-N 3.4Å; H97-I101 WeakPolarHBondContact NE2-CD1 3.39Å; H97-I101 WeakPolarHBondContact O-CG1 3.02Å; H97-I101 PolarHBondContact O-N 3.16Å; H97-E424 IonicContact NE2-OE2 2.87Å; H97-K440 PolarHBondContact NE2-NZ 2.9Å |
| 98 | C | 97.2 | Very high | 96 | Very high | 1 Ų | 1 | 30.3 Ų | 30.3 | 1% | 0.007 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -64.3 | -38.4 | 176.3 | -73.9 | 0 | 0 | 0 | 0 | 113.4 | I94 A95 C96 H100 I101 L102 A416 P420 | I94-C98 PolarHBondContact O-N 2.91Å; I94-C98 PolarHBondContact O-SG 2.86Å; A95-C98 PolarHBondContact O-N 3.48Å; C96-C98 PolarHBondContact O-N 3.23Å; C98-H100 VanDerWaalsContact C-N 3.34Å; C98-I101 WeakPolarHBondContact O-CB 3.29Å; C98-I101 PolarHBondContact O-N 3.27Å; C98-L102 PolarHBondContact O-N 2.98Å; C98-A416 WeakPolarHBondContact CB-O 3.5Å; C98-A416 PolarHBondContact SG-O 3.08Å; C98-P420 HydrophobicContact CB-CB 3.99Å; C98-P420 HydrophobicContact CB-CG 4.1Å |
| 99 | M | 96.3 | Very high | 95.7 | Very high | 2 Ų | 2 | 30.8 Ų | 30.8 | 1% | 0.01 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -64.8 | -39 | 172.7 | -65.4 | 173.9 | -164.5 | 0 | 0 | 111.3 | A95 C96 L102 V103 F273 S275 I276 V279 L296 M300 | A95-M99 HydrophobicContact CB-CE 4.47Å; A95-M99 VanDerWaalsContact O-CG 3.31Å; A95-M99 WeakPolarHBondContact O-CG 3.39Å; A95-M99 PolarHBondContact O-N 2.99Å; C96-M99 PolarHBondContact O-N 3.48Å; M99-L102 PolarHBondContact O-N 3.35Å; M99-V103 WeakPolarHBondContact O-CG2 3.49Å; M99-V103 PolarHBondContact O-N 3.21Å; M99-F273 VanDerWaalsContact CE-O 3.28Å; M99-F273 WeakPolarHBondContact CE-O 3.34Å; M99-S275 VanDerWaalsContact CE-OG 3.23Å; M99-S275 WeakPolarHBondContact CE-OG 3.31Å; M99-I276 HydrophobicContact CG-CB 4.37Å; M99-I276 HydrophobicContact CG-CG1 4.24Å; M99-V279 HydrophobicContact CB-CG1 4.46Å; M99-V279 HydrophobicContact CB-CG2 4.21Å; M99-V279 HydrophobicContact CG-CG2 3.92Å; M99-V279 HydrophobicContact SD-CG2 3.78Å; M99-L296 HydrophobicContact CB-CD1 4.08Å; M99-L296 HydrophobicContact CB-CD2 3.78Å; M99-L296 HydrophobicContact CB-CG 4.4Å; M99-L296 HydrophobicContact SD-CD1 3.99Å; M99-M300 HydrophobicContact CE-CE 3.75Å; M99-M300 HydrophobicContact CE-SD 4.19Å; M99-M300 HydrophobicContact SD-CE 4.05Å; M99-M300 HydrophobicContact SD-CG 4.23Å; M99-M300 HydrophobicContact SD-SD 3.86Å |
| 100 | H | 96.5 | Very high | 95.3 | Very high | 32 Ų | 32 | 28.3 Ų | 28.3 | 15% | 0.148 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -65 | -35.7 | 172.5 | -86.3 | -77.6 | 0 | 0 | 0 | 113.5 | C96 H97 C98 R104 P293 S297 | C96-H100 PolarHBondContact O-CD2 3.45Å; C96-H100 VanDerWaalsContact O-CD2 3.23Å; C96-H100 PolarHBondContact O-N 2.94Å; H97-H100 CarbonylContact O-C 3.55Å; H97-H100 WeakPolarHBondContact O-CB 3.48Å; H97-H100 PolarHBondContact O-N 3.4Å; C98-H100 VanDerWaalsContact C-N 3.34Å; H100-R104 WeakPolarHBondContact O-CB 3.44Å; H100-R104 VanDerWaalsContact O-CG 3.25Å; H100-R104 WeakPolarHBondContact O-CG 3.49Å; H100-R104 PolarHBondContact O-N 3.33Å; H100-R104 VanDerWaalsContact O-N 3.08Å; H100-R104 PolarHBondContact O-NE 3.13Å; H100-R104 VanDerWaalsContact O-NE 3.13Å; H100-P293 PolarHBondContact CE1-O 2.96Å; H100-S297 PolarHBondContact CE1-OG 2.98Å; H100-S297 PolarHBondContact NE2-OG 3.42Å |
| 101 | I | 96 | Very high | 95 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -58.3 | -54 | 169.7 | -73 | 169.9 | 0 | 0 | 0 | 109.8 | H97 C98 V103 R104 C105 P420 P421 E424 | H97-I101 WeakPolarHBondContact NE2-CD1 3.39Å; H97-I101 WeakPolarHBondContact O-CG1 3.02Å; H97-I101 PolarHBondContact O-N 3.16Å; C98-I101 WeakPolarHBondContact O-CB 3.29Å; C98-I101 PolarHBondContact O-N 3.27Å; I101-V103 VanDerWaalsContact C-N 3.35Å; I101-V103 PolarHBondContact O-N 2.89Å; I101-R104 VanDerWaalsContact CG1-NH2 3.28Å; I101-R104 PolarHBondContact O-N 3.34Å; I101-R104 VanDerWaalsContact O-N 3.16Å; I101-C105 PolarHBondContact O-N 3.05Å; I101-C105 PolarHBondContact O-SG 3.21Å; I101-P420 HydrophobicContact CB-CB 4.36Å; I101-P420 HydrophobicContact CG2-CB 4.12Å; I101-P420 WeakPolarHBondContact CG2-O 3.48Å; I101-P421 HydrophobicContact CD1-CG 4.49Å; I101-E424 HydrophobicContact CD1-CB 4.32Å; I101-E424 WeakPolarHBondContact CD1-OE2 3.04Å; I101-E424 HydrophobicContact CG1-CB 4.34Å; I101-E424 WeakPolarHBondContact CG1-OE2 3.18Å; I101-E424 HydrophobicContact CG2-CB 3.67Å |
| 102 | L | 96.2 | Very high | 94.7 | Very high | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -59.5 | -45.8 | -175 | 178.8 | 58.5 | 0 | 0 | 0 | 111.7 | C98 M99 C105 A106 Y120 T123 I276 L280 L423 | C98-L102 PolarHBondContact O-N 2.98Å; M99-L102 PolarHBondContact O-N 3.35Å; L102-C105 PolarHBondContact O-N 3.46Å; L102-A106 WeakPolarHBondContact O-CB 3.16Å; L102-A106 PolarHBondContact O-N 2.89Å; L102-Y120 HydrophobicContact CD1-CD2 3.4Å; L102-Y120 HydrophobicContact CD1-CE2 3.54Å; L102-Y120 HydrophobicContact CD1-CG 4.24Å; L102-Y120 HydrophobicContact CD2-CD1 4.01Å; L102-Y120 HydrophobicContact CD2-CD2 3.76Å; L102-Y120 HydrophobicContact CD2-CE1 4.11Å; L102-Y120 HydrophobicContact CD2-CE2 3.89Å; L102-Y120 HydrophobicContact CD2-CG 3.84Å; L102-Y120 HydrophobicContact CG-CD2 4.24Å; L102-Y120 HydrophobicContact CG-CE2 4.35Å; L102-T123 HydrophobicContact CD1-CG2 4.2Å; L102-I276 HydrophobicContact CB-CD1 4.42Å; L102-I276 HydrophobicContact CD2-CD1 3.79Å; L102-I276 HydrophobicContact CD2-CG1 3.47Å; L102-I276 VanDerWaalsContact CD2-CG1 3.47Å; L102-L280 HydrophobicContact CD1-CD1 3.97Å; L102-L280 HydrophobicContact CD2-CD1 3.99Å; L102-L280 HydrophobicContact CD2-CG 4.08Å; L102-L280 HydrophobicContact CG-CD1 3.86Å; L102-L280 HydrophobicContact CG-CD2 4.25Å; L102-L280 HydrophobicContact CG-CG 4.06Å; L102-L423 HydrophobicContact CD1-CD2 3.71Å |
| 103 | V | 95.3 | Very high | 94.4 | Very high | 1 Ų | 1 | 41.3 Ų | 41.3 | 1% | 0.006 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -58.1 | -48 | 174.7 | 167.6 | 0 | 0 | 0 | 0 | 111.6 | M99 I101 C105 A106 Q107 V279 L280 F292 P293 L296 | M99-V103 WeakPolarHBondContact O-CG2 3.49Å; M99-V103 PolarHBondContact O-N 3.21Å; I101-V103 VanDerWaalsContact C-N 3.35Å; I101-V103 PolarHBondContact O-N 2.89Å; V103-C105 VanDerWaalsContact C-N 3.33Å; V103-C105 PolarHBondContact O-N 3.36Å; V103-A106 PolarHBondContact O-N 3.29Å; V103-Q107 HydrophobicContact CG1-CG 4.38Å; V103-Q107 WeakPolarHBondContact O-CB 3.45Å; V103-Q107 VanDerWaalsContact O-CG 3.31Å; V103-Q107 WeakPolarHBondContact O-CG 3.39Å; V103-Q107 PolarHBondContact O-N 3.39Å; V103-V279 HydrophobicContact CG2-CG1 3.49Å; V103-V279 VanDerWaalsContact CG2-CG1 3.49Å; V103-L280 HydrophobicContact CG2-CD2 4.27Å; V103-F292 HydrophobicContact CG1-CD1 4.25Å; V103-F292 HydrophobicContact CG2-CD1 3.94Å; V103-F292 HydrophobicContact CG2-CE1 3.64Å; V103-P293 HydrophobicContact CG1-CG 4.43Å; V103-L296 HydrophobicContact CG2-CD2 4.37Å |
| 104 | R | 94.5 | Very high | 94 | Very high | 93 Ų | 93 | 43.2 Ų | 43.2 | 35% | 0.351 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -62 | -40.1 | 179.5 | -75.4 | -179.3 | -66.2 | 130.9 | 1.2 | 112.1 | H100 I101 R108 E424 | H100-R104 WeakPolarHBondContact O-CB 3.44Å; H100-R104 VanDerWaalsContact O-CG 3.25Å; H100-R104 WeakPolarHBondContact O-CG 3.49Å; H100-R104 PolarHBondContact O-N 3.33Å; H100-R104 VanDerWaalsContact O-N 3.08Å; H100-R104 PolarHBondContact O-NE 3.13Å; H100-R104 VanDerWaalsContact O-NE 3.13Å; I101-R104 VanDerWaalsContact CG1-NH2 3.28Å; I101-R104 PolarHBondContact O-N 3.34Å; I101-R104 VanDerWaalsContact O-N 3.16Å; R104-R108 WeakPolarHBondContact O-CB 3.27Å; R104-R108 PolarHBondContact O-N 2.85Å; R104-E424 IonicContact CZ-OE1 3.17Å; R104-E424 IonicContact NH1-OE1 3.06Å; R104-E424 PolarHBondContact NH1-OE1 2.81Å; R104-E424 IonicContact NH2-OE1 3.42Å; R104-E424 PolarHBondContact NH2-OE1 3.18Å; R104-E424 IonicContact NH2-OE2 3.57Å |
| 105 | C | 94.3 | Very high | 93.5 | Very high | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -67.6 | -46.9 | 176.6 | -60.1 | 0 | 0 | 0 | 0 | 111.4 | I101 L102 V103 Q107 R108 F109 T123 L423 T427 | I101-C105 PolarHBondContact O-N 3.05Å; I101-C105 PolarHBondContact O-SG 3.21Å; L102-C105 PolarHBondContact O-N 3.46Å; V103-C105 VanDerWaalsContact C-N 3.33Å; V103-C105 PolarHBondContact O-N 3.36Å; C105-Q107 PolarHBondContact O-N 2.86Å; C105-R108 WeakPolarHBondContact O-CB 3.41Å; C105-R108 PolarHBondContact O-N 3.35Å; C105-R108 VanDerWaalsContact O-N 3.13Å; C105-F109 VanDerWaalsContact O-CD2 3.22Å; C105-F109 WeakPolarHBondContact O-CD2 3.45Å; C105-F109 PolarHBondContact O-N 2.85Å; C105-T123 HydrophobicContact CB-CG2 4Å; C105-L423 HydrophobicContact CB-CD1 4.48Å; C105-L423 HydrophobicContact CB-CD2 3.93Å; C105-L423 HydrophobicContact CB-CG 3.94Å; C105-T427 HydrophobicContact CB-CG2 4.45Å |
| 106 | A | 94.1 | Very high | 92.9 | Very high | 3 Ų | 3 | 51.6 Ų | 51.6 | 3% | 0.025 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -58.5 | -48 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L102 V103 R108 F109 C110 M118 T123 L280 | L102-A106 WeakPolarHBondContact O-CB 3.16Å; L102-A106 PolarHBondContact O-N 2.89Å; V103-A106 PolarHBondContact O-N 3.29Å; A106-R108 VanDerWaalsContact C-N 3.3Å; A106-R108 PolarHBondContact O-N 3.45Å; A106-F109 PolarHBondContact O-N 3.05Å; A106-C110 PolarHBondContact O-N 3.27Å; A106-C110 PolarHBondContact O-SG 3.31Å; A106-C110 VanDerWaalsContact O-SG 3.36Å; A106-M118 HydrophobicContact CB-CB 4.31Å; A106-T123 HydrophobicContact CB-CG2 4.02Å; A106-L280 HydrophobicContact CB-CD1 4.09Å; A106-L280 HydrophobicContact CB-CD2 3.5Å; A106-L280 HydrophobicContact CB-CG 4.46Å |
| 107 | Q | 92.8 | Very high | 92.4 | Very high | 49 Ų | 49 | 56.7 Ų | 56.7 | 23% | 0.229 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -60.6 | -35.1 | 175.2 | -72.5 | -177 | 6.9 | 0 | 0 | 113.2 | V103 C105 K111 E283 | V103-Q107 HydrophobicContact CG1-CG 4.38Å; V103-Q107 WeakPolarHBondContact O-CB 3.45Å; V103-Q107 VanDerWaalsContact O-CG 3.31Å; V103-Q107 WeakPolarHBondContact O-CG 3.39Å; V103-Q107 PolarHBondContact O-N 3.39Å; C105-Q107 PolarHBondContact O-N 2.86Å; Q107-K111 VanDerWaalsContact O-CG 3.31Å; Q107-K111 WeakPolarHBondContact O-CG 3.32Å; Q107-K111 PolarHBondContact O-N 2.98Å; Q107-E283 WeakPolarHBondContact CG-OE1 3.22Å; Q107-E283 PolarHBondContact NE2-OE1 3.17Å |
| 108 | R | 91.8 | Very high | 92.1 | Very high | 83 Ų | 83 | 53.9 Ų | 53.9 | 31% | 0.313 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -64.9 | -44.5 | 175.9 | -174.6 | 59.1 | 161 | 172.7 | -10.7 | 110.7 | R104 C105 A106 R112 T427 F428 E431 | R104-R108 WeakPolarHBondContact O-CB 3.27Å; R104-R108 PolarHBondContact O-N 2.85Å; C105-R108 WeakPolarHBondContact O-CB 3.41Å; C105-R108 PolarHBondContact O-N 3.35Å; C105-R108 VanDerWaalsContact O-N 3.13Å; A106-R108 VanDerWaalsContact C-N 3.3Å; A106-R108 PolarHBondContact O-N 3.45Å; R108-R112 WeakPolarHBondContact O-CB 3.4Å; R108-R112 PolarHBondContact O-N 3.12Å; R108-T427 HydrophobicContact CG-CG2 4.27Å; R108-F428 HydrophobicContact CB-CZ 4.35Å; R108-F428 HydrophobicContact CG-CE1 4.18Å; R108-F428 HydrophobicContact CG-CZ 4.31Å; R108-E431 IonicContact CZ-OE1 2.7Å; R108-E431 IonicContact CZ-OE2 2.64Å; R108-E431 IonicContact NE-OE1 3.54Å; R108-E431 PolarHBondContact NE-OE1 2.88Å; R108-E431 IonicContact NH2-OE1 3.55Å; R108-E431 PolarHBondContact NH2-OE1 2.97Å; R108-E431 IonicContact NH2-OE2 2.84Å; R108-E431 PolarHBondContact NH2-OE2 2.85Å |
| 109 | F | 92.3 | Very high | 91.8 | Very high | 9 Ų | 9 | 56.7 Ų | 56.7 | 4% | 0.039 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -74.4 | -37.5 | 178.4 | -71.1 | -63.3 | 0 | 0 | 0 | 113.8 | C105 A106 K111 R112 L113 M118 T123 H126 A130 T427 | C105-F109 VanDerWaalsContact O-CD2 3.22Å; C105-F109 WeakPolarHBondContact O-CD2 3.45Å; C105-F109 PolarHBondContact O-N 2.85Å; A106-F109 PolarHBondContact O-N 3.05Å; F109-K111 VanDerWaalsContact C-N 3.26Å; F109-K111 PolarHBondContact O-N 2.71Å; F109-R112 PolarHBondContact O-N 3.24Å; F109-L113 HydrophobicContact CB-CD1 4.35Å; F109-L113 HydrophobicContact CD1-CD1 4.44Å; F109-L113 WeakPolarHBondContact O-CB 3.32Å; F109-L113 PolarHBondContact O-N 3.12Å; F109-M118 HydrophobicContact CB-CE 3.51Å; F109-M118 HydrophobicContact CB-SD 4.16Å; F109-M118 HydrophobicContact CD2-CE 4.49Å; F109-M118 HydrophobicContact CG-CE 4.22Å; F109-T123 HydrophobicContact CD2-CG2 4.23Å; F109-H126 HydrophobicContact CD1-CB 3.84Å; F109-H126 HydrophobicContact CD2-CB 4.35Å; F109-H126 HydrophobicContact CE1-CB 4.02Å; F109-H126 WeakPolarHBondContact CE1-O 3.48Å; F109-H126 HydrophobicContact CE2-CB 4.5Å; F109-H126 HydrophobicContact CG-CB 4.04Å; F109-H126 VanDerWaalsContact CZ-C 3.5Å; F109-H126 HydrophobicContact CZ-CB 4.36Å; F109-H126 VanDerWaalsContact CZ-O 3.27Å; F109-H126 WeakPolarHBondContact CZ-O 3.31Å; F109-A130 HydrophobicContact CE1-CB 4.19Å; F109-A130 HydrophobicContact CZ-CB 4.02Å; F109-T427 HydrophobicContact CD2-CG2 4.5Å; F109-T427 HydrophobicContact CE2-CG2 3.61Å; F109-T427 WeakPolarHBondContact CE2-OG1 3.4Å; F109-T427 HydrophobicContact CZ-CG2 3.77Å |
| 110 | C | 90.7 | Very high | 91.7 | Very high | 27 Ų | 27 | 56.8 Ų | 56.8 | 18% | 0.182 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -51.9 | -47.4 | 169.5 | -73.1 | 0 | 0 | 0 | 0 | 111.3 | A106 N114 K115 M118 | A106-C110 PolarHBondContact O-N 3.27Å; A106-C110 PolarHBondContact O-SG 3.31Å; A106-C110 VanDerWaalsContact O-SG 3.36Å; C110-N114 WeakPolarHBondContact O-CA 3.25Å; C110-N114 PolarHBondContact O-N 3.1Å; C110-N114 VanDerWaalsContact O-N 3.1Å; C110-K115 WeakPolarHBondContact CB-O 3.39Å; C110-K115 PolarHBondContact O-N 3.3Å; C110-K115 VanDerWaalsContact O-N 3.12Å; C110-M118 WeakPolarHBondContact SG-CG 3.31Å |
| 111 | K | 90.1 | Very high | 91.5 | Very high | 159 Ų | 159 | 55.2 Ų | 55.2 | 69% | 0.691 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -68.9 | -43.4 | 178.7 | -69.4 | 170.7 | -173.4 | 170.3 | 0 | 113.1 | Q107 F109 | Q107-K111 VanDerWaalsContact O-CG 3.31Å; Q107-K111 WeakPolarHBondContact O-CG 3.32Å; Q107-K111 PolarHBondContact O-N 2.98Å; F109-K111 VanDerWaalsContact C-N 3.26Å; F109-K111 PolarHBondContact O-N 2.71Å |
| 112 | R | 90.3 | Very high | 91.4 | Very high | 114 Ų | 114 | 56.8 Ų | 56.8 | 43% | 0.43 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -69.1 | -39.7 | -179.3 | -83.5 | -174.7 | 165.8 | 152.8 | 2 | 113.2 | R108 F109 E431 | R108-R112 WeakPolarHBondContact O-CB 3.4Å; R108-R112 PolarHBondContact O-N 3.12Å; F109-R112 PolarHBondContact O-N 3.24Å; R112-E431 IonicContact CZ-OE1 3.66Å; R112-E431 IonicContact NH1-OE1 2.83Å; R112-E431 IonicContact NH2-OE1 3.75Å; R112-E431 PolarHBondContact NH2-OE1 3.47Å |
| 113 | L | 90.5 | Very high | 91.3 | Very high | 74 Ų | 74 | 56.8 Ų | 56.8 | 39% | 0.387 | 27% | 0.271 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.7 | 2.1 | -174.8 | -58.2 | 175.2 | 0 | 0 | 0 | 113.3 | F109 K115 H126 | F109-L113 HydrophobicContact CB-CD1 4.35Å; F109-L113 HydrophobicContact CD1-CD1 4.44Å; F109-L113 WeakPolarHBondContact O-CB 3.32Å; F109-L113 PolarHBondContact O-N 3.12Å; L113-K115 HydrophobicContact CB-CD 4.29Å; L113-K115 HydrophobicContact CB-CG 4.1Å; L113-K115 HydrophobicContact CD1-CD 4.42Å; L113-K115 PolarHBondContact O-N 3.16Å; L113-K115 VanDerWaalsContact O-N 3.17Å; L113-H126 HydrophobicContact CD1-CB 4.27Å |
| 114 | N | 88.6 | Confident | 91.3 | Very high | 153 Ų | 153 | 57.3 Ų | 57.3 | 82% | 0.818 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.9 | 35.6 | -173.5 | -158 | 24.3 | 0 | 0 | 0 | 113.5 | C110 | C110-N114 WeakPolarHBondContact O-CA 3.25Å; C110-N114 PolarHBondContact O-N 3.1Å; C110-N114 VanDerWaalsContact O-N 3.1Å |
| 115 | K | 87.4 | Confident | 91.4 | Very high | 83 Ų | 83 | 53.6 Ų | 53.6 | 36% | 0.361 | 26% | 0.261 | S | S | . | . | trans | -92 | 138.1 | 177.6 | -74.8 | -178 | 177.1 | 178.3 | 0 | 109.9 | C110 L113 F117 M118 H126 | C110-K115 WeakPolarHBondContact CB-O 3.39Å; C110-K115 PolarHBondContact O-N 3.3Å; C110-K115 VanDerWaalsContact O-N 3.12Å; L113-K115 HydrophobicContact CB-CD 4.29Å; L113-K115 HydrophobicContact CB-CG 4.1Å; L113-K115 HydrophobicContact CD1-CD 4.42Å; L113-K115 PolarHBondContact O-N 3.16Å; L113-K115 VanDerWaalsContact O-N 3.17Å; K115-F117 VanDerWaalsContact C-N 3.29Å; K115-F117 PolarHBondContact O-N 3.38Å; K115-M118 HydrophobicContact CD-SD 3.95Å; K115-H126 PolarHBondContact NZ-NE2 3.13Å | ||
| 116 | P | 82.6 | Confident | 91.3 | Very high | 122 Ų | 122 | 54.4 Ų | 54.4 | 79% | 0.792 | 27% | 0.265 | S | S | * | . | S | Bend | trans | -68.8 | -27.2 | -177.3 | 27.5 | -35 | 0 | 0 | 0 | 113.3 | ||
| 117 | F | 86.7 | Confident | 91.3 | Very high | 125 Ų | 125 | 54.3 Ų | 54.3 | 55% | 0.548 | 26% | 0.264 | S | S | . | . | trans | -154.1 | 165 | 177.2 | 62.6 | -94 | 0 | 0 | 0 | 110.6 | K115 N284 | K115-F117 VanDerWaalsContact C-N 3.29Å; K115-F117 PolarHBondContact O-N 3.38Å; F117-N284 HydrophobicContact CB-CB 4Å; F117-N284 VanDerWaalsContact CB-CG 3.46Å; F117-N284 WeakPolarHBondContact CB-OD1 3.42Å | ||
| 118 | M | 89.1 | Confident | 91.3 | Very high | 2 Ų | 2 | 53.6 Ų | 53.6 | 1% | 0.01 | 26% | 0.261 | C | S | . | . | trans | -132.7 | 144.4 | 173.7 | -66.2 | -86.6 | -65.9 | 0 | 0 | 109.1 | A106 F109 C110 K115 D122 H126 N284 | A106-M118 HydrophobicContact CB-CB 4.31Å; F109-M118 HydrophobicContact CB-CE 3.51Å; F109-M118 HydrophobicContact CB-SD 4.16Å; F109-M118 HydrophobicContact CD2-CE 4.49Å; F109-M118 HydrophobicContact CG-CE 4.22Å; C110-M118 WeakPolarHBondContact SG-CG 3.31Å; K115-M118 HydrophobicContact CD-SD 3.95Å; M118-D122 HydrophobicContact CE-CB 4.23Å; M118-H126 HydrophobicContact CE-CB 4.3Å; M118-N284 PolarHBondContact O-ND2 3.36Å | ||
| 119 | D | 91.4 | Very high | 91.2 | Very high | 59 Ų | 59 | 53.3 Ų | 53.3 | 32% | 0.316 | 26% | 0.264 | S | S | . | . | trans | -94 | 166.7 | 166.4 | -178.1 | 41.7 | 0 | 0 | 0 | 110.5 | G121 D122 T123 | D119-G121 PolarHBondContact O-N 2.89Å; D119-D122 PolarHBondContact O-N 3.33Å; D119-T123 WeakPolarHBondContact O-CB 3.37Å; D119-T123 PolarHBondContact O-N 2.98Å; D119-T123 PolarHBondContact O-OG1 2.95Å | ||
| 120 | Y | 93.8 | Very high | 91 | Very high | 4 Ų | 4 | 54.4 Ų | 54.4 | 2% | 0.016 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -61.2 | -46.2 | -179 | -167.9 | -177.6 | 0 | 0 | 0 | 111.4 | L102 D122 T123 V124 V147 I276 L415 I419 | L102-Y120 HydrophobicContact CD1-CD2 3.4Å; L102-Y120 HydrophobicContact CD1-CE2 3.54Å; L102-Y120 HydrophobicContact CD1-CG 4.24Å; L102-Y120 HydrophobicContact CD2-CD1 4.01Å; L102-Y120 HydrophobicContact CD2-CD2 3.76Å; L102-Y120 HydrophobicContact CD2-CE1 4.11Å; L102-Y120 HydrophobicContact CD2-CE2 3.89Å; L102-Y120 HydrophobicContact CD2-CG 3.84Å; L102-Y120 HydrophobicContact CG-CD2 4.24Å; L102-Y120 HydrophobicContact CG-CE2 4.35Å; Y120-D122 VanDerWaalsContact C-N 3.32Å; Y120-D122 PolarHBondContact O-N 3.04Å; Y120-T123 PolarHBondContact O-N 3.41Å; Y120-T123 VanDerWaalsContact O-N 3.16Å; Y120-V124 HydrophobicContact CD2-CG2 3.9Å; Y120-V124 HydrophobicContact CE2-CG2 3.66Å; Y120-V124 PolarHBondContact O-N 3.37Å; Y120-V147 HydrophobicContact CD1-CG1 3.85Å; Y120-V147 HydrophobicContact CD2-CG1 4.15Å; Y120-V147 HydrophobicContact CE1-CG1 4.33Å; Y120-V147 HydrophobicContact CE2-CG2 4.5Å; Y120-V147 HydrophobicContact CG-CG1 3.74Å; Y120-I276 HydrophobicContact CE1-CD1 4.2Å; Y120-I276 HydrophobicContact CE1-CG1 4.19Å; Y120-I276 HydrophobicContact CE1-CG2 4.13Å; Y120-L415 HydrophobicContact CD1-CD2 4.46Å; Y120-L415 HydrophobicContact CE1-CB 4.39Å; Y120-L415 HydrophobicContact CE1-CD2 3.86Å; Y120-L415 PolarHBondContact OH-O 3.43Å; Y120-I419 HydrophobicContact CE2-CG2 3.87Å; Y120-I419 WeakPolarHBondContact OH-CB 3.47Å; Y120-I419 VanDerWaalsContact OH-CG2 3.28Å; Y120-I419 WeakPolarHBondContact OH-CG2 3.41Å |
| 121 | G | 93.6 | Very high | 90.8 | Very high | 0 Ų | 0 | 53.5 Ų | 53.5 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -61.3 | -39 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | D119 M125 | D119-G121 PolarHBondContact O-N 2.89Å; G121-M125 WeakPolarHBondContact O-CB 3.4Å; G121-M125 PolarHBondContact O-N 2.83Å; G121-M125 VanDerWaalsContact O-N 3.09Å |
| 122 | D | 93.1 | Very high | 90.4 | Very high | 32 Ų | 32 | 49.8 Ų | 49.8 | 17% | 0.171 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -69.9 | -36.5 | 175.4 | -74.8 | -27.7 | 0 | 0 | 0 | 112.5 | M118 D119 Y120 M125 H126 R144 | M118-D122 HydrophobicContact CE-CB 4.23Å; D119-D122 PolarHBondContact O-N 3.33Å; Y120-D122 VanDerWaalsContact C-N 3.32Å; Y120-D122 PolarHBondContact O-N 3.04Å; D122-M125 PolarHBondContact O-N 3.45Å; D122-H126 PolarHBondContact O-CD2 2.83Å; D122-H126 PolarHBondContact O-N 3.17Å; D122-R144 IonicContact OD1-CZ 3.35Å; D122-R144 VanDerWaalsContact OD1-CZ 3.27Å; D122-R144 IonicContact OD1-NE 3.48Å; D122-R144 IonicContact OD1-NH1 3.46Å; D122-R144 PolarHBondContact OD1-NH1 2.92Å; D122-R144 IonicContact OD2-NH1 2.68Å |
| 123 | T | 94.6 | Very high | 90.2 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -66.1 | -40.9 | 178.8 | -52.5 | 0 | 0 | 0 | 0 | 110.7 | L102 C105 A106 F109 D119 Y120 G127 L423 | L102-T123 HydrophobicContact CD1-CG2 4.2Å; C105-T123 HydrophobicContact CB-CG2 4Å; A106-T123 HydrophobicContact CB-CG2 4.02Å; F109-T123 HydrophobicContact CD2-CG2 4.23Å; D119-T123 WeakPolarHBondContact O-CB 3.37Å; D119-T123 PolarHBondContact O-N 2.98Å; D119-T123 PolarHBondContact O-OG1 2.95Å; Y120-T123 PolarHBondContact O-N 3.41Å; Y120-T123 VanDerWaalsContact O-N 3.16Å; T123-G127 PolarHBondContact O-N 3.3Å; T123-L423 HydrophobicContact CG2-CD2 3.88Å |
| 124 | V | 95.9 | Very high | 90.1 | Very high | 13 Ų | 13 | 46 Ų | 46 | 8% | 0.079 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -68.5 | -41.9 | 175.1 | 173.8 | 0 | 0 | 0 | 0 | 111.7 | Y120 G127 L128 V147 I419 L423 | Y120-V124 HydrophobicContact CD2-CG2 3.9Å; Y120-V124 HydrophobicContact CE2-CG2 3.66Å; Y120-V124 PolarHBondContact O-N 3.37Å; V124-G127 WeakPolarHBondContact O-CA 3.36Å; V124-G127 PolarHBondContact O-N 2.86Å; V124-L128 HydrophobicContact CG1-CD1 4.24Å; V124-L128 HydrophobicContact CG1-CG 4.47Å; V124-L128 WeakPolarHBondContact O-CG 3.42Å; V124-L128 PolarHBondContact O-N 3.34Å; V124-V147 HydrophobicContact CB-CG2 3.89Å; V124-V147 HydrophobicContact CG1-CG2 4.11Å; V124-V147 HydrophobicContact CG2-CG2 3.68Å; V124-I419 HydrophobicContact CG2-CG2 3.6Å; V124-L423 HydrophobicContact CG2-CD2 4.1Å |
| 125 | M | 95.2 | Very high | 90.1 | Very high | 15 Ų | 15 | 46 Ų | 46 | 7% | 0.074 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -56 | -56.8 | 175.2 | -171.6 | -178.1 | 79 | 0 | 0 | 111.8 | G121 D122 G127 L128 E129 A140 H141 R144 | G121-M125 WeakPolarHBondContact O-CB 3.4Å; G121-M125 PolarHBondContact O-N 2.83Å; G121-M125 VanDerWaalsContact O-N 3.09Å; D122-M125 PolarHBondContact O-N 3.45Å; M125-G127 PolarHBondContact O-N 3.45Å; M125-L128 PolarHBondContact O-N 3.28Å; M125-E129 WeakPolarHBondContact O-CG 3.33Å; M125-E129 PolarHBondContact O-N 3.41Å; M125-A140 HydrophobicContact CG-CB 4.37Å; M125-H141 PolarHBondContact SD-ND1 3.05Å; M125-R144 HydrophobicContact CB-CB 4.22Å; M125-R144 HydrophobicContact SD-CB 4.49Å |
| 126 | H | 93.4 | Very high | 90.1 | Very high | 17 Ų | 17 | 44.6 Ų | 44.6 | 8% | 0.079 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -65.6 | -27.3 | 178.7 | -68.8 | -54.3 | 0 | 0 | 0 | 112.6 | F109 L113 K115 M118 D122 E129 A130 | F109-H126 HydrophobicContact CD1-CB 3.84Å; F109-H126 HydrophobicContact CD2-CB 4.35Å; F109-H126 HydrophobicContact CE1-CB 4.02Å; F109-H126 WeakPolarHBondContact CE1-O 3.48Å; F109-H126 HydrophobicContact CE2-CB 4.5Å; F109-H126 HydrophobicContact CG-CB 4.04Å; F109-H126 VanDerWaalsContact CZ-C 3.5Å; F109-H126 HydrophobicContact CZ-CB 4.36Å; F109-H126 VanDerWaalsContact CZ-O 3.27Å; F109-H126 WeakPolarHBondContact CZ-O 3.31Å; L113-H126 HydrophobicContact CD1-CB 4.27Å; K115-H126 PolarHBondContact NZ-NE2 3.13Å; M118-H126 HydrophobicContact CE-CB 4.3Å; D122-H126 PolarHBondContact O-CD2 2.83Å; D122-H126 PolarHBondContact O-N 3.17Å; H126-E129 IonicContact CE1-OE2 2.77Å; H126-E129 IonicContact CG-OE2 3.57Å; H126-E129 IonicContact ND1-OE1 3.72Å; H126-E129 IonicContact ND1-OE2 3.69Å; H126-E129 PolarHBondContact ND1-OE2 3.16Å; H126-A130 WeakPolarHBondContact O-CB 3.36Å; H126-A130 PolarHBondContact O-N 2.97Å; H126-A130 VanDerWaalsContact O-N 3.12Å |
| 127 | G | 92.6 | Very high | 90.3 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.7 | -37.2 | 169 | 0 | 0 | 0 | 0 | 0 | 114 | T123 V124 M125 S426 | T123-G127 PolarHBondContact O-N 3.3Å; V124-G127 WeakPolarHBondContact O-CA 3.36Å; V124-G127 PolarHBondContact O-N 2.86Å; M125-G127 PolarHBondContact O-N 3.45Å; G127-S426 VanDerWaalsContact O-CB 3.22Å; G127-S426 WeakPolarHBondContact O-CB 3.31Å; G127-S426 PolarHBondContact O-OG 3.36Å |
| 128 | L | 92.9 | Very high | 90.5 | Very high | 35 Ų | 35 | 43.1 Ų | 43.1 | 18% | 0.183 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -78.9 | -35.5 | 176.5 | -64.5 | 172.4 | 0 | 0 | 0 | 111.9 | V124 M125 A130 S131 L136 A140 | V124-L128 HydrophobicContact CG1-CD1 4.24Å; V124-L128 HydrophobicContact CG1-CG 4.47Å; V124-L128 WeakPolarHBondContact O-CG 3.42Å; V124-L128 PolarHBondContact O-N 3.34Å; M125-L128 PolarHBondContact O-N 3.28Å; L128-A130 PolarHBondContact O-N 2.66Å; L128-S131 WeakPolarHBondContact O-CB 3.31Å; L128-S131 PolarHBondContact O-N 3.24Å; L128-S131 VanDerWaalsContact O-N 3.1Å; L128-L136 HydrophobicContact CD2-CD2 3.75Å; L128-L136 HydrophobicContact CD2-CG 4.4Å; L128-A140 HydrophobicContact CB-CB 3.75Å |
| 129 | E | 91.4 | Very high | 90.6 | Very high | 77 Ų | 77 | 47.4 Ų | 47.4 | 36% | 0.36 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -60.2 | -32.4 | 171.3 | -67.8 | 169.7 | -171 | 0 | 0 | 112.3 | M125 H126 S131 A140 | M125-E129 WeakPolarHBondContact O-CG 3.33Å; M125-E129 PolarHBondContact O-N 3.41Å; H126-E129 IonicContact CE1-OE2 2.77Å; H126-E129 IonicContact CG-OE2 3.57Å; H126-E129 IonicContact ND1-OE1 3.72Å; H126-E129 IonicContact ND1-OE2 3.69Å; H126-E129 PolarHBondContact ND1-OE2 3.16Å; E129-S131 VanDerWaalsContact C-N 3.32Å; E129-A140 HydrophobicContact CB-CB 4.44Å; E129-A140 HydrophobicContact CG-CB 3.47Å; E129-A140 VanDerWaalsContact CG-CB 3.47Å |
| 130 | A | 87.5 | Confident | 90.6 | Very high | 31 Ų | 31 | 44.8 Ų | 44.8 | 26% | 0.256 | 24% | 0.24 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -80.4 | -7.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | F109 H126 L128 | F109-A130 HydrophobicContact CE1-CB 4.19Å; F109-A130 HydrophobicContact CZ-CB 4.02Å; H126-A130 WeakPolarHBondContact O-CB 3.36Å; H126-A130 PolarHBondContact O-N 2.97Å; H126-A130 VanDerWaalsContact O-N 3.12Å; L128-A130 PolarHBondContact O-N 2.66Å |
| 131 | S | 86.8 | Confident | 90.5 | Very high | 9 Ų | 9 | 50.4 Ų | 50.4 | 6% | 0.063 | 27% | 0.267 | C | S | . | . | S | Bend | trans | -67.6 | 146 | -177 | -170.8 | 0 | 0 | 0 | 0 | 111.9 | L128 E129 S133 Q137 | L128-S131 WeakPolarHBondContact O-CB 3.31Å; L128-S131 PolarHBondContact O-N 3.24Å; L128-S131 VanDerWaalsContact O-N 3.1Å; E129-S131 VanDerWaalsContact C-N 3.32Å; S131-S133 PolarHBondContact O-N 3.11Å; S131-Q137 WeakPolarHBondContact O-CG 3.28Å; S131-Q137 PolarHBondContact O-NE2 2.95Å |
| 132 | P | 82.1 | Confident | 90.5 | Very high | 80 Ų | 80 | 58.2 Ų | 58.2 | 52% | 0.519 | 30% | 0.296 | S | S | . | . | S | Bend | trans | -66.7 | -16.6 | 175.2 | 30.8 | -41.3 | 0 | 0 | 0 | 114.3 | Y429 | P132-Y429 HydrophobicContact CB-CD1 3.99Å; P132-Y429 HydrophobicContact CB-CE1 3.98Å; P132-Y429 HydrophobicContact CG-CD1 3.52Å; P132-Y429 HydrophobicContact CG-CE1 3.66Å; P132-Y429 HydrophobicContact CG-CG 4Å |
| 133 | S | 85.3 | Confident | 90.5 | Very high | 48 Ų | 48 | 56.8 Ų | 56.8 | 34% | 0.336 | 29% | 0.289 | S | S | . | . | trans | -86.5 | 116.4 | -176.3 | 177.4 | 0 | 0 | 0 | 0 | 111.4 | S131 W135 L136 Q137 | S131-S133 PolarHBondContact O-N 3.11Å; S133-W135 PolarHBondContact O-N 3.45Å; S133-W135 VanDerWaalsContact O-N 3.09Å; S133-L136 PolarHBondContact O-N 2.78Å; S133-L136 WeakPolarHBondContact OG-CD1 3.38Å; S133-Q137 PolarHBondContact O-N 3.09Å | ||
| 134 | A | 87.4 | Confident | 90.5 | Very high | 61 Ų | 61 | 61.7 Ų | 61.7 | 50% | 0.504 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -55.2 | -28.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | N138 | A134-N138 WeakPolarHBondContact O-CB 3.45Å; A134-N138 VanDerWaalsContact O-CG 3.29Å; A134-N138 PolarHBondContact O-N 2.98Å; A134-N138 PolarHBondContact O-ND2 3.41Å |
| 135 | W | 89.8 | Confident | 90.4 | Very high | 152 Ų | 152 | 66.7 Ų | 66.7 | 58% | 0.576 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -68.9 | -43.1 | 174 | -174.9 | 88.4 | 0 | 0 | 0 | 112.1 | S133 H139 | S133-W135 PolarHBondContact O-N 3.45Å; S133-W135 VanDerWaalsContact O-N 3.09Å; W135-H139 AromaticContact CD1-CE1 3.73Å; W135-H139 AromaticContact CD1-ND1 3.77Å; W135-H139 AromaticContact CD2-ND1 3.95Å; W135-H139 AromaticContact CE2-ND1 3.76Å; W135-H139 AromaticContact CG-ND1 3.97Å; W135-H139 AromaticContact NE1-CE1 3.49Å; W135-H139 PolarHBondContact NE1-CE1 2.77Å; W135-H139 AromaticContact NE1-ND1 3.63Å; W135-H139 PolarHBondContact O-N 2.99Å; W135-H139 PolarHBondContact O-ND1 3.46Å |
| 136 | L | 86.6 | Confident | 90.4 | Very high | 54 Ų | 54 | 68.1 Ų | 68.1 | 28% | 0.283 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -67.2 | -40.3 | 178.1 | -84.2 | 81.7 | 0 | 0 | 0 | 111.1 | L128 S133 H139 A140 | L128-L136 HydrophobicContact CD2-CD2 3.75Å; L128-L136 HydrophobicContact CD2-CG 4.4Å; S133-L136 PolarHBondContact O-N 2.78Å; S133-L136 WeakPolarHBondContact OG-CD1 3.38Å; L136-H139 CarbonylContact O-C 3.51Å; L136-H139 PolarHBondContact O-N 3.23Å; L136-A140 WeakPolarHBondContact O-CA 3.38Å; L136-A140 PolarHBondContact O-N 3.43Å |
| 137 | Q | 87.8 | Confident | 90.5 | Very high | 88 Ų | 88 | 67.3 Ų | 67.3 | 41% | 0.411 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -58 | -52.9 | 175.9 | -65.9 | 178.4 | 0.4 | 0 | 0 | 111.3 | S131 S133 H139 A140 | S131-Q137 WeakPolarHBondContact O-CG 3.28Å; S131-Q137 PolarHBondContact O-NE2 2.95Å; S133-Q137 PolarHBondContact O-N 3.09Å; Q137-H139 PolarHBondContact O-N 2.87Å; Q137-A140 WeakPolarHBondContact O-CB 3.14Å; Q137-A140 PolarHBondContact O-N 3.24Å |
| 138 | N | 90.4 | Very high | 90.6 | Very high | 129 Ų | 129 | 68.4 Ų | 68.4 | 69% | 0.69 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -65.6 | -24.5 | -178.2 | -71.3 | -20.3 | 0 | 0 | 0 | 113.7 | A134 | A134-N138 WeakPolarHBondContact O-CB 3.45Å; A134-N138 VanDerWaalsContact O-CG 3.29Å; A134-N138 PolarHBondContact O-N 2.98Å; A134-N138 PolarHBondContact O-ND2 3.41Å |
| 139 | H | 91.6 | Very high | 90.7 | Very high | 92 Ų | 92 | 72.5 Ų | 72.5 | 43% | 0.426 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -107.4 | 15.5 | -179.8 | -62.1 | 87.5 | 0 | 0 | 0 | 113.3 | W135 L136 Q137 H141 W142 | W135-H139 AromaticContact CD1-CE1 3.73Å; W135-H139 AromaticContact CD1-ND1 3.77Å; W135-H139 AromaticContact CD2-ND1 3.95Å; W135-H139 AromaticContact CE2-ND1 3.76Å; W135-H139 AromaticContact CG-ND1 3.97Å; W135-H139 AromaticContact NE1-CE1 3.49Å; W135-H139 PolarHBondContact NE1-CE1 2.77Å; W135-H139 AromaticContact NE1-ND1 3.63Å; W135-H139 PolarHBondContact O-N 2.99Å; W135-H139 PolarHBondContact O-ND1 3.46Å; L136-H139 CarbonylContact O-C 3.51Å; L136-H139 PolarHBondContact O-N 3.23Å; Q137-H139 PolarHBondContact O-N 2.87Å; H139-H141 PolarHBondContact O-N 3.2Å; H139-H141 VanDerWaalsContact O-N 3.13Å; H139-W142 WeakPolarHBondContact O-CA 3.5Å; H139-W142 WeakPolarHBondContact O-CB 3.4Å; H139-W142 PolarHBondContact O-N 3.49Å |
| 140 | A | 91.5 | Very high | 90.9 | Very high | 3 Ų | 3 | 70.6 Ų | 70.6 | 3% | 0.025 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -57.1 | -33.9 | -173.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | M125 L128 E129 L136 Q137 W142 G143 | M125-A140 HydrophobicContact CG-CB 4.37Å; L128-A140 HydrophobicContact CB-CB 3.75Å; E129-A140 HydrophobicContact CB-CB 4.44Å; E129-A140 HydrophobicContact CG-CB 3.47Å; E129-A140 VanDerWaalsContact CG-CB 3.47Å; L136-A140 WeakPolarHBondContact O-CA 3.38Å; L136-A140 PolarHBondContact O-N 3.43Å; Q137-A140 WeakPolarHBondContact O-CB 3.14Å; Q137-A140 PolarHBondContact O-N 3.24Å; A140-W142 PolarHBondContact O-N 3.42Å; A140-G143 PolarHBondContact O-N 2.82Å |
| 141 | H | 92.2 | Very high | 91.3 | Very high | 123 Ų | 123 | 69.6 Ų | 69.6 | 57% | 0.569 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -56.9 | -28 | 172.5 | -68.5 | -44.5 | 0 | 0 | 0 | 113.3 | M125 H139 G143 R144 H145 | M125-H141 PolarHBondContact SD-ND1 3.05Å; H139-H141 PolarHBondContact O-N 3.2Å; H139-H141 VanDerWaalsContact O-N 3.13Å; H141-G143 VanDerWaalsContact C-N 3.3Å; H141-G143 PolarHBondContact O-N 3.39Å; H141-R144 PolarHBondContact O-N 2.91Å; H141-H145 PolarHBondContact O-N 3.38Å; H141-H145 PolarHBondContact O-ND1 3.16Å |
| 142 | W | 92.7 | Very high | 91.6 | Very high | 163 Ų | 163 | 70.7 Ų | 70.7 | 62% | 0.617 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -63.8 | -36.6 | 176.5 | -165 | 59.7 | 0 | 0 | 0 | 111.5 | H139 A140 R144 H145 I146 | H139-W142 WeakPolarHBondContact O-CA 3.5Å; H139-W142 WeakPolarHBondContact O-CB 3.4Å; H139-W142 PolarHBondContact O-N 3.49Å; A140-W142 PolarHBondContact O-N 3.42Å; W142-R144 VanDerWaalsContact C-N 3.34Å; W142-R144 PolarHBondContact O-N 2.86Å; W142-H145 PolarHBondContact O-N 2.85Å; W142-I146 HydrophobicContact CD2-CD1 3.83Å; W142-I146 HydrophobicContact CD2-CG1 4.19Å; W142-I146 HydrophobicContact CE3-CD1 3.54Å; W142-I146 HydrophobicContact CE3-CG1 4.39Å; W142-I146 HydrophobicContact CH2-CD1 3.77Å; W142-I146 HydrophobicContact CH2-CG1 4.36Å; W142-I146 HydrophobicContact CZ2-CD1 4.08Å; W142-I146 HydrophobicContact CZ2-CG1 4.19Å; W142-I146 HydrophobicContact CZ3-CD1 3.51Å; W142-I146 HydrophobicContact CZ3-CG1 4.47Å; W142-I146 WeakPolarHBondContact O-CG1 3.24Å; W142-I146 PolarHBondContact O-N 2.9Å |
| 143 | G | 93.3 | Very high | 92.3 | Very high | 2 Ų | 2 | 69.1 Ų | 69.1 | 2% | 0.021 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -58.4 | -41.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | A140 H141 H145 I146 V147 | A140-G143 PolarHBondContact O-N 2.82Å; H141-G143 VanDerWaalsContact C-N 3.3Å; H141-G143 PolarHBondContact O-N 3.39Å; G143-H145 VanDerWaalsContact C-N 3.34Å; G143-H145 PolarHBondContact O-N 3.03Å; G143-I146 PolarHBondContact O-N 3.36Å; G143-V147 WeakPolarHBondContact O-CG2 3.45Å; G143-V147 PolarHBondContact O-N 2.68Å; G143-V147 VanDerWaalsContact O-N 3.08Å |
| 144 | R | 94.3 | Very high | 92.7 | Very high | 104 Ų | 104 | 66.8 Ų | 66.8 | 39% | 0.392 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59.3 | -45.5 | 172.6 | -178 | 171.4 | 177.3 | 158.6 | 1.4 | 111.5 | D122 M125 H141 W142 V147 S148 | D122-R144 IonicContact OD1-CZ 3.35Å; D122-R144 VanDerWaalsContact OD1-CZ 3.27Å; D122-R144 IonicContact OD1-NE 3.48Å; D122-R144 IonicContact OD1-NH1 3.46Å; D122-R144 PolarHBondContact OD1-NH1 2.92Å; D122-R144 IonicContact OD2-NH1 2.68Å; M125-R144 HydrophobicContact CB-CB 4.22Å; M125-R144 HydrophobicContact SD-CB 4.49Å; H141-R144 PolarHBondContact O-N 2.91Å; W142-R144 VanDerWaalsContact C-N 3.34Å; W142-R144 PolarHBondContact O-N 2.86Å; R144-V147 PolarHBondContact O-N 2.97Å; R144-S148 WeakPolarHBondContact O-CB 3.36Å; R144-S148 PolarHBondContact O-N 3.01Å; R144-S148 PolarHBondContact O-OG 3.39Å |
| 145 | H | 93.9 | Very high | 93 | Very high | 118 Ų | 118 | 64.4 Ų | 64.4 | 55% | 0.546 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -66 | -37.6 | -179.6 | -69.9 | 81.3 | 0 | 0 | 0 | 112.4 | H141 W142 G143 F149 | H141-H145 PolarHBondContact O-N 3.38Å; H141-H145 PolarHBondContact O-ND1 3.16Å; W142-H145 PolarHBondContact O-N 2.85Å; G143-H145 VanDerWaalsContact C-N 3.34Å; G143-H145 PolarHBondContact O-N 3.03Å; H145-F149 VanDerWaalsContact O-CB 3.25Å; H145-F149 WeakPolarHBondContact O-CB 3.46Å; H145-F149 PolarHBondContact O-N 2.72Å |
| 146 | I | 95.1 | Very high | 93.3 | Very high | 44 Ų | 44 | 58.2 Ų | 58.2 | 23% | 0.226 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -60.6 | -50.9 | 173.1 | -66.2 | 166.6 | 0 | 0 | 0 | 111 | W142 G143 S148 F149 F150 I419 | W142-I146 HydrophobicContact CD2-CD1 3.83Å; W142-I146 HydrophobicContact CD2-CG1 4.19Å; W142-I146 HydrophobicContact CE3-CD1 3.54Å; W142-I146 HydrophobicContact CE3-CG1 4.39Å; W142-I146 HydrophobicContact CH2-CD1 3.77Å; W142-I146 HydrophobicContact CH2-CG1 4.36Å; W142-I146 HydrophobicContact CZ2-CD1 4.08Å; W142-I146 HydrophobicContact CZ2-CG1 4.19Å; W142-I146 HydrophobicContact CZ3-CD1 3.51Å; W142-I146 HydrophobicContact CZ3-CG1 4.47Å; W142-I146 WeakPolarHBondContact O-CG1 3.24Å; W142-I146 PolarHBondContact O-N 2.9Å; G143-I146 PolarHBondContact O-N 3.36Å; I146-S148 PolarHBondContact O-N 3.21Å; I146-F149 WeakPolarHBondContact O-CB 3.16Å; I146-F149 PolarHBondContact O-N 2.9Å; I146-F150 HydrophobicContact CG2-CD2 3.61Å; I146-F150 HydrophobicContact CG2-CE2 3.69Å; I146-F150 WeakPolarHBondContact O-CD2 3.46Å; I146-F150 PolarHBondContact O-N 3.01Å; I146-I419 HydrophobicContact CG2-CD1 4.2Å |
| 147 | V | 95.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.5 | -46.3 | -179.6 | 174.1 | 0 | 0 | 0 | 0 | 110.3 | Y120 V124 G143 R144 F149 F150 L151 L415 I419 | Y120-V147 HydrophobicContact CD1-CG1 3.85Å; Y120-V147 HydrophobicContact CD2-CG1 4.15Å; Y120-V147 HydrophobicContact CE1-CG1 4.33Å; Y120-V147 HydrophobicContact CE2-CG2 4.5Å; Y120-V147 HydrophobicContact CG-CG1 3.74Å; V124-V147 HydrophobicContact CB-CG2 3.89Å; V124-V147 HydrophobicContact CG1-CG2 4.11Å; V124-V147 HydrophobicContact CG2-CG2 3.68Å; G143-V147 WeakPolarHBondContact O-CG2 3.45Å; G143-V147 PolarHBondContact O-N 2.68Å; G143-V147 VanDerWaalsContact O-N 3.08Å; R144-V147 PolarHBondContact O-N 2.97Å; V147-F149 VanDerWaalsContact C-N 3.35Å; V147-F149 PolarHBondContact O-N 2.72Å; V147-F150 PolarHBondContact O-N 2.95Å; V147-L151 HydrophobicContact CG1-CD1 3.76Å; V147-L151 HydrophobicContact CG1-CG 4.29Å; V147-L151 WeakPolarHBondContact O-CB 3.5Å; V147-L151 VanDerWaalsContact O-CG 3.27Å; V147-L151 WeakPolarHBondContact O-CG 3.25Å; V147-L151 PolarHBondContact O-N 2.97Å; V147-L415 HydrophobicContact CG1-CD2 4.31Å; V147-I419 HydrophobicContact CG2-CD1 4.17Å; V147-I419 HydrophobicContact CG2-CG2 4.32Å |
| 148 | S | 94.3 | Very high | 94 | Very high | 23 Ų | 23 | 52.5 Ų | 52.5 | 16% | 0.161 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -60.6 | -41.1 | 175.4 | -67 | 0 | 0 | 0 | 0 | 112.5 | R144 I146 I152 | R144-S148 WeakPolarHBondContact O-CB 3.36Å; R144-S148 PolarHBondContact O-N 3.01Å; R144-S148 PolarHBondContact O-OG 3.39Å; I146-S148 PolarHBondContact O-N 3.21Å; S148-I152 WeakPolarHBondContact O-CB 3.47Å; S148-I152 WeakPolarHBondContact O-CD1 3.19Å; S148-I152 VanDerWaalsContact O-CG1 3.23Å; S148-I152 WeakPolarHBondContact O-CG1 3.43Å; S148-I152 PolarHBondContact O-N 2.87Å |
| 149 | F | 95.7 | Very high | 94.2 | Very high | 121 Ų | 121 | 46.4 Ų | 46.4 | 53% | 0.531 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -61.4 | -52.8 | 175.8 | 171.3 | -99.1 | 0 | 0 | 0 | 111.6 | H145 I146 V147 L151 I152 V153 | H145-F149 VanDerWaalsContact O-CB 3.25Å; H145-F149 WeakPolarHBondContact O-CB 3.46Å; H145-F149 PolarHBondContact O-N 2.72Å; I146-F149 WeakPolarHBondContact O-CB 3.16Å; I146-F149 PolarHBondContact O-N 2.9Å; V147-F149 VanDerWaalsContact C-N 3.35Å; V147-F149 PolarHBondContact O-N 2.72Å; F149-L151 VanDerWaalsContact C-N 3.34Å; F149-L151 PolarHBondContact O-N 3Å; F149-I152 WeakPolarHBondContact O-CB 3.28Å; F149-I152 PolarHBondContact O-N 2.66Å; F149-V153 HydrophobicContact CD1-CG2 4.43Å; F149-V153 HydrophobicContact CD2-CG2 4.36Å; F149-V153 HydrophobicContact CE1-CG2 4.03Å; F149-V153 HydrophobicContact CE2-CG2 3.96Å; F149-V153 HydrophobicContact CZ-CG2 3.78Å; F149-V153 WeakPolarHBondContact O-CG2 3.49Å; F149-V153 PolarHBondContact O-N 2.9Å |
| 150 | F | 95.9 | Very high | 94.4 | Very high | 37 Ų | 37 | 42.3 Ų | 42.3 | 16% | 0.162 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.8 | -35.4 | 179.3 | -77.4 | -64.8 | 0 | 0 | 0 | 112.5 | I146 V147 I152 V153 T154 A414 L415 | I146-F150 HydrophobicContact CG2-CD2 3.61Å; I146-F150 HydrophobicContact CG2-CE2 3.69Å; I146-F150 WeakPolarHBondContact O-CD2 3.46Å; I146-F150 PolarHBondContact O-N 3.01Å; V147-F150 PolarHBondContact O-N 2.95Å; F150-I152 VanDerWaalsContact C-N 3.35Å; F150-I152 PolarHBondContact O-N 3.42Å; F150-V153 PolarHBondContact O-N 3.03Å; F150-T154 WeakPolarHBondContact O-CB 3.18Å; F150-T154 PolarHBondContact O-N 3.37Å; F150-T154 PolarHBondContact O-OG1 2.82Å; F150-A414 HydrophobicContact CD1-CB 3.93Å; F150-A414 HydrophobicContact CD2-CB 3.91Å; F150-A414 HydrophobicContact CE1-CB 3.82Å; F150-A414 HydrophobicContact CE2-CB 3.81Å; F150-A414 HydrophobicContact CG-CB 3.98Å; F150-A414 HydrophobicContact CZ-CB 3.76Å; F150-L415 HydrophobicContact CB-CD1 4.1Å; F150-L415 HydrophobicContact CB-CD2 3.83Å; F150-L415 HydrophobicContact CB-CG 3.79Å |
| 151 | L | 94.5 | Very high | 94.6 | Very high | 11 Ų | 11 | 42.1 Ų | 42.1 | 6% | 0.058 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61.7 | -41.4 | 172.6 | -76.7 | 170.1 | 0 | 0 | 0 | 112 | V147 F149 Q155 I361 L415 | V147-L151 HydrophobicContact CG1-CD1 3.76Å; V147-L151 HydrophobicContact CG1-CG 4.29Å; V147-L151 WeakPolarHBondContact O-CB 3.5Å; V147-L151 VanDerWaalsContact O-CG 3.27Å; V147-L151 WeakPolarHBondContact O-CG 3.25Å; V147-L151 PolarHBondContact O-N 2.97Å; F149-L151 VanDerWaalsContact C-N 3.34Å; F149-L151 PolarHBondContact O-N 3Å; L151-Q155 WeakPolarHBondContact O-CB 3.4Å; L151-Q155 VanDerWaalsContact O-CG 3.24Å; L151-Q155 WeakPolarHBondContact O-CG 3.48Å; L151-Q155 PolarHBondContact O-N 3.3Å; L151-I361 HydrophobicContact CB-CD1 4.28Å; L151-L415 HydrophobicContact CD2-CD1 3.88Å; L151-L415 HydrophobicContact CD2-CD2 4.39Å; L151-L415 HydrophobicContact CG-CD1 4.19Å; L151-L415 HydrophobicContact CG-CD2 4.12Å |
| 152 | I | 94.9 | Very high | 94.7 | Very high | 31 Ų | 31 | 36.7 Ų | 36.7 | 16% | 0.159 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -61.5 | -49.9 | 173.9 | -72.4 | 160.9 | 0 | 0 | 0 | 110.4 | S148 F149 F150 T154 Q155 L156 P358 I361 I362 | S148-I152 WeakPolarHBondContact O-CB 3.47Å; S148-I152 WeakPolarHBondContact O-CD1 3.19Å; S148-I152 VanDerWaalsContact O-CG1 3.23Å; S148-I152 WeakPolarHBondContact O-CG1 3.43Å; S148-I152 PolarHBondContact O-N 2.87Å; F149-I152 WeakPolarHBondContact O-CB 3.28Å; F149-I152 PolarHBondContact O-N 2.66Å; F150-I152 VanDerWaalsContact C-N 3.35Å; F150-I152 PolarHBondContact O-N 3.42Å; I152-T154 PolarHBondContact O-N 3.01Å; I152-Q155 PolarHBondContact O-N 3.41Å; I152-L156 HydrophobicContact CG2-CD1 4.06Å; I152-L156 WeakPolarHBondContact O-CB 3.19Å; I152-L156 PolarHBondContact O-N 3.13Å; I152-P358 HydrophobicContact CB-CB 4.39Å; I152-P358 HydrophobicContact CG1-CB 4.07Å; I152-P358 HydrophobicContact CG2-CB 4.28Å; I152-I361 HydrophobicContact CD1-CB 4.24Å; I152-I361 HydrophobicContact CD1-CG2 3.72Å; I152-I361 HydrophobicContact CG1-CB 4.29Å; I152-I361 HydrophobicContact CG1-CD1 4.14Å; I152-I361 HydrophobicContact CG1-CG2 4.21Å; I152-I362 HydrophobicContact CD1-CD1 3.91Å; I152-I362 HydrophobicContact CD1-CG1 3.63Å; I152-I362 HydrophobicContact CG1-CD1 4.11Å; I152-I362 HydrophobicContact CG1-CG1 4.2Å; I152-I362 HydrophobicContact CG2-CD1 3.91Å |
| 153 | V | 95.5 | Very high | 94.8 | Very high | 47 Ų | 47 | 29 Ų | 29 | 29% | 0.285 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -61.2 | -44.9 | -179.1 | 174.5 | 0 | 0 | 0 | 0 | 111.1 | F149 F150 Q155 G157 | F149-V153 HydrophobicContact CD1-CG2 4.43Å; F149-V153 HydrophobicContact CD2-CG2 4.36Å; F149-V153 HydrophobicContact CE1-CG2 4.03Å; F149-V153 HydrophobicContact CE2-CG2 3.96Å; F149-V153 HydrophobicContact CZ-CG2 3.78Å; F149-V153 WeakPolarHBondContact O-CG2 3.49Å; F149-V153 PolarHBondContact O-N 2.9Å; F150-V153 PolarHBondContact O-N 3.03Å; V153-Q155 PolarHBondContact O-N 3.39Å; V153-G157 PolarHBondContact O-N 3.4Å |
| 154 | T | 94.1 | Very high | 94.9 | Very high | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -59.2 | -47.5 | 175.9 | -61 | 0 | 0 | 0 | 0 | 111.3 | F150 I152 G157 F158 E274 S411 L415 | F150-T154 WeakPolarHBondContact O-CB 3.18Å; F150-T154 PolarHBondContact O-N 3.37Å; F150-T154 PolarHBondContact O-OG1 2.82Å; I152-T154 PolarHBondContact O-N 3.01Å; T154-G157 CarbonylContact O-C 3.58Å; T154-G157 WeakPolarHBondContact O-CA 3.42Å; T154-G157 PolarHBondContact O-N 3.19Å; T154-F158 HydrophobicContact CG2-CD1 4.01Å; T154-F158 HydrophobicContact CG2-CE1 3.43Å; T154-F158 VanDerWaalsContact CG2-CE1 3.43Å; T154-F158 HydrophobicContact CG2-CE2 4.18Å; T154-F158 HydrophobicContact CG2-CZ 3.53Å; T154-F158 WeakPolarHBondContact O-CD1 3.44Å; T154-F158 WeakPolarHBondContact O-CG 3.49Å; T154-F158 PolarHBondContact O-N 3.14Å; T154-E274 HydrophobicContact CG2-CG 3.82Å; T154-S411 VanDerWaalsContact CA-OG 3.3Å; T154-S411 WeakPolarHBondContact CA-OG 3.27Å; T154-S411 PolarHBondContact N-OG 2.97Å; T154-S411 WeakPolarHBondContact OG1-CB 3.34Å; T154-S411 PolarHBondContact OG1-OG 3.05Å; T154-L415 WeakPolarHBondContact OG1-CD1 3.45Å |
| 155 | Q | 94.3 | Very high | 94.9 | Very high | 10 Ų | 10 | 24 Ų | 24 | 5% | 0.047 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -71.5 | -38.6 | -176.4 | -65.7 | -5.6 | -20.5 | 0 | 0 | 113.3 | L151 I152 V153 G157 F158 C159 Q354 V357 P358 | L151-Q155 WeakPolarHBondContact O-CB 3.4Å; L151-Q155 VanDerWaalsContact O-CG 3.24Å; L151-Q155 WeakPolarHBondContact O-CG 3.48Å; L151-Q155 PolarHBondContact O-N 3.3Å; I152-Q155 PolarHBondContact O-N 3.41Å; V153-Q155 PolarHBondContact O-N 3.39Å; Q155-G157 VanDerWaalsContact C-N 3.31Å; Q155-F158 PolarHBondContact O-N 3.45Å; Q155-C159 PolarHBondContact O-N 3.04Å; Q155-C159 PolarHBondContact O-SG 2.81Å; Q155-Q354 HydrophobicContact CB-CG 4.33Å; Q155-Q354 VanDerWaalsContact CD-NE2 3.26Å; Q155-Q354 HydrophobicContact CG-CG 4.41Å; Q155-V357 HydrophobicContact CG-CB 3.88Å; Q155-V357 HydrophobicContact CG-CG1 3.94Å; Q155-P358 HydrophobicContact CB-CB 4.49Å; Q155-P358 HydrophobicContact CB-CG 3.81Å |
| 156 | L | 94.9 | Very high | 94.9 | Very high | 22 Ų | 22 | 18.3 Ų | 18.3 | 12% | 0.115 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -65.1 | -38.3 | 170.8 | -93.8 | 168.1 | 0 | 0 | 0 | 110.6 | I152 C159 C160 P358 L389 T390 | I152-L156 HydrophobicContact CG2-CD1 4.06Å; I152-L156 WeakPolarHBondContact O-CB 3.19Å; I152-L156 PolarHBondContact O-N 3.13Å; L156-C159 WeakPolarHBondContact O-CB 3.3Å; L156-C159 PolarHBondContact O-N 3.2Å; L156-C160 PolarHBondContact O-N 2.76Å; L156-C160 PolarHBondContact O-SG 2.98Å; L156-P358 HydrophobicContact CD2-CB 3.66Å; L156-P358 HydrophobicContact CD2-CG 3.47Å; L156-P358 VanDerWaalsContact CD2-CG 3.47Å; L156-L389 HydrophobicContact CD1-CD2 4.36Å; L156-T390 HydrophobicContact CB-CG2 3.94Å; L156-T390 HydrophobicContact CG-CG2 3.79Å; L156-T390 WeakPolarHBondContact O-CG2 3.49Å |
| 157 | G | 95.3 | Very high | 94.8 | Very high | 8 Ų | 8 | 16.2 Ų | 16.2 | 8% | 0.082 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -59.2 | -46.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | V153 T154 Q155 C159 C160 V161 V407 | V153-G157 PolarHBondContact O-N 3.4Å; T154-G157 CarbonylContact O-C 3.58Å; T154-G157 WeakPolarHBondContact O-CA 3.42Å; T154-G157 PolarHBondContact O-N 3.19Å; Q155-G157 VanDerWaalsContact C-N 3.31Å; G157-C159 VanDerWaalsContact C-N 3.31Å; G157-C159 PolarHBondContact O-N 2.89Å; G157-C160 WeakPolarHBondContact O-CB 3.31Å; G157-C160 PolarHBondContact O-N 3.03Å; G157-C160 VanDerWaalsContact O-N 3.09Å; G157-V161 WeakPolarHBondContact O-CG2 3.26Å; G157-V161 PolarHBondContact O-N 3.07Å; G157-V407 VanDerWaalsContact CA-CG2 3.49Å |
| 158 | F | 94.4 | Very high | 94.6 | Very high | 15 Ų | 15 | 17.8 Ų | 17.8 | 7% | 0.066 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -61.5 | -40.7 | 175.1 | -71.4 | 13.7 | 0 | 0 | 0 | 111 | T154 Q155 C160 V161 Y162 F271 E274 Q354 V407 | T154-F158 HydrophobicContact CG2-CD1 4.01Å; T154-F158 HydrophobicContact CG2-CE1 3.43Å; T154-F158 VanDerWaalsContact CG2-CE1 3.43Å; T154-F158 HydrophobicContact CG2-CE2 4.18Å; T154-F158 HydrophobicContact CG2-CZ 3.53Å; T154-F158 WeakPolarHBondContact O-CD1 3.44Å; T154-F158 WeakPolarHBondContact O-CG 3.49Å; T154-F158 PolarHBondContact O-N 3.14Å; Q155-F158 PolarHBondContact O-N 3.45Å; F158-C160 VanDerWaalsContact C-N 3.33Å; F158-C160 PolarHBondContact O-N 3Å; F158-V161 PolarHBondContact O-N 3.34Å; F158-Y162 HydrophobicContact CB-CE2 4.45Å; F158-Y162 WeakPolarHBondContact O-CB 3.25Å; F158-Y162 WeakPolarHBondContact O-CD1 3.46Å; F158-Y162 WeakPolarHBondContact O-CD2 3.26Å; F158-Y162 PolarHBondContact O-N 2.93Å; F158-F271 HydrophobicContact CD1-CD2 4.06Å; F158-F271 AromaticContact CD1-CE2 3.31Å; F158-F271 HydrophobicContact CD1-CE2 3.31Å; F158-F271 AromaticContact CD1-CZ 3.79Å; F158-F271 HydrophobicContact CD1-CZ 3.79Å; F158-F271 AromaticContact CE1-CD2 3.67Å; F158-F271 HydrophobicContact CE1-CD2 3.67Å; F158-F271 AromaticContact CE1-CE2 3.39Å; F158-F271 HydrophobicContact CE1-CE2 3.39Å; F158-F271 HydrophobicContact CE1-CG 4.44Å; F158-F271 AromaticContact CE1-CZ 3.95Å; F158-F271 HydrophobicContact CE1-CZ 3.95Å; F158-F271 HydrophobicContact CG-CE2 4.31Å; F158-F271 HydrophobicContact CG-CZ 4.39Å; F158-F271 HydrophobicContact CZ-CE2 4.43Å; F158-E274 HydrophobicContact CE1-CG 4.42Å; F158-E274 HydrophobicContact CZ-CB 3.97Å; F158-E274 HydrophobicContact CZ-CG 3.66Å; F158-Q354 HydrophobicContact CB-CG 3.9Å; F158-Q354 HydrophobicContact CD2-CG 3.85Å; F158-Q354 VanDerWaalsContact CD2-NE2 3.27Å; F158-Q354 HydrophobicContact CG-CG 4.34Å; F158-V407 HydrophobicContact CD1-CG1 3.95Å; F158-V407 HydrophobicContact CE1-CG1 4.03Å |
| 159 | C | 95.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 16.7 Ų | 16.7 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -60.4 | -39.6 | 172.9 | -68.9 | 0 | 0 | 0 | 0 | 112.2 | Q155 L156 G157 Y162 I163 Y351 T390 | Q155-C159 PolarHBondContact O-N 3.04Å; Q155-C159 PolarHBondContact O-SG 2.81Å; L156-C159 WeakPolarHBondContact O-CB 3.3Å; L156-C159 PolarHBondContact O-N 3.2Å; G157-C159 VanDerWaalsContact C-N 3.31Å; G157-C159 PolarHBondContact O-N 2.89Å; C159-Y162 PolarHBondContact O-N 2.64Å; C159-I163 VanDerWaalsContact O-CG1 3.31Å; C159-I163 WeakPolarHBondContact O-CG1 3.44Å; C159-I163 PolarHBondContact O-N 3.42Å; C159-Y351 HydrophobicContact CB-CD2 4.02Å; C159-Y351 HydrophobicContact CB-CE2 3.45Å; C159-Y351 VanDerWaalsContact CB-CE2 3.45Å; C159-Y351 WeakPolarHBondContact O-CE2 3.23Å; C159-T390 HydrophobicContact CB-CG2 3.88Å |
| 160 | C | 95.2 | Very high | 94.3 | Very high | 6 Ų | 6 | 12.8 Ų | 12.8 | 4% | 0.041 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -63.3 | -49.3 | 173.9 | -59.5 | 0 | 0 | 0 | 0 | 111.5 | L156 G157 F158 Y162 I163 V164 T390 V403 | L156-C160 PolarHBondContact O-N 2.76Å; L156-C160 PolarHBondContact O-SG 2.98Å; G157-C160 WeakPolarHBondContact O-CB 3.31Å; G157-C160 PolarHBondContact O-N 3.03Å; G157-C160 VanDerWaalsContact O-N 3.09Å; F158-C160 VanDerWaalsContact C-N 3.33Å; F158-C160 PolarHBondContact O-N 3Å; C160-Y162 VanDerWaalsContact C-N 3.27Å; C160-Y162 PolarHBondContact O-N 2.74Å; C160-I163 PolarHBondContact O-N 2.93Å; C160-I163 VanDerWaalsContact O-N 3.1Å; C160-V164 PolarHBondContact O-N 3.44Å; C160-V164 VanDerWaalsContact O-N 3.12Å; C160-T390 PolarHBondContact SG-O 3.07Å; C160-V403 HydrophobicContact CB-CG1 4.11Å |
| 161 | V | 95.3 | Very high | 93.9 | Very high | 0 Ų | 0 | 13.2 Ų | 13.2 | 0% | 0 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -54.6 | -44.4 | 175.6 | 169.6 | 0 | 0 | 0 | 0 | 111.1 | T67 G157 F158 V164 F165 F271 L400 V403 I404 | T67-V161 WeakPolarHBondContact OG1-CG1 3.36Å; G157-V161 WeakPolarHBondContact O-CG2 3.26Å; G157-V161 PolarHBondContact O-N 3.07Å; F158-V161 PolarHBondContact O-N 3.34Å; V161-V164 PolarHBondContact O-N 3.02Å; V161-F165 VanDerWaalsContact O-CB 3.27Å; V161-F165 WeakPolarHBondContact O-CB 3.34Å; V161-F165 PolarHBondContact O-N 2.98Å; V161-F271 HydrophobicContact CB-CZ 4.21Å; V161-F271 HydrophobicContact CG1-CZ 3.96Å; V161-F271 HydrophobicContact CG2-CE2 3.84Å; V161-F271 HydrophobicContact CG2-CZ 3.96Å; V161-L400 HydrophobicContact CG1-CD1 3.8Å; V161-L400 WeakPolarHBondContact O-CD1 3.26Å; V161-V403 HydrophobicContact CG2-CB 4.26Å; V161-V403 HydrophobicContact CG2-CG1 3.65Å; V161-I404 HydrophobicContact CB-CG1 4.29Å; V161-I404 HydrophobicContact CG1-CD1 3.95Å; V161-I404 HydrophobicContact CG1-CG1 3.54Å; V161-I404 HydrophobicContact CG2-CG1 3.68Å |
| 162 | Y | 94.9 | Very high | 93.6 | Very high | 9 Ų | 9 | 14 Ų | 14 | 4% | 0.035 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -64 | -39.4 | 177.8 | -66.3 | -17 | 0 | 0 | 0 | 112.5 | T67 F158 C159 C160 F165 L166 I347 T350 Y351 Q354 | T67-Y162 HydrophobicContact CG2-CD1 3.69Å; T67-Y162 HydrophobicContact CG2-CE1 3.77Å; T67-Y162 WeakPolarHBondContact OG1-CE1 3.15Å; F158-Y162 HydrophobicContact CB-CE2 4.45Å; F158-Y162 WeakPolarHBondContact O-CB 3.25Å; F158-Y162 WeakPolarHBondContact O-CD1 3.46Å; F158-Y162 WeakPolarHBondContact O-CD2 3.26Å; F158-Y162 PolarHBondContact O-N 2.93Å; C159-Y162 PolarHBondContact O-N 2.64Å; C160-Y162 VanDerWaalsContact C-N 3.27Å; C160-Y162 PolarHBondContact O-N 2.74Å; Y162-F165 PolarHBondContact O-N 3.45Å; Y162-L166 VanDerWaalsContact O-CB 3.28Å; Y162-L166 WeakPolarHBondContact O-CB 3.48Å; Y162-L166 WeakPolarHBondContact O-CD1 3.37Å; Y162-L166 WeakPolarHBondContact O-CG 3.33Å; Y162-L166 PolarHBondContact O-N 3.2Å; Y162-I347 HydrophobicContact CD1-CD1 4.35Å; Y162-I347 HydrophobicContact CD1-CG2 3.74Å; Y162-I347 HydrophobicContact CD2-CG2 4.29Å; Y162-I347 HydrophobicContact CE1-CD1 4.16Å; Y162-I347 HydrophobicContact CE1-CG2 4.49Å; Y162-I347 HydrophobicContact CG-CG2 3.62Å; Y162-T350 HydrophobicContact CE2-CG2 4.16Å; Y162-Y351 HydrophobicContact CD2-CD2 4.15Å; Y162-Q354 HydrophobicContact CE2-CB 4.18Å |
| 163 | I | 95.4 | Very high | 93.3 | Very high | 0 Ų | 0 | 13.2 Ų | 13.2 | 0% | 0 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -62.9 | -47.1 | 176.8 | -69.4 | 165.9 | 0 | 0 | 0 | 111.2 | C159 C160 L166 A167 M202 L209 Y351 C391 A394 | C159-I163 VanDerWaalsContact O-CG1 3.31Å; C159-I163 WeakPolarHBondContact O-CG1 3.44Å; C159-I163 PolarHBondContact O-N 3.42Å; C160-I163 PolarHBondContact O-N 2.93Å; C160-I163 VanDerWaalsContact O-N 3.1Å; I163-L166 PolarHBondContact O-N 3.46Å; I163-A167 PolarHBondContact O-N 2.83Å; I163-A167 VanDerWaalsContact O-N 3.08Å; I163-M202 HydrophobicContact CG2-CB 3.96Å; I163-M202 HydrophobicContact CG2-CG 3.82Å; I163-M202 HydrophobicContact CG2-SD 4.01Å; I163-L209 HydrophobicContact CD1-CD1 4.07Å; I163-L209 HydrophobicContact CG1-CD1 3.65Å; I163-Y351 HydrophobicContact CD1-CE2 3.97Å; I163-Y351 HydrophobicContact CG1-CE2 3.9Å; I163-C391 HydrophobicContact CD1-CB 4.25Å; I163-A394 HydrophobicContact CB-CB 3.91Å; I163-A394 HydrophobicContact CG2-CB 3.61Å |
| 164 | V | 94.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -63.3 | -47 | 177.4 | -175.2 | 0 | 0 | 0 | 0 | 110.4 | C160 V161 L166 A167 D168 M202 A394 L400 | C160-V164 PolarHBondContact O-N 3.44Å; C160-V164 VanDerWaalsContact O-N 3.12Å; V161-V164 PolarHBondContact O-N 3.02Å; V164-L166 PolarHBondContact O-N 3.28Å; V164-A167 PolarHBondContact O-N 3.02Å; V164-D168 PolarHBondContact O-N 2.88Å; V164-M202 HydrophobicContact CG2-SD 4.03Å; V164-A394 HydrophobicContact CG2-CB 3.75Å; V164-L400 HydrophobicContact CB-CD1 4.3Å; V164-L400 HydrophobicContact CG1-CB 3.87Å; V164-L400 HydrophobicContact CG1-CD1 4.43Å |
| 165 | F | 94.6 | Very high | 92.3 | Very high | 1 Ų | 1 | 14.9 Ų | 14.9 | 0% | 0.004 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -58.6 | -43.9 | 177.9 | 179.2 | -87.3 | 0 | 0 | 0 | 112.7 | T67 L70 V161 Y162 N169 Y343 I347 L400 | T67-F165 HydrophobicContact CG2-CB 4.27Å; T67-F165 HydrophobicContact CG2-CD1 4.08Å; T67-F165 HydrophobicContact CG2-CD2 3.91Å; T67-F165 HydrophobicContact CG2-CE1 4.43Å; T67-F165 HydrophobicContact CG2-CE2 4.26Å; T67-F165 HydrophobicContact CG2-CG 3.81Å; L70-F165 HydrophobicContact CD1-CE2 3.49Å; L70-F165 VanDerWaalsContact CD1-CE2 3.49Å; L70-F165 HydrophobicContact CD1-CZ 3.56Å; V161-F165 VanDerWaalsContact O-CB 3.27Å; V161-F165 WeakPolarHBondContact O-CB 3.34Å; V161-F165 PolarHBondContact O-N 2.98Å; Y162-F165 PolarHBondContact O-N 3.45Å; F165-N169 WeakPolarHBondContact CD2-ND2 3.31Å; F165-N169 WeakPolarHBondContact CE1-ND2 3.32Å; F165-N169 VanDerWaalsContact CE2-ND2 3.32Å; F165-N169 WeakPolarHBondContact CE2-ND2 3.39Å; F165-N169 VanDerWaalsContact CZ-ND2 3.32Å; F165-N169 WeakPolarHBondContact CZ-ND2 3.36Å; F165-N169 WeakPolarHBondContact O-CB 3.44Å; F165-N169 PolarHBondContact O-N 3.23Å; F165-N169 VanDerWaalsContact O-N 3.09Å; F165-N169 PolarHBondContact O-ND2 2.82Å; F165-Y343 HydrophobicContact CZ-CD1 4.36Å; F165-Y343 HydrophobicContact CZ-CG 4.43Å; F165-I347 HydrophobicContact CD1-CB 4.48Å; F165-I347 HydrophobicContact CD1-CG1 4.06Å; F165-I347 HydrophobicContact CD1-CG2 4.39Å; F165-I347 HydrophobicContact CE1-CG1 3.9Å; F165-L400 HydrophobicContact CB-CD1 3.97Å; F165-L400 HydrophobicContact CB-CD2 4.48Å; F165-L400 HydrophobicContact CD2-CD2 4.04Å |
| 166 | L | 94.4 | Very high | 91.5 | Very high | 0 Ų | 0 | 14.4 Ų | 14.4 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -61.8 | -45.3 | 177.8 | -75.2 | 167.1 | 0 | 0 | 0 | 111.2 | Y162 I163 V164 L170 F205 L209 I344 I347 L348 | Y162-L166 VanDerWaalsContact O-CB 3.28Å; Y162-L166 WeakPolarHBondContact O-CB 3.48Å; Y162-L166 WeakPolarHBondContact O-CD1 3.37Å; Y162-L166 WeakPolarHBondContact O-CG 3.33Å; Y162-L166 PolarHBondContact O-N 3.2Å; I163-L166 PolarHBondContact O-N 3.46Å; V164-L166 PolarHBondContact O-N 3.28Å; L166-L170 VanDerWaalsContact O-CB 3.24Å; L166-L170 WeakPolarHBondContact O-CB 3.32Å; L166-L170 PolarHBondContact O-N 2.58Å; L166-F205 HydrophobicContact CB-CD2 4.04Å; L166-F205 HydrophobicContact CB-CE2 3.78Å; L166-F205 HydrophobicContact CB-CZ 4.04Å; L166-F205 WeakPolarHBondContact O-CE2 3.49Å; L166-L209 HydrophobicContact CD1-CD2 4.47Å; L166-I344 HydrophobicContact CD2-CB 4.08Å; L166-I344 HydrophobicContact CD2-CG1 4.26Å; L166-I344 HydrophobicContact CD2-CG2 3.79Å; L166-I344 WeakPolarHBondContact CD2-O 3.41Å; L166-I347 HydrophobicContact CD1-CG2 4.26Å; L166-I347 HydrophobicContact CD2-CB 4.24Å; L166-I347 HydrophobicContact CD2-CG2 4.18Å; L166-I347 HydrophobicContact CG-CG2 4.01Å; L166-L348 HydrophobicContact CD1-CD2 3.68Å; L166-L348 HydrophobicContact CD1-CG 4.09Å; L166-L348 HydrophobicContact CD2-CD2 4.32Å; L166-L348 HydrophobicContact CD2-CG 3.86Å |
| 167 | A | 92.9 | Very high | 90.6 | Very high | 0 Ų | 0 | 17.1 Ų | 17.1 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -64.5 | -47.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | I163 V164 N169 L170 K171 M202 | I163-A167 PolarHBondContact O-N 2.83Å; I163-A167 VanDerWaalsContact O-N 3.08Å; V164-A167 PolarHBondContact O-N 3.02Å; A167-N169 PolarHBondContact O-N 2.98Å; A167-L170 PolarHBondContact O-N 3.38Å; A167-K171 VanDerWaalsContact O-CB 3.23Å; A167-K171 WeakPolarHBondContact O-CB 3.41Å; A167-K171 PolarHBondContact O-N 3.37Å; A167-M202 HydrophobicContact CB-CB 4.31Å; A167-M202 HydrophobicContact CB-CG 3.34Å |
| 168 | D | 91.2 | Very high | 89.3 | Confident | 33 Ų | 33 | 24.2 Ų | 24.2 | 18% | 0.176 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -65.2 | -41.2 | -178.8 | -73.2 | -20.7 | 0 | 0 | 0 | 112.4 | V164 Q172 L328 | V164-D168 PolarHBondContact O-N 2.88Å; D168-Q172 PolarHBondContact O-N 3.11Å; D168-Q172 VanDerWaalsContact O-N 3.13Å; D168-L328 HydrophobicContact CB-CD1 4.08Å; D168-L328 HydrophobicContact CB-CD2 3.92Å |
| 169 | N | 92.1 | Very high | 88.1 | Confident | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -70.9 | -40.9 | 176.8 | -74.5 | -90.9 | 0 | 0 | 0 | 111.4 | F165 A167 Q172 V173 S327 I344 | F165-N169 WeakPolarHBondContact CD2-ND2 3.31Å; F165-N169 WeakPolarHBondContact CE1-ND2 3.32Å; F165-N169 VanDerWaalsContact CE2-ND2 3.32Å; F165-N169 WeakPolarHBondContact CE2-ND2 3.39Å; F165-N169 VanDerWaalsContact CZ-ND2 3.32Å; F165-N169 WeakPolarHBondContact CZ-ND2 3.36Å; F165-N169 WeakPolarHBondContact O-CB 3.44Å; F165-N169 PolarHBondContact O-N 3.23Å; F165-N169 VanDerWaalsContact O-N 3.09Å; F165-N169 PolarHBondContact O-ND2 2.82Å; A167-N169 PolarHBondContact O-N 2.98Å; N169-Q172 PolarHBondContact O-N 3.38Å; N169-V173 WeakPolarHBondContact O-CG2 3.15Å; N169-V173 PolarHBondContact O-N 3.23Å; N169-S327 PolarHBondContact ND2-OG 3.38Å; N169-S327 VanDerWaalsContact OD1-CB 3.31Å; N169-S327 WeakPolarHBondContact OD1-CB 3.33Å; N169-S327 PolarHBondContact OD1-OG 3.1Å; N169-I344 HydrophobicContact CB-CD1 3.94Å; N169-I344 HydrophobicContact CB-CG1 3.97Å |
| 170 | L | 91.5 | Very high | 87 | Confident | 38 Ų | 38 | 25.8 Ų | 25.8 | 20% | 0.199 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -65.2 | -42.4 | 177 | -179.9 | 61.8 | 0 | 0 | 0 | 111.2 | L166 A167 Q172 V173 V174 Y201 F205 I344 | L166-L170 VanDerWaalsContact O-CB 3.24Å; L166-L170 WeakPolarHBondContact O-CB 3.32Å; L166-L170 PolarHBondContact O-N 2.58Å; A167-L170 PolarHBondContact O-N 3.38Å; L170-Q172 VanDerWaalsContact C-N 3.35Å; L170-Q172 PolarHBondContact O-N 3.08Å; L170-V173 PolarHBondContact O-N 3.48Å; L170-V173 VanDerWaalsContact O-N 3.15Å; L170-V174 HydrophobicContact CD1-CG2 3.95Å; L170-V174 HydrophobicContact CG-CG2 4.23Å; L170-V174 WeakPolarHBondContact O-CG2 3.35Å; L170-V174 PolarHBondContact O-N 2.98Å; L170-Y201 HydrophobicContact CD2-CD1 3.95Å; L170-Y201 HydrophobicContact CD2-CE1 4.45Å; L170-Y201 HydrophobicContact CG-CD1 4.05Å; L170-Y201 HydrophobicContact CG-CE1 4.26Å; L170-F205 HydrophobicContact CB-CE2 3.84Å; L170-F205 HydrophobicContact CB-CZ 3.94Å; L170-F205 HydrophobicContact CD2-CD2 4.45Å; L170-F205 HydrophobicContact CD2-CE1 4.36Å; L170-F205 HydrophobicContact CD2-CE2 3.49Å; L170-F205 VanDerWaalsContact CD2-CE2 3.49Å; L170-F205 HydrophobicContact CD2-CZ 3.45Å; L170-F205 VanDerWaalsContact CD2-CZ 3.45Å; L170-F205 HydrophobicContact CG-CE2 4.29Å; L170-F205 HydrophobicContact CG-CZ 4.24Å; L170-I344 HydrophobicContact CB-CD1 4.1Å |
| 171 | K | 88.4 | Confident | 85.8 | Confident | 47 Ų | 47 | 28.7 Ų | 28.7 | 20% | 0.204 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -54.9 | -50.6 | 174.9 | 175.4 | 168.3 | 176.3 | 162.4 | 0 | 111 | A167 V173 V174 E175 M196 Y201 | A167-K171 VanDerWaalsContact O-CB 3.23Å; A167-K171 WeakPolarHBondContact O-CB 3.41Å; A167-K171 PolarHBondContact O-N 3.37Å; K171-V173 VanDerWaalsContact C-N 3.32Å; K171-V173 PolarHBondContact O-N 2.9Å; K171-V174 PolarHBondContact O-N 2.91Å; K171-E175 WeakPolarHBondContact CE-OE1 3.18Å; K171-E175 WeakPolarHBondContact CE-OE2 3.35Å; K171-E175 HydrophobicContact CG-CG 4.3Å; K171-E175 VanDerWaalsContact CG-OE2 3.31Å; K171-E175 WeakPolarHBondContact CG-OE2 3.14Å; K171-E175 IonicContact NZ-OE1 2.62Å; K171-E175 WeakPolarHBondContact O-CB 3.2Å; K171-E175 WeakPolarHBondContact O-CG 3.16Å; K171-E175 PolarHBondContact O-N 3.46Å; K171-M196 PolarHBondContact NZ-O 3.41Å; K171-Y201 HydrophobicContact CB-CD2 3.78Å; K171-Y201 HydrophobicContact CB-CE2 3.7Å; K171-Y201 HydrophobicContact CB-CG 4.23Å; K171-Y201 HydrophobicContact CD-CD2 4.15Å; K171-Y201 HydrophobicContact CD-CE2 3.99Å; K171-Y201 HydrophobicContact CG-CD2 4.11Å; K171-Y201 HydrophobicContact CG-CE2 3.69Å |
| 172 | Q | 86.3 | Confident | 84.6 | Confident | 28 Ų | 28 | 35 Ų | 35 | 13% | 0.131 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62.7 | -35.2 | 176.9 | -76 | -162.7 | 6 | 0 | 0 | 114 | D168 N169 L170 A176 L328 | D168-Q172 PolarHBondContact O-N 3.11Å; D168-Q172 VanDerWaalsContact O-N 3.13Å; N169-Q172 PolarHBondContact O-N 3.38Å; L170-Q172 VanDerWaalsContact C-N 3.35Å; L170-Q172 PolarHBondContact O-N 3.08Å; Q172-A176 WeakPolarHBondContact O-CB 3.4Å; Q172-A176 PolarHBondContact O-N 2.92Å; Q172-L328 HydrophobicContact CG-CD2 4.24Å; Q172-L328 PolarHBondContact NE2-O 3.33Å; Q172-L328 PolarHBondContact OE1-O 3.43Å |
| 173 | V | 88.6 | Confident | 83.4 | Confident | 14 Ų | 14 | 40 Ų | 40 | 9% | 0.085 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64.2 | -53.2 | 174.5 | 171.8 | 0 | 0 | 0 | 0 | 109.4 | N169 L170 K171 A176 V177 K340 L341 | N169-V173 WeakPolarHBondContact O-CG2 3.15Å; N169-V173 PolarHBondContact O-N 3.23Å; L170-V173 PolarHBondContact O-N 3.48Å; L170-V173 VanDerWaalsContact O-N 3.15Å; K171-V173 VanDerWaalsContact C-N 3.32Å; K171-V173 PolarHBondContact O-N 2.9Å; V173-A176 PolarHBondContact O-N 3.37Å; V173-V177 WeakPolarHBondContact O-CG2 3.33Å; V173-V177 PolarHBondContact O-N 3.06Å; V173-V177 VanDerWaalsContact O-N 3.07Å; V173-K340 HydrophobicContact CG2-CB 3.71Å; V173-K340 HydrophobicContact CG2-CD 4.19Å; V173-L341 HydrophobicContact CG1-CD2 4.13Å; V173-L341 HydrophobicContact CG1-CG 4.32Å; V173-L341 HydrophobicContact CG2-CD2 4.42Å; V173-L341 HydrophobicContact CG2-CG 4.34Å |
| 174 | V | 86.3 | Confident | 82 | Confident | 64 Ų | 64 | 42.1 Ų | 42.1 | 39% | 0.388 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -62.3 | -47.5 | -176.1 | 172.8 | 0 | 0 | 0 | 0 | 112 | L170 K171 A176 V177 Y201 | L170-V174 HydrophobicContact CD1-CG2 3.95Å; L170-V174 HydrophobicContact CG-CG2 4.23Å; L170-V174 WeakPolarHBondContact O-CG2 3.35Å; L170-V174 PolarHBondContact O-N 2.98Å; K171-V174 PolarHBondContact O-N 2.91Å; V174-A176 PolarHBondContact O-N 2.85Å; V174-V177 PolarHBondContact O-N 3.47Å; V174-Y201 HydrophobicContact CB-CE1 4.36Å; V174-Y201 WeakPolarHBondContact CG1-OH 3.34Å; V174-Y201 HydrophobicContact CG2-CE1 4.22Å |
| 175 | E | 82.3 | Confident | 80.4 | Confident | 17 Ų | 17 | 51.7 Ų | 51.7 | 8% | 0.079 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -68.3 | -18.7 | 179.7 | -66.2 | -178.4 | 149.7 | 0 | 0 | 112.7 | K171 L192 T195 | K171-E175 WeakPolarHBondContact CE-OE1 3.18Å; K171-E175 WeakPolarHBondContact CE-OE2 3.35Å; K171-E175 HydrophobicContact CG-CG 4.3Å; K171-E175 VanDerWaalsContact CG-OE2 3.31Å; K171-E175 WeakPolarHBondContact CG-OE2 3.14Å; K171-E175 IonicContact NZ-OE1 2.62Å; K171-E175 WeakPolarHBondContact O-CB 3.2Å; K171-E175 WeakPolarHBondContact O-CG 3.16Å; K171-E175 PolarHBondContact O-N 3.46Å; E175-L192 HydrophobicContact CB-CB 4.2Å; E175-L192 HydrophobicContact CB-CD2 3.82Å; E175-L192 HydrophobicContact CB-CG 3.77Å; E175-T195 PolarHBondContact OE1-N 3.39Å; E175-T195 PolarHBondContact OE1-OG1 2.85Å |
| 176 | A | 78.4 | Confident | 78.2 | Confident | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -95.6 | -11 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | Q172 V173 V174 N178 S179 T180 N332 | Q172-A176 WeakPolarHBondContact O-CB 3.4Å; Q172-A176 PolarHBondContact O-N 2.92Å; V173-A176 PolarHBondContact O-N 3.37Å; V174-A176 PolarHBondContact O-N 2.85Å; A176-N178 VanDerWaalsContact C-N 3.27Å; A176-N178 PolarHBondContact O-N 3.31Å; A176-S179 CarbonylContact O-C 3.44Å; A176-S179 PolarHBondContact O-N 3.38Å; A176-S179 PolarHBondContact O-OG 2.99Å; A176-T180 PolarHBondContact O-N 2.91Å; A176-T180 PolarHBondContact O-OG1 2.79Å; A176-N332 HydrophobicContact CB-CB 4.08Å |
| 177 | V | 76.6 | Confident | 76.1 | Confident | 79 Ų | 79 | 60.4 Ų | 60.4 | 48% | 0.479 | 32% | 0.323 | S | S | . | . | G | 310 helix | trans | -52.9 | -45.3 | -176 | 162.3 | 0 | 0 | 0 | 0 | 111.7 | V173 V174 S179 | V173-V177 WeakPolarHBondContact O-CG2 3.33Å; V173-V177 PolarHBondContact O-N 3.06Å; V173-V177 VanDerWaalsContact O-N 3.07Å; V174-V177 PolarHBondContact O-N 3.47Å; V177-S179 VanDerWaalsContact C-N 3.27Å; V177-S179 PolarHBondContact O-N 2.78Å |
| 178 | N | 68.6 | Low | 73.7 | Confident | 158 Ų | 158 | 67.5 Ų | 67.5 | 85% | 0.845 | 36% | 0.357 | S | S | * | . | G | 310 helix | trans | -75.1 | -13.1 | -177.7 | -67.1 | -13.5 | 0 | 0 | 0 | 114 | A176 | A176-N178 VanDerWaalsContact C-N 3.27Å; A176-N178 PolarHBondContact O-N 3.31Å |
| 179 | S | 68.4 | Low | 71.5 | Confident | 26 Ų | 26 | 72.3 Ų | 72.3 | 18% | 0.182 | 39% | 0.387 | C | S | . | . | G | 310 helix | trans | -117.7 | 6.6 | -179.9 | 66 | 0 | 0 | 0 | 0 | 113.2 | A176 V177 T181 | A176-S179 CarbonylContact O-C 3.44Å; A176-S179 PolarHBondContact O-N 3.38Å; A176-S179 PolarHBondContact O-OG 2.99Å; V177-S179 VanDerWaalsContact C-N 3.27Å; V177-S179 PolarHBondContact O-N 2.78Å; S179-T181 PolarHBondContact O-N 3.31Å; S179-T181 PolarHBondContact O-OG1 3.41Å |
| 180 | T | 70.8 | Confident | 69.3 | Low | 22 Ų | 22 | 75.3 Ų | 75.3 | 14% | 0.135 | 41% | 0.406 | C | S | . | . | trans | -72.3 | 119.1 | -174.8 | -65.4 | 0 | 0 | 0 | 0 | 110.3 | A176 N332 W334 Q337 | A176-T180 PolarHBondContact O-N 2.91Å; A176-T180 PolarHBondContact O-OG1 2.79Å; T180-N332 WeakPolarHBondContact CA-O 3.12Å; T180-W334 HydrophobicContact CG2-CB 4.49Å; T180-W334 HydrophobicContact CG2-CD2 3.72Å; T180-W334 HydrophobicContact CG2-CE3 4.42Å; T180-W334 HydrophobicContact CG2-CG 3.73Å; T180-W334 HydrophobicContact CG2-CZ2 4.28Å; T180-Q337 HydrophobicContact CG2-CG 4.05Å | ||
| 181 | T | 70 | Confident | 67.2 | Low | 66 Ų | 66 | 80.8 Ų | 80.8 | 41% | 0.405 | 43% | 0.433 | S | S | . | . | B | Isolated β-bridge | trans | -109.5 | 150.2 | -173.2 | -67.1 | 0 | 0 | 0 | 0 | 110.8 | S179 N183 N332 C333 | S179-T181 PolarHBondContact O-N 3.31Å; S179-T181 PolarHBondContact O-OG1 3.41Å; T181-N183 VanDerWaalsContact C-N 3.35Å; T181-N183 HydrophobicContact CG2-CB 4.04Å; T181-N332 PolarHBondContact N-O 3.32Å; T181-C333 VanDerWaalsContact O-CA 3.28Å; T181-C333 WeakPolarHBondContact O-CA 3.49Å; T181-C333 VanDerWaalsContact O-CB 3.23Å; T181-C333 WeakPolarHBondContact O-CB 3.24Å |
| 182 | N | 70.9 | Confident | 65.5 | Low | 132 Ų | 132 | 81.4 Ų | 81.4 | 71% | 0.706 | 44% | 0.438 | S | S | * | . | S | Bend | trans | -73.3 | -26.9 | 177.6 | -71.3 | -24.3 | 0 | 0 | 0 | 112.8 | C184 | N182-C184 PolarHBondContact O-N 2.97Š|
| 183 | N | 68.8 | Low | 63.7 | Low | 114 Ų | 114 | 84 Ų | 84 | 61% | 0.61 | 46% | 0.456 | S | S | * | . | trans | -79 | 105.6 | 177.6 | -63.3 | -21 | 0 | 0 | 0 | 110.8 | T181 Y185 S186 | T181-N183 VanDerWaalsContact C-N 3.35Å; T181-N183 HydrophobicContact CG2-CB 4.04Å; N183-Y185 PolarHBondContact O-N 3.27Å; N183-S186 PolarHBondContact O-OG 3.14Å | ||
| 184 | C | 66.9 | Low | 62.1 | Low | 45 Ų | 45 | 88.9 Ų | 88.9 | 30% | 0.304 | 49% | 0.488 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.1 | 3 | 175.3 | -57.5 | 0 | 0 | 0 | 0 | 114.4 | N182 C333 Y336 | N182-C184 PolarHBondContact O-N 2.97Å; C184-C333 HydrophobicContact CB-CB 3.91Å; C184-C333 WeakPolarHBondContact CB-SG 3.32Å; C184-C333 WeakPolarHBondContact SG-CB 3.36Å; C184-C333 CovalentContact SG-SG 2.04Å; C184-C333 PolarHBondContact SG-SG 3.03Å; C184-Y336 HydrophobicContact CB-CE2 4.2Å |
| 185 | Y | 59.8 | Low | 60.6 | Low | 202 Ų | 202 | 89 Ų | 89 | 79% | 0.792 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.6 | -20.2 | -176.1 | -87.1 | -82.1 | 0 | 0 | 0 | 114.7 | N183 | N183-Y185 PolarHBondContact O-N 3.27Š|
| 186 | S | 49.8 | Very low | 59.6 | Low | 55 Ų | 55 | 93 Ų | 93 | 39% | 0.385 | 51% | 0.509 | S | S | . | . | trans | -84.1 | 117.6 | 179.9 | 45.8 | 0 | 0 | 0 | 0 | 110.5 | N183 E188 | N183-S186 PolarHBondContact O-OG 3.14Å; S186-E188 PolarHBondContact O-N 3.2Å | ||
| 187 | N | 49.1 | Very low | 59.4 | Low | 128 Ų | 128 | 96.8 Ų | 96.8 | 68% | 0.684 | 53% | 0.53 | S | S | * | . | trans | -71.5 | 40.8 | 171.5 | -74.5 | -24.4 | 0 | 0 | 0 | 112.8 | T189 | N187-T189 PolarHBondContact O-N 2.85Å; N187-T189 VanDerWaalsContact O-N 3.16Å | ||
| 188 | E | 43.7 | Very low | 59.2 | Low | 150 Ų | 150 | 93.8 Ų | 93.8 | 70% | 0.701 | 51% | 0.512 | S | S | * | . | trans | -83.2 | 90.4 | 169.5 | -68.1 | -161.2 | 176.8 | 0 | 0 | 109 | S186 V190 | S186-E188 PolarHBondContact O-N 3.2Å; E188-V190 HydrophobicContact CB-CG2 4.07Å; E188-V190 PolarHBondContact O-N 3.36Å | ||
| 189 | T | 44 | Very low | 60 | Low | 134 Ų | 134 | 90.6 Ų | 90.6 | 82% | 0.822 | 49% | 0.488 | S | S | * | . | trans | -69.6 | 71.6 | 160.9 | 53.1 | 0 | 0 | 0 | 0 | 108.8 | N187 I191 | N187-T189 PolarHBondContact O-N 2.85Å; N187-T189 VanDerWaalsContact O-N 3.16Å; T189-I191 PolarHBondContact O-N 3.41Å | ||
| 190 | V | 46.1 | Very low | 60.7 | Low | 63 Ų | 63 | 93.4 Ų | 93.4 | 38% | 0.382 | 50% | 0.5 | S | S | . | . | trans | -54.6 | 137.7 | 176.2 | -178.9 | 0 | 0 | 0 | 0 | 108.9 | E188 L192 | E188-V190 HydrophobicContact CB-CG2 4.07Å; E188-V190 PolarHBondContact O-N 3.36Å; V190-L192 PolarHBondContact O-N 3.43Å | ||
| 191 | I | 47.1 | Very low | 61.5 | Low | 152 Ų | 152 | 93.4 Ų | 93.4 | 78% | 0.779 | 50% | 0.498 | S | S | * | . | trans | -55.1 | 107.2 | -176.5 | -58.9 | 167.6 | 0 | 0 | 0 | 109.2 | T189 T193 | T189-I191 PolarHBondContact O-N 3.41Å; I191-T193 PolarHBondContact O-N 2.79Å; I191-T193 VanDerWaalsContact O-N 3.15Å | ||
| 192 | L | 53.2 | Low | 62.3 | Low | 60 Ų | 60 | 90.2 Ų | 90.2 | 31% | 0.314 | 48% | 0.479 | S | S | . | . | trans | -60.1 | 117.2 | 167.4 | -92 | 64 | 0 | 0 | 0 | 107.1 | E175 V190 P194 | E175-L192 HydrophobicContact CB-CB 4.2Å; E175-L192 HydrophobicContact CB-CD2 3.82Å; E175-L192 HydrophobicContact CB-CG 3.77Å; V190-L192 PolarHBondContact O-N 3.43Å; L192-P194 VanDerWaalsContact O-CD 3.27Å; L192-P194 WeakPolarHBondContact O-CD 3.41Å | ||
| 193 | T | 48.1 | Very low | 63.1 | Low | 83 Ų | 83 | 88 Ų | 88 | 51% | 0.509 | 47% | 0.467 | S | S | . | . | trans | -66.7 | 116.3 | 169.3 | 44.1 | 0 | 0 | 0 | 0 | 107.7 | I191 T195 | I191-T193 PolarHBondContact O-N 2.79Å; I191-T193 VanDerWaalsContact O-N 3.15Å; T193-T195 PolarHBondContact O-N 3.25Å | ||
| 194 | P | 54.3 | Low | 64.1 | Low | 116 Ų | 116 | 85.2 Ų | 85.2 | 75% | 0.753 | 46% | 0.456 | S | S | * | . | trans | -71.2 | 106.6 | -176.7 | 28.2 | -32.7 | 0 | 0 | 0 | 108.3 | L192 | L192-P194 VanDerWaalsContact O-CD 3.27Å; L192-P194 WeakPolarHBondContact O-CD 3.41Å | ||
| 195 | T | 54.8 | Low | 65.2 | Low | 67 Ų | 67 | 83.9 Ų | 83.9 | 41% | 0.411 | 45% | 0.445 | S | S | . | . | trans | -92.6 | -44.1 | -173 | 50.5 | 0 | 0 | 0 | 0 | 112.3 | E175 T193 Y201 | E175-T195 PolarHBondContact OE1-N 3.39Å; E175-T195 PolarHBondContact OE1-OG1 2.85Å; T193-T195 PolarHBondContact O-N 3.25Å; T195-Y201 PolarHBondContact OG1-OH 3.36Å | ||
| 196 | M | 61.8 | Low | 66.6 | Low | 100 Ų | 100 | 76.1 Ų | 76.1 | 49% | 0.493 | 42% | 0.417 | S | S | . | . | S | Bend | trans | -148.5 | 152 | -172.6 | -65.3 | -87.9 | 86.4 | 0 | 0 | 111.7 | K171 L200 Y201 | K171-M196 PolarHBondContact NZ-O 3.41Å; M196-L200 HydrophobicContact CB-CB 4.5Å; M196-L200 HydrophobicContact CB-CD1 4.24Å; M196-L200 HydrophobicContact CE-CD1 4.03Å; M196-L200 HydrophobicContact CG-CD1 4.49Å; M196-L200 HydrophobicContact SD-CD1 3.52Å; M196-L200 VanDerWaalsContact SD-CD1 3.52Å; M196-Y201 HydrophobicContact CB-CD2 4.3Å; M196-Y201 HydrophobicContact CB-CE2 3.73Å |
| 197 | D | 74.8 | Confident | 68.6 | Low | 81 Ų | 81 | 77.3 Ų | 77.3 | 43% | 0.433 | 42% | 0.423 | S | S | . | . | trans | -64.4 | 144.9 | 168.2 | -175.1 | 15.2 | 0 | 0 | 0 | 110.9 | R199 L200 | D197-R199 PolarHBondContact O-N 3.18Å; D197-R199 WeakPolarHBondContact OD2-CB 3.37Å; D197-R199 WeakPolarHBondContact OD2-CD 3.39Å; D197-L200 WeakPolarHBondContact O-CB 3.47Å; D197-L200 PolarHBondContact O-N 2.93Å | ||
| 198 | S | 72.8 | Confident | 70.5 | Confident | 15 Ų | 15 | 77.7 Ų | 77.7 | 11% | 0.105 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -61.4 | -27.5 | -179.1 | 60 | 0 | 0 | 0 | 0 | 112.1 | L200 Y201 M202 | S198-L200 VanDerWaalsContact C-N 3.28Å; S198-L200 PolarHBondContact O-N 3.49Å; S198-Y201 WeakPolarHBondContact O-CB 3.37Å; S198-Y201 PolarHBondContact O-N 3.02Å; S198-M202 PolarHBondContact O-N 3.36Å |
| 199 | R | 84.2 | Confident | 72.8 | Confident | 92 Ų | 92 | 70.5 Ų | 70.5 | 35% | 0.347 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -58.1 | -35.3 | 172.1 | -64.9 | 178.8 | 162.7 | 157.7 | -1.2 | 113.6 | D197 M202 L203 V395 | D197-R199 PolarHBondContact O-N 3.18Å; D197-R199 WeakPolarHBondContact OD2-CB 3.37Å; D197-R199 WeakPolarHBondContact OD2-CD 3.39Å; R199-M202 HydrophobicContact CG-CE 4.15Å; R199-M202 PolarHBondContact O-N 2.88Å; R199-L203 WeakPolarHBondContact O-CG 3.39Å; R199-L203 PolarHBondContact O-N 3.29Å; R199-V395 HydrophobicContact CB-CG1 4.31Å; R199-V395 HydrophobicContact CG-CG1 4.08Å; R199-V395 PolarHBondContact NE-O 3.41Å; R199-V395 PolarHBondContact NH2-O 2.94Å |
| 200 | L | 84.5 | Confident | 75.1 | Confident | 84 Ų | 84 | 65.5 Ų | 65.5 | 44% | 0.44 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -71.3 | -37.4 | 177 | -64.3 | 172.5 | 0 | 0 | 0 | 111.2 | M196 D197 S198 L203 S204 | M196-L200 HydrophobicContact CB-CB 4.5Å; M196-L200 HydrophobicContact CB-CD1 4.24Å; M196-L200 HydrophobicContact CE-CD1 4.03Å; M196-L200 HydrophobicContact CG-CD1 4.49Å; M196-L200 HydrophobicContact SD-CD1 3.52Å; M196-L200 VanDerWaalsContact SD-CD1 3.52Å; D197-L200 WeakPolarHBondContact O-CB 3.47Å; D197-L200 PolarHBondContact O-N 2.93Å; S198-L200 VanDerWaalsContact C-N 3.28Å; S198-L200 PolarHBondContact O-N 3.49Å; L200-L203 PolarHBondContact O-N 2.99Å; L200-S204 WeakPolarHBondContact O-CB 3.48Å; L200-S204 PolarHBondContact O-N 3.17Å |
| 201 | Y | 85.9 | Confident | 77.2 | Confident | 22 Ų | 22 | 68 Ų | 68 | 9% | 0.086 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -63.8 | -41.7 | 171.9 | -73.4 | -81.2 | 0 | 0 | 0 | 111.8 | L170 K171 V174 T195 M196 S198 L203 S204 F205 | L170-Y201 HydrophobicContact CD2-CD1 3.95Å; L170-Y201 HydrophobicContact CD2-CE1 4.45Å; L170-Y201 HydrophobicContact CG-CD1 4.05Å; L170-Y201 HydrophobicContact CG-CE1 4.26Å; K171-Y201 HydrophobicContact CB-CD2 3.78Å; K171-Y201 HydrophobicContact CB-CE2 3.7Å; K171-Y201 HydrophobicContact CB-CG 4.23Å; K171-Y201 HydrophobicContact CD-CD2 4.15Å; K171-Y201 HydrophobicContact CD-CE2 3.99Å; K171-Y201 HydrophobicContact CG-CD2 4.11Å; K171-Y201 HydrophobicContact CG-CE2 3.69Å; V174-Y201 HydrophobicContact CB-CE1 4.36Å; V174-Y201 WeakPolarHBondContact CG1-OH 3.34Å; V174-Y201 HydrophobicContact CG2-CE1 4.22Å; T195-Y201 PolarHBondContact OG1-OH 3.36Å; M196-Y201 HydrophobicContact CB-CD2 4.3Å; M196-Y201 HydrophobicContact CB-CE2 3.73Å; S198-Y201 WeakPolarHBondContact O-CB 3.37Å; S198-Y201 PolarHBondContact O-N 3.02Å; Y201-L203 PolarHBondContact O-N 3.31Å; Y201-S204 PolarHBondContact O-N 2.62Å; Y201-S204 VanDerWaalsContact O-N 3.17Å; Y201-S204 PolarHBondContact O-OG 2.98Å; Y201-F205 WeakPolarHBondContact O-CD2 3.25Å; Y201-F205 PolarHBondContact O-N 3.18Å |
| 202 | M | 87.3 | Confident | 79.1 | Confident | 0 Ų | 0 | 62.6 Ų | 62.6 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -58.9 | -45.6 | 173.7 | -70.3 | -170.5 | -100.2 | 0 | 0 | 112.5 | I163 V164 A167 S198 R199 S204 F205 L206 A394 V395 P398 | I163-M202 HydrophobicContact CG2-CB 3.96Å; I163-M202 HydrophobicContact CG2-CG 3.82Å; I163-M202 HydrophobicContact CG2-SD 4.01Å; V164-M202 HydrophobicContact CG2-SD 4.03Å; A167-M202 HydrophobicContact CB-CB 4.31Å; A167-M202 HydrophobicContact CB-CG 3.34Å; S198-M202 PolarHBondContact O-N 3.36Å; R199-M202 HydrophobicContact CG-CE 4.15Å; R199-M202 PolarHBondContact O-N 2.88Å; M202-S204 VanDerWaalsContact C-N 3.32Å; M202-S204 PolarHBondContact O-N 2.99Å; M202-F205 PolarHBondContact O-N 3.04Å; M202-L206 PolarHBondContact O-N 3.14Å; M202-A394 WeakPolarHBondContact CE-O 3.49Å; M202-A394 VanDerWaalsContact SD-C 3.51Å; M202-A394 HydrophobicContact SD-CB 3.68Å; M202-A394 VanDerWaalsContact SD-O 3.39Å; M202-V395 HydrophobicContact CB-CG2 4.04Å; M202-V395 HydrophobicContact SD-CG2 4.34Å; M202-P398 HydrophobicContact CE-CB 3.71Å |
| 203 | L | 88.6 | Confident | 80.6 | Confident | 86 Ų | 86 | 60.1 Ų | 60.1 | 45% | 0.45 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -65 | -33.8 | 175.6 | -71.2 | 169.5 | 0 | 0 | 0 | 112.3 | R199 L200 Y201 F205 L206 P207 V395 | R199-L203 WeakPolarHBondContact O-CG 3.39Å; R199-L203 PolarHBondContact O-N 3.29Å; L200-L203 PolarHBondContact O-N 2.99Å; Y201-L203 PolarHBondContact O-N 3.31Å; L203-F205 VanDerWaalsContact C-N 3.3Å; L203-F205 PolarHBondContact O-N 3.15Å; L203-L206 VanDerWaalsContact O-CB 3.3Å; L203-L206 WeakPolarHBondContact O-CB 3.44Å; L203-L206 PolarHBondContact O-N 3.34Å; L203-P207 WeakPolarHBondContact O-CD 3.25Å; L203-V395 HydrophobicContact CG-CG2 4.47Å |
| 204 | S | 88.9 | Confident | 82.4 | Confident | 55 Ų | 55 | 59.4 Ų | 59.4 | 39% | 0.385 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -66.1 | -30 | 177 | 79.6 | 0 | 0 | 0 | 0 | 113.3 | L200 Y201 M202 P207 F208 | L200-S204 WeakPolarHBondContact O-CB 3.48Å; L200-S204 PolarHBondContact O-N 3.17Å; Y201-S204 PolarHBondContact O-N 2.62Å; Y201-S204 VanDerWaalsContact O-N 3.17Å; Y201-S204 PolarHBondContact O-OG 2.98Å; M202-S204 VanDerWaalsContact C-N 3.32Å; M202-S204 PolarHBondContact O-N 2.99Å; S204-P207 WeakPolarHBondContact O-CD 3.25Å; S204-F208 WeakPolarHBondContact O-CD2 3.43Å |
| 205 | F | 89.4 | Confident | 83.7 | Confident | 17 Ų | 17 | 57.5 Ų | 57.5 | 8% | 0.075 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -76.7 | -25.7 | 174.3 | -82.8 | -67.1 | 0 | 0 | 0 | 113.6 | L166 L170 Y201 M202 L203 F208 L209 I344 L348 | L166-F205 HydrophobicContact CB-CD2 4.04Å; L166-F205 HydrophobicContact CB-CE2 3.78Å; L166-F205 HydrophobicContact CB-CZ 4.04Å; L166-F205 WeakPolarHBondContact O-CE2 3.49Å; L170-F205 HydrophobicContact CB-CE2 3.84Å; L170-F205 HydrophobicContact CB-CZ 3.94Å; L170-F205 HydrophobicContact CD2-CD2 4.45Å; L170-F205 HydrophobicContact CD2-CE1 4.36Å; L170-F205 HydrophobicContact CD2-CE2 3.49Å; L170-F205 VanDerWaalsContact CD2-CE2 3.49Å; L170-F205 HydrophobicContact CD2-CZ 3.45Å; L170-F205 VanDerWaalsContact CD2-CZ 3.45Å; L170-F205 HydrophobicContact CG-CE2 4.29Å; L170-F205 HydrophobicContact CG-CZ 4.24Å; Y201-F205 WeakPolarHBondContact O-CD2 3.25Å; Y201-F205 PolarHBondContact O-N 3.18Å; M202-F205 PolarHBondContact O-N 3.04Å; L203-F205 VanDerWaalsContact C-N 3.3Å; L203-F205 PolarHBondContact O-N 3.15Å; F205-F208 WeakPolarHBondContact O-CB 3.5Å; F205-F208 PolarHBondContact O-N 3.42Å; F205-L209 HydrophobicContact CB-CD1 4.11Å; F205-L209 HydrophobicContact CB-CG 4.41Å; F205-L209 WeakPolarHBondContact O-CG 3.39Å; F205-L209 PolarHBondContact O-N 2.91Å; F205-I344 HydrophobicContact CE1-CG2 4.41Å; F205-I344 HydrophobicContact CZ-CG2 4.17Å; F205-L348 HydrophobicContact CD1-CD2 4.28Å; F205-L348 HydrophobicContact CE1-CD1 4.31Å; F205-L348 HydrophobicContact CE1-CD2 4.46Å |
| 206 | L | 90.6 | Very high | 84.5 | Confident | 39 Ų | 39 | 61.8 Ų | 61.8 | 20% | 0.204 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -47.7 | -51.7 | -177.5 | -178.2 | 60 | 0 | 0 | 0 | 114.6 | M202 L203 F208 L209 V210 V387 C391 | M202-L206 PolarHBondContact O-N 3.14Å; L203-L206 VanDerWaalsContact O-CB 3.3Å; L203-L206 WeakPolarHBondContact O-CB 3.44Å; L203-L206 PolarHBondContact O-N 3.34Å; L206-F208 VanDerWaalsContact C-N 3.31Å; L206-F208 PolarHBondContact O-N 3.48Å; L206-L209 PolarHBondContact O-N 2.62Å; L206-V210 HydrophobicContact CD1-CG2 4.07Å; L206-V210 HydrophobicContact CG-CG2 4.49Å; L206-V210 WeakPolarHBondContact O-CG2 3.24Å; L206-V210 PolarHBondContact O-N 2.94Å; L206-V387 HydrophobicContact CD1-CG1 3.77Å; L206-C391 HydrophobicContact CD1-CB 3.91Å |
| 207 | P | 90.6 | Very high | 85.1 | Confident | 80 Ų | 80 | 61 Ų | 61 | 52% | 0.519 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.4 | -36.2 | 178.9 | 23.3 | -34.8 | 0 | 0 | 0 | 113.3 | L203 S204 L211 | L203-P207 WeakPolarHBondContact O-CD 3.25Å; S204-P207 WeakPolarHBondContact O-CD 3.25Å; P207-L211 WeakPolarHBondContact O-CB 3.43Å; P207-L211 PolarHBondContact O-N 2.92Å |
| 208 | F | 90.7 | Very high | 84.9 | Confident | 135 Ų | 135 | 59.4 Ų | 59.4 | 59% | 0.592 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -69.3 | -41.7 | 176.2 | -63.4 | -83.2 | 0 | 0 | 0 | 111.8 | S204 F205 L206 L211 L212 | S204-F208 WeakPolarHBondContact O-CD2 3.43Å; F205-F208 WeakPolarHBondContact O-CB 3.5Å; F205-F208 PolarHBondContact O-N 3.42Å; L206-F208 VanDerWaalsContact C-N 3.31Å; L206-F208 PolarHBondContact O-N 3.48Å; F208-L211 PolarHBondContact O-N 2.64Å; F208-L212 VanDerWaalsContact O-CB 3.26Å; F208-L212 WeakPolarHBondContact O-CB 3.37Å; F208-L212 PolarHBondContact O-N 3.33Å |
| 209 | L | 91.6 | Very high | 85.1 | Confident | 0 Ų | 0 | 68.3 Ų | 68.3 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -65.8 | -40.8 | 177.3 | -66.6 | 171.4 | 0 | 0 | 0 | 111.9 | I163 L166 F205 L206 L212 V213 L348 Y351 V387 | I163-L209 HydrophobicContact CD1-CD1 4.07Å; I163-L209 HydrophobicContact CG1-CD1 3.65Å; L166-L209 HydrophobicContact CD1-CD2 4.47Å; F205-L209 HydrophobicContact CB-CD1 4.11Å; F205-L209 HydrophobicContact CB-CG 4.41Å; F205-L209 WeakPolarHBondContact O-CG 3.39Å; F205-L209 PolarHBondContact O-N 2.91Å; L206-L209 PolarHBondContact O-N 2.62Å; L209-L212 PolarHBondContact O-N 2.85Å; L209-V213 WeakPolarHBondContact O-CB 3.32Å; L209-V213 WeakPolarHBondContact O-CG2 3.24Å; L209-V213 PolarHBondContact O-N 2.98Å; L209-L348 HydrophobicContact CD2-CD2 3.69Å; L209-Y351 HydrophobicContact CB-CE1 4.32Å; L209-Y351 HydrophobicContact CD1-CE2 4.43Å; L209-Y351 HydrophobicContact CD2-CD1 3.8Å; L209-Y351 HydrophobicContact CD2-CD2 4.11Å; L209-Y351 HydrophobicContact CD2-CE1 3.94Å; L209-Y351 HydrophobicContact CD2-CE2 4.23Å; L209-Y351 HydrophobicContact CD2-CG 3.91Å; L209-V387 HydrophobicContact CB-CG1 4.15Å |
| 210 | V | 91.3 | Very high | 84.8 | Confident | 29 Ų | 29 | 68.1 Ų | 68.1 | 18% | 0.176 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -59 | -55.7 | 171.9 | 170 | 0 | 0 | 0 | 0 | 109.7 | L206 L212 V213 L214 L384 V387 | L206-V210 HydrophobicContact CD1-CG2 4.07Å; L206-V210 HydrophobicContact CG-CG2 4.49Å; L206-V210 WeakPolarHBondContact O-CG2 3.24Å; L206-V210 PolarHBondContact O-N 2.94Å; V210-L212 VanDerWaalsContact C-N 3.25Å; V210-L212 PolarHBondContact O-N 3.49Å; V210-V213 PolarHBondContact O-N 2.89Å; V210-V213 VanDerWaalsContact O-N 3.13Å; V210-L214 HydrophobicContact CG1-CD1 4.16Å; V210-L214 HydrophobicContact CG1-CG 4.41Å; V210-L214 WeakPolarHBondContact O-CG 3.5Å; V210-L214 PolarHBondContact O-N 2.86Å; V210-L384 HydrophobicContact CB-CD1 4.5Å; V210-L384 HydrophobicContact CG1-CD1 3.91Å; V210-L384 HydrophobicContact CG2-CD1 3.67Å; V210-V387 HydrophobicContact CG2-CB 4.37Å; V210-V387 HydrophobicContact CG2-CG1 3.83Å |
| 211 | L | 89.6 | Confident | 84.5 | Confident | 115 Ų | 115 | 64.7 Ų | 64.7 | 60% | 0.602 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -54.3 | -42.9 | 179.9 | 179.4 | 62.7 | 0 | 0 | 0 | 112.1 | P207 F208 L214 | P207-L211 WeakPolarHBondContact O-CB 3.43Å; P207-L211 PolarHBondContact O-N 2.92Å; F208-L211 PolarHBondContact O-N 2.64Å; L211-L214 PolarHBondContact O-N 3.24Å |
| 212 | L | 87.1 | Confident | 84 | Confident | 38 Ų | 38 | 66.6 Ų | 66.6 | 20% | 0.199 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -65.8 | -40.8 | -179.9 | -170.4 | 70 | 0 | 0 | 0 | 112.6 | F208 L209 V210 L214 I215 L221 L348 A352 | F208-L212 VanDerWaalsContact O-CB 3.26Å; F208-L212 WeakPolarHBondContact O-CB 3.37Å; F208-L212 PolarHBondContact O-N 3.33Å; L209-L212 PolarHBondContact O-N 2.85Å; V210-L212 VanDerWaalsContact C-N 3.25Å; V210-L212 PolarHBondContact O-N 3.49Å; L212-L214 VanDerWaalsContact C-N 3.32Å; L212-L214 PolarHBondContact O-N 3.43Å; L212-I215 HydrophobicContact CD1-CD1 4.21Å; L212-I215 WeakPolarHBondContact O-CB 3.49Å; L212-I215 PolarHBondContact O-N 2.91Å; L212-L221 HydrophobicContact CD1-CD1 4.28Å; L212-L348 WeakPolarHBondContact CD2-O 3.44Å; L212-A352 HydrophobicContact CD2-CB 3.75Å; L212-A352 HydrophobicContact CG-CB 3.76Å |
| 213 | V | 86.4 | Confident | 83.8 | Confident | 8 Ų | 8 | 71.7 Ų | 71.7 | 5% | 0.048 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -70.7 | -25.8 | 177.3 | 159.1 | 0 | 0 | 0 | 0 | 113 | L209 V210 I215 Y351 F355 R383 V387 | L209-V213 WeakPolarHBondContact O-CB 3.32Å; L209-V213 WeakPolarHBondContact O-CG2 3.24Å; L209-V213 PolarHBondContact O-N 2.98Å; V210-V213 PolarHBondContact O-N 2.89Å; V210-V213 VanDerWaalsContact O-N 3.13Å; V213-I215 PolarHBondContact O-N 2.96Å; V213-Y351 HydrophobicContact CG2-CD1 4.32Å; V213-Y351 HydrophobicContact CG2-CE1 3.78Å; V213-F355 HydrophobicContact CB-CD1 4.26Å; V213-F355 HydrophobicContact CB-CE1 4.26Å; V213-F355 HydrophobicContact CG1-CD1 3.6Å; V213-F355 HydrophobicContact CG1-CE1 3.19Å; V213-F355 HydrophobicContact CG1-CE2 4.39Å; V213-F355 HydrophobicContact CG1-CG 4.38Å; V213-F355 HydrophobicContact CG1-CZ 3.62Å; V213-F355 HydrophobicContact CG2-CB 4.22Å; V213-F355 HydrophobicContact CG2-CD1 3.65Å; V213-F355 HydrophobicContact CG2-CD2 4.08Å; V213-F355 HydrophobicContact CG2-CE1 4.04Å; V213-F355 HydrophobicContact CG2-CE2 4.4Å; V213-F355 HydrophobicContact CG2-CG 3.69Å; V213-F355 HydrophobicContact CG2-CZ 4.37Å; V213-R383 HydrophobicContact CG1-CB 3.83Å; V213-R383 HydrophobicContact CG1-CG 4.1Å; V213-V387 HydrophobicContact CB-CG2 4Å; V213-V387 HydrophobicContact CG1-CG2 3.89Å; V213-V387 HydrophobicContact CG2-CG2 3.78Å |
| 214 | L | 85.8 | Confident | 83.6 | Confident | 69 Ų | 69 | 73.4 Ų | 73.4 | 36% | 0.361 | 36% | 0.361 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.3 | -12.8 | 172.6 | -64.5 | -176.6 | 0 | 0 | 0 | 113 | V210 L211 L212 R216 L380 | V210-L214 HydrophobicContact CG1-CD1 4.16Å; V210-L214 HydrophobicContact CG1-CG 4.41Å; V210-L214 WeakPolarHBondContact O-CG 3.5Å; V210-L214 PolarHBondContact O-N 2.86Å; L211-L214 PolarHBondContact O-N 3.24Å; L212-L214 VanDerWaalsContact C-N 3.32Å; L212-L214 PolarHBondContact O-N 3.43Å; L214-R216 PolarHBondContact O-N 3.26Å; L214-L380 HydrophobicContact CD2-CD2 3.65Å |
| 215 | I | 81.4 | Confident | 83.4 | Confident | 76 Ų | 76 | 70.9 Ų | 70.9 | 39% | 0.39 | 34% | 0.343 | S | S | . | . | trans | -73.1 | 99.3 | 176.7 | -56.4 | -178.3 | 0 | 0 | 0 | 110.3 | L212 V213 N217 | L212-I215 HydrophobicContact CD1-CD1 4.21Å; L212-I215 WeakPolarHBondContact O-CB 3.49Å; L212-I215 PolarHBondContact O-N 2.91Å; V213-I215 PolarHBondContact O-N 2.96Å; I215-N217 VanDerWaalsContact C-N 3.28Å; I215-N217 HydrophobicContact CG2-CB 4.49Å; I215-N217 PolarHBondContact O-N 2.75Å | ||
| 216 | R | 70.3 | Confident | 83.1 | Confident | 157 Ų | 157 | 74.6 Ų | 74.6 | 59% | 0.592 | 36% | 0.362 | S | S | * | . | trans | -74.7 | -12.2 | 176.4 | -64.2 | 174.9 | 65.6 | 173 | 2.6 | 114.2 | L214 L218 | L214-R216 PolarHBondContact O-N 3.26Å; R216-L218 PolarHBondContact O-N 2.94Å | ||
| 217 | N | 74.6 | Confident | 82.8 | Confident | 83 Ų | 83 | 78.3 Ų | 78.3 | 44% | 0.444 | 38% | 0.381 | S | S | . | . | trans | -88.5 | 79.6 | -178.4 | -168.7 | -11.9 | 0 | 0 | 0 | 112.5 | I215 R219 I220 L221 | I215-N217 VanDerWaalsContact C-N 3.28Å; I215-N217 HydrophobicContact CG2-CB 4.49Å; I215-N217 PolarHBondContact O-N 2.75Å; N217-R219 PolarHBondContact O-N 3.06Å; N217-R219 VanDerWaalsContact O-N 3.09Å; N217-R219 WeakPolarHBondContact OD1-CB 3.44Å; N217-R219 PolarHBondContact OD1-N 2.94Å; N217-I220 WeakPolarHBondContact ND2-CD1 3.36Å; N217-I220 PolarHBondContact O-N 3.03Å; N217-L221 PolarHBondContact O-N 3.42Å | ||
| 218 | L | 71.6 | Confident | 82.6 | Confident | 48 Ų | 48 | 74.9 Ų | 74.9 | 25% | 0.251 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -56.9 | -24.7 | 179.6 | -56.3 | 175 | 0 | 0 | 0 | 114.1 | R216 I220 L221 T222 Y356 | R216-L218 PolarHBondContact O-N 2.94Å; L218-I220 VanDerWaalsContact C-N 3.35Å; L218-I220 PolarHBondContact O-N 3.23Å; L218-L221 HydrophobicContact CD2-CD2 4.41Å; L218-L221 PolarHBondContact O-N 3.34Å; L218-T222 VanDerWaalsContact O-CB 3.29Å; L218-T222 WeakPolarHBondContact O-CB 3.44Å; L218-T222 PolarHBondContact O-N 3.23Å; L218-T222 PolarHBondContact O-OG1 3.01Å; L218-Y356 HydrophobicContact CD1-CD1 4.13Å; L218-Y356 HydrophobicContact CD1-CD2 4.19Å; L218-Y356 HydrophobicContact CD1-CE1 3.56Å; L218-Y356 HydrophobicContact CD1-CE2 3.64Å; L218-Y356 HydrophobicContact CD1-CG 4.42Å; L218-Y356 HydrophobicContact CD2-CD1 4.48Å; L218-Y356 HydrophobicContact CD2-CD2 3.65Å; L218-Y356 HydrophobicContact CD2-CE2 3.82Å; L218-Y356 HydrophobicContact CD2-CG 4.02Å; L218-Y356 HydrophobicContact CG-CD2 4.46Å; L218-Y356 HydrophobicContact CG-CE2 4.15Å |
| 219 | R | 77 | Confident | 82.3 | Confident | 201 Ų | 201 | 69.5 Ų | 69.5 | 76% | 0.758 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -65.3 | -40.9 | -178.3 | -172.7 | 178.8 | 178.8 | -173.1 | -2.1 | 111.3 | N217 I223 | N217-R219 PolarHBondContact O-N 3.06Å; N217-R219 VanDerWaalsContact O-N 3.09Å; N217-R219 WeakPolarHBondContact OD1-CB 3.44Å; N217-R219 PolarHBondContact OD1-N 2.94Å; R219-I223 WeakPolarHBondContact O-CG1 3.33Å; R219-I223 PolarHBondContact O-N 3.15Å |
| 220 | I | 77.9 | Confident | 82.1 | Confident | 89 Ų | 89 | 74.6 Ų | 74.6 | 46% | 0.456 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -68.9 | -49.3 | 176.3 | -64 | 175.5 | 0 | 0 | 0 | 109.3 | N217 L218 T222 I223 F224 | N217-I220 WeakPolarHBondContact ND2-CD1 3.36Å; N217-I220 PolarHBondContact O-N 3.03Å; L218-I220 VanDerWaalsContact C-N 3.35Å; L218-I220 PolarHBondContact O-N 3.23Å; I220-T222 VanDerWaalsContact C-N 3.26Å; I220-T222 PolarHBondContact O-N 3.21Å; I220-I223 PolarHBondContact O-N 3.32Å; I220-I223 VanDerWaalsContact O-N 3.08Å; I220-F224 HydrophobicContact CG2-CD2 3.77Å; I220-F224 HydrophobicContact CG2-CE2 3.62Å; I220-F224 WeakPolarHBondContact O-CD2 3.27Å; I220-F224 PolarHBondContact O-N 3.03Å |
| 221 | L | 76.7 | Confident | 82 | Confident | 11 Ų | 11 | 74.4 Ų | 74.4 | 6% | 0.058 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -57.6 | -36.8 | 178.7 | -176.4 | 65.9 | 0 | 0 | 0 | 112.9 | L212 N217 L218 F224 S225 A352 L353 | L212-L221 HydrophobicContact CD1-CD1 4.28Å; N217-L221 PolarHBondContact O-N 3.42Å; L218-L221 HydrophobicContact CD2-CD2 4.41Å; L218-L221 PolarHBondContact O-N 3.34Å; L221-F224 PolarHBondContact O-N 2.9Å; L221-S225 VanDerWaalsContact O-CB 3.26Å; L221-S225 WeakPolarHBondContact O-CB 3.44Å; L221-S225 PolarHBondContact O-N 3.05Å; L221-A352 HydrophobicContact CD1-CB 3.93Å; L221-A352 HydrophobicContact CD2-CB 3.58Å; L221-A352 HydrophobicContact CG-CB 4.34Å; L221-L353 HydrophobicContact CD2-CD2 3.95Å; L221-L353 HydrophobicContact CG-CD2 4.22Å |
| 222 | T | 77.1 | Confident | 82 | Confident | 62 Ų | 62 | 69.4 Ų | 69.4 | 38% | 0.38 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -65 | -38.3 | 177.1 | -59.5 | 0 | 0 | 0 | 0 | 112 | L218 I220 S225 M226 | L218-T222 VanDerWaalsContact O-CB 3.29Å; L218-T222 WeakPolarHBondContact O-CB 3.44Å; L218-T222 PolarHBondContact O-N 3.23Å; L218-T222 PolarHBondContact O-OG1 3.01Å; I220-T222 VanDerWaalsContact C-N 3.26Å; I220-T222 PolarHBondContact O-N 3.21Å; T222-S225 PolarHBondContact O-N 2.92Å; T222-M226 WeakPolarHBondContact O-CG 3.18Å; T222-M226 PolarHBondContact O-N 3.33Å |
| 223 | I | 83.3 | Confident | 82 | Confident | 107 Ų | 107 | 71.8 Ų | 71.8 | 55% | 0.549 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -66.9 | -49.3 | 177.6 | -65 | 165.8 | 0 | 0 | 0 | 109.7 | R219 I220 S225 M226 L227 | R219-I223 WeakPolarHBondContact O-CG1 3.33Å; R219-I223 PolarHBondContact O-N 3.15Å; I220-I223 PolarHBondContact O-N 3.32Å; I220-I223 VanDerWaalsContact O-N 3.08Å; I223-S225 VanDerWaalsContact C-N 3.33Å; I223-S225 PolarHBondContact O-N 3.46Å; I223-M226 PolarHBondContact O-N 3.3Å; I223-M226 VanDerWaalsContact O-N 3.15Å; I223-L227 PolarHBondContact O-N 3.2Å |
| 224 | F | 84.2 | Confident | 82.3 | Confident | 122 Ų | 122 | 75.2 Ų | 75.2 | 54% | 0.535 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -59.3 | -43.5 | 174.9 | -77.7 | -72.1 | 0 | 0 | 0 | 111.9 | I220 L221 M226 L227 A228 | I220-F224 HydrophobicContact CG2-CD2 3.77Å; I220-F224 HydrophobicContact CG2-CE2 3.62Å; I220-F224 WeakPolarHBondContact O-CD2 3.27Å; I220-F224 PolarHBondContact O-N 3.03Å; L221-F224 PolarHBondContact O-N 2.9Å; F224-M226 VanDerWaalsContact C-N 3.33Å; F224-M226 PolarHBondContact O-N 3.43Å; F224-L227 PolarHBondContact O-N 2.98Å; F224-A228 VanDerWaalsContact O-CB 3.27Å; F224-A228 WeakPolarHBondContact O-CB 3.47Å; F224-A228 PolarHBondContact O-N 3.02Å |
| 225 | S | 83.2 | Confident | 82.6 | Confident | 2 Ų | 2 | 72 Ų | 72 | 1% | 0.014 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -59.7 | -38.1 | 174.6 | 177.7 | 0 | 0 | 0 | 0 | 113 | K62 L221 T222 I223 N229 L353 | K62-S225 PolarHBondContact NZ-O 2.96Å; K62-S225 PolarHBondContact NZ-OG 3.49Å; L221-S225 VanDerWaalsContact O-CB 3.26Å; L221-S225 WeakPolarHBondContact O-CB 3.44Å; L221-S225 PolarHBondContact O-N 3.05Å; T222-S225 PolarHBondContact O-N 2.92Å; I223-S225 VanDerWaalsContact C-N 3.33Å; I223-S225 PolarHBondContact O-N 3.46Å; S225-N229 WeakPolarHBondContact O-CB 3.28Å; S225-N229 PolarHBondContact O-N 2.84Å; S225-N229 PolarHBondContact O-ND2 3.01Å; S225-N229 PolarHBondContact OG-ND2 3.21Å; S225-L353 WeakPolarHBondContact OG-CD1 3.5Å |
| 226 | M | 83 | Confident | 83.1 | Confident | 95 Ų | 95 | 68.6 Ų | 68.6 | 47% | 0.468 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -64.6 | -44.7 | 176 | -76 | -159.2 | -70.4 | 0 | 0 | 111.6 | T222 I223 F224 N229 I230 | T222-M226 WeakPolarHBondContact O-CG 3.18Å; T222-M226 PolarHBondContact O-N 3.33Å; I223-M226 PolarHBondContact O-N 3.3Å; I223-M226 VanDerWaalsContact O-N 3.15Å; F224-M226 VanDerWaalsContact C-N 3.33Å; F224-M226 PolarHBondContact O-N 3.43Å; M226-N229 PolarHBondContact O-N 3.26Å; M226-I230 WeakPolarHBondContact O-CG1 3.37Å; M226-I230 PolarHBondContact O-N 2.64Å |
| 227 | L | 86.3 | Confident | 84.2 | Confident | 117 Ų | 117 | 64.7 Ų | 64.7 | 61% | 0.613 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -62.6 | -48.3 | 175.3 | -176.6 | 61.4 | 0 | 0 | 0 | 111.9 | I223 F224 N229 I230 S231 | I223-L227 PolarHBondContact O-N 3.2Å; F224-L227 PolarHBondContact O-N 2.98Å; L227-N229 VanDerWaalsContact C-N 3.27Å; L227-N229 PolarHBondContact O-N 3.2Å; L227-I230 WeakPolarHBondContact O-CB 3.45Å; L227-I230 PolarHBondContact O-N 2.84Å; L227-I230 VanDerWaalsContact O-N 3.12Å; L227-S231 PolarHBondContact O-N 3.03Å; L227-S231 PolarHBondContact O-OG 3.06Å |
| 228 | A | 86.3 | Confident | 85.1 | Confident | 8 Ų | 8 | 62.2 Ų | 62.2 | 7% | 0.066 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -53.2 | -39.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | F224 S231 M232 C349 | F224-A228 VanDerWaalsContact O-CB 3.27Å; F224-A228 WeakPolarHBondContact O-CB 3.47Å; F224-A228 PolarHBondContact O-N 3.02Å; A228-S231 WeakPolarHBondContact CA-OG 3.41Å; A228-S231 PolarHBondContact O-N 3.43Å; A228-S231 PolarHBondContact O-OG 3.33Å; A228-M232 VanDerWaalsContact O-CG 3.31Å; A228-M232 WeakPolarHBondContact O-CG 3.34Å; A228-M232 PolarHBondContact O-N 2.86Å; A228-C349 HydrophobicContact CB-CB 3.84Å |
| 229 | N | 83.8 | Confident | 86.1 | Confident | 22 Ų | 22 | 59.9 Ų | 59.9 | 12% | 0.118 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -77.2 | -30.6 | -179.6 | -82.3 | -109.1 | 0 | 0 | 0 | 112.2 | K62 S225 M226 L227 M232 L233 | K62-N229 HydrophobicContact CD-CB 3.79Å; K62-N229 WeakPolarHBondContact CD-OD1 3.48Å; K62-N229 WeakPolarHBondContact CE-ND2 3.47Å; K62-N229 WeakPolarHBondContact CE-OD1 3.28Å; K62-N229 HydrophobicContact CG-CB 4.37Å; K62-N229 WeakPolarHBondContact CG-OD1 3.47Å; K62-N229 PolarHBondContact NZ-ND2 3.27Å; S225-N229 WeakPolarHBondContact O-CB 3.28Å; S225-N229 PolarHBondContact O-N 2.84Å; S225-N229 PolarHBondContact O-ND2 3.01Å; S225-N229 PolarHBondContact OG-ND2 3.21Å; M226-N229 PolarHBondContact O-N 3.26Å; L227-N229 VanDerWaalsContact C-N 3.27Å; L227-N229 PolarHBondContact O-N 3.2Å; N229-M232 PolarHBondContact O-N 3.4Å; N229-L233 WeakPolarHBondContact O-CB 3.16Å; N229-L233 PolarHBondContact O-N 3.29Å |
| 230 | I | 87.1 | Confident | 86.9 | Confident | 107 Ų | 107 | 51.7 Ų | 51.7 | 55% | 0.549 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -64.9 | -43.6 | 169.4 | -65.5 | 165.4 | 0 | 0 | 0 | 109.8 | M226 L227 L233 V234 | M226-I230 WeakPolarHBondContact O-CG1 3.37Å; M226-I230 PolarHBondContact O-N 2.64Å; L227-I230 WeakPolarHBondContact O-CB 3.45Å; L227-I230 PolarHBondContact O-N 2.84Å; L227-I230 VanDerWaalsContact O-N 3.12Å; I230-L233 WeakPolarHBondContact O-CB 3.47Å; I230-L233 PolarHBondContact O-N 3.48Å; I230-V234 WeakPolarHBondContact O-CG2 3.44Å; I230-V234 PolarHBondContact O-N 3.43Å |
| 231 | S | 88.8 | Confident | 87.6 | Confident | 26 Ų | 26 | 52.9 Ų | 52.9 | 18% | 0.182 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -67.4 | -34.8 | 176.7 | 54.4 | 0 | 0 | 0 | 0 | 113.3 | L227 A228 S235 | L227-S231 PolarHBondContact O-N 3.03Å; L227-S231 PolarHBondContact O-OG 3.06Å; A228-S231 WeakPolarHBondContact CA-OG 3.41Å; A228-S231 PolarHBondContact O-N 3.43Å; A228-S231 PolarHBondContact O-OG 3.33Å; S231-S235 VanDerWaalsContact O-CB 3.27Å; S231-S235 WeakPolarHBondContact O-CB 3.37Å; S231-S235 PolarHBondContact O-N 3.08Å; S231-S235 PolarHBondContact O-OG 3.43Å |
| 232 | M | 89.4 | Confident | 88.3 | Confident | 9 Ų | 9 | 53.3 Ų | 53.3 | 4% | 0.044 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -64.6 | -39.3 | 170.6 | -74.8 | 170.5 | 63.3 | 0 | 0 | 112.1 | A228 N229 S235 L236 Y343 G346 I347 | A228-M232 VanDerWaalsContact O-CG 3.31Å; A228-M232 WeakPolarHBondContact O-CG 3.34Å; A228-M232 PolarHBondContact O-N 2.86Å; N229-M232 PolarHBondContact O-N 3.4Å; M232-S235 WeakPolarHBondContact O-CB 3.25Å; M232-S235 PolarHBondContact O-N 2.94Å; M232-L236 PolarHBondContact O-N 2.86Å; M232-Y343 HydrophobicContact CB-CD1 4.46Å; M232-Y343 HydrophobicContact CB-CE1 4.1Å; M232-Y343 HydrophobicContact CE-CD1 4.03Å; M232-Y343 HydrophobicContact CE-CE1 3.85Å; M232-Y343 HydrophobicContact CG-CD1 3.87Å; M232-Y343 HydrophobicContact CG-CE1 4Å; M232-Y343 PolarHBondContact O-OH 3.22Å; M232-G346 VanDerWaalsContact SD-C 3.54Å; M232-I347 HydrophobicContact CE-CD1 3.57Å; M232-I347 HydrophobicContact CE-CG1 4.34Å; M232-I347 HydrophobicContact SD-CD1 4.24Å |
| 233 | L | 88.9 | Confident | 89 | Confident | 89 Ų | 89 | 50.3 Ų | 50.3 | 47% | 0.466 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -63.7 | -45.7 | 175.5 | 178.8 | 64.3 | 0 | 0 | 0 | 111.7 | M65 N229 I230 S235 L236 V237 | M65-L233 HydrophobicContact CE-CD1 3.6Å; M65-L233 HydrophobicContact SD-CD1 4.28Å; N229-L233 WeakPolarHBondContact O-CB 3.16Å; N229-L233 PolarHBondContact O-N 3.29Å; I230-L233 WeakPolarHBondContact O-CB 3.47Å; I230-L233 PolarHBondContact O-N 3.48Å; L233-S235 VanDerWaalsContact C-N 3.3Å; L233-S235 PolarHBondContact O-N 3.26Å; L233-L236 WeakPolarHBondContact O-CB 3.33Å; L233-L236 PolarHBondContact O-N 3.49Å; L233-V237 WeakPolarHBondContact O-CG2 3.11Å; L233-V237 PolarHBondContact O-N 2.99Å; L233-V237 VanDerWaalsContact O-N 3.08Å |
| 234 | V | 91.4 | Very high | 89.3 | Confident | 80 Ų | 80 | 48.9 Ų | 48.9 | 49% | 0.485 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -60.8 | -42.1 | 173.9 | 172.8 | 0 | 0 | 0 | 0 | 110.9 | I230 L236 V237 I238 | I230-V234 WeakPolarHBondContact O-CG2 3.44Å; I230-V234 PolarHBondContact O-N 3.43Å; V234-L236 VanDerWaalsContact C-N 3.33Å; V234-L236 PolarHBondContact O-N 3.38Å; V234-V237 PolarHBondContact O-N 3.29Å; V234-V237 VanDerWaalsContact O-N 3.16Å; V234-I238 HydrophobicContact CG1-CD1 4.21Å; V234-I238 WeakPolarHBondContact O-CG1 3.49Å; V234-I238 PolarHBondContact O-N 3.18Å; V234-I238 VanDerWaalsContact O-N 3.07Å |
| 235 | S | 92.5 | Very high | 89.4 | Confident | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62 | -39.4 | 177 | -61.4 | 0 | 0 | 0 | 0 | 112.2 | S231 M232 L233 I238 I239 L342 | S231-S235 VanDerWaalsContact O-CB 3.27Å; S231-S235 WeakPolarHBondContact O-CB 3.37Å; S231-S235 PolarHBondContact O-N 3.08Å; S231-S235 PolarHBondContact O-OG 3.43Å; M232-S235 WeakPolarHBondContact O-CB 3.25Å; M232-S235 PolarHBondContact O-N 2.94Å; L233-S235 VanDerWaalsContact C-N 3.3Å; L233-S235 PolarHBondContact O-N 3.26Å; S235-I238 PolarHBondContact O-N 3.04Å; S235-I239 WeakPolarHBondContact O-CG1 3.38Å; S235-I239 PolarHBondContact O-N 3.41Å; S235-L342 WeakPolarHBondContact OG-CB 3.23Å |
| 236 | L | 92.3 | Very high | 89.4 | Confident | 6 Ų | 6 | 53.1 Ų | 53.1 | 3% | 0.031 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -64.2 | -38.6 | 173.7 | -172.7 | 67.8 | 0 | 0 | 0 | 112.3 | M65 I69 L70 M232 L233 V234 I238 I239 A240 L306 I310 Y343 | M65-L236 HydrophobicContact CE-CD2 3.34Å; I69-L236 HydrophobicContact CD1-CD1 4.07Å; I69-L236 HydrophobicContact CD1-CD2 3.65Å; L70-L236 HydrophobicContact CD2-CD1 4.32Å; M232-L236 PolarHBondContact O-N 2.86Å; L233-L236 WeakPolarHBondContact O-CB 3.33Å; L233-L236 PolarHBondContact O-N 3.49Å; V234-L236 VanDerWaalsContact C-N 3.33Å; V234-L236 PolarHBondContact O-N 3.38Å; L236-I238 VanDerWaalsContact C-N 3.34Å; L236-I239 PolarHBondContact O-N 3.4Å; L236-A240 WeakPolarHBondContact O-CB 3.37Å; L236-A240 PolarHBondContact O-N 3.31Å; L236-L306 HydrophobicContact CD2-CD1 4.23Å; L236-L306 HydrophobicContact CD2-CD2 3.99Å; L236-L306 HydrophobicContact CD2-CG 4.46Å; L236-I310 HydrophobicContact CD1-CD1 4.44Å; L236-I310 HydrophobicContact CD1-CG1 4.44Å; L236-Y343 WeakPolarHBondContact CB-OH 3.28Å |
| 237 | V | 93.1 | Very high | 89.4 | Confident | 74 Ų | 74 | 52.2 Ų | 52.2 | 45% | 0.448 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -63.6 | -40.8 | 175.8 | 173 | 0 | 0 | 0 | 0 | 111.1 | L233 V234 A240 Q241 | L233-V237 WeakPolarHBondContact O-CG2 3.11Å; L233-V237 PolarHBondContact O-N 2.99Å; L233-V237 VanDerWaalsContact O-N 3.08Å; V234-V237 PolarHBondContact O-N 3.29Å; V234-V237 VanDerWaalsContact O-N 3.16Å; V237-A240 WeakPolarHBondContact O-CB 3.35Å; V237-A240 PolarHBondContact O-N 3.42Å; V237-Q241 WeakPolarHBondContact O-CG 3.29Å; V237-Q241 PolarHBondContact O-N 3.43Å |
| 238 | I | 93.6 | Very high | 89.3 | Confident | 31 Ų | 31 | 49.8 Ų | 49.8 | 16% | 0.159 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63.7 | -42 | 175.3 | -64.4 | 164.9 | 0 | 0 | 0 | 110.8 | V234 S235 L236 Q241 Y242 L335 Y336 V339 | V234-I238 HydrophobicContact CG1-CD1 4.21Å; V234-I238 WeakPolarHBondContact O-CG1 3.49Å; V234-I238 PolarHBondContact O-N 3.18Å; V234-I238 VanDerWaalsContact O-N 3.07Å; S235-I238 PolarHBondContact O-N 3.04Å; L236-I238 VanDerWaalsContact C-N 3.34Å; I238-Q241 PolarHBondContact O-N 2.74Å; I238-Y242 PolarHBondContact O-N 3.47Å; I238-Y242 VanDerWaalsContact O-N 3.08Å; I238-L335 HydrophobicContact CD1-CD1 4.39Å; I238-L335 HydrophobicContact CG2-CD2 4.25Å; I238-L335 HydrophobicContact CG2-CG 4.27Å; I238-Y336 HydrophobicContact CG2-CD1 4.13Å; I238-Y336 HydrophobicContact CG2-CE1 3.84Å; I238-V339 HydrophobicContact CB-CG2 4Å; I238-V339 HydrophobicContact CD1-CG2 3.88Å; I238-V339 HydrophobicContact CG2-CG2 3.8Å |
| 239 | I | 93.1 | Very high | 89.1 | Confident | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60.8 | -46.8 | 173.4 | -68.6 | 171.3 | 0 | 0 | 0 | 110.8 | L70 S235 L236 Q241 Y242 I243 I326 L330 V339 Y343 | L70-I239 HydrophobicContact CD2-CD1 4.07Å; S235-I239 WeakPolarHBondContact O-CG1 3.38Å; S235-I239 PolarHBondContact O-N 3.41Å; L236-I239 PolarHBondContact O-N 3.4Å; I239-Q241 VanDerWaalsContact C-N 3.33Å; I239-Q241 PolarHBondContact O-N 2.94Å; I239-Y242 PolarHBondContact O-N 3.01Å; I239-Y242 VanDerWaalsContact O-N 3.15Å; I239-I243 HydrophobicContact CG2-CG2 4.4Å; I239-I243 PolarHBondContact O-N 3.24Å; I239-I326 HydrophobicContact CG2-CG2 3.51Å; I239-L330 HydrophobicContact CD1-CD1 4.29Å; I239-L330 HydrophobicContact CG1-CD1 3.94Å; I239-L330 HydrophobicContact CG1-CD2 4.26Å; I239-V339 HydrophobicContact CD1-CG1 4Å; I239-V339 HydrophobicContact CG1-CG1 4.03Å; I239-Y343 HydrophobicContact CD1-CD2 4.5Å; I239-Y343 HydrophobicContact CD1-CE2 3.73Å |
| 240 | A | 93.5 | Very high | 89 | Confident | 29 Ų | 29 | 55.7 Ų | 55.7 | 24% | 0.24 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -58.7 | -44.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | L236 V237 Y242 I243 T244 I310 | L236-A240 WeakPolarHBondContact O-CB 3.37Å; L236-A240 PolarHBondContact O-N 3.31Å; V237-A240 WeakPolarHBondContact O-CB 3.35Å; V237-A240 PolarHBondContact O-N 3.42Å; A240-Y242 PolarHBondContact O-N 3.29Å; A240-I243 WeakPolarHBondContact O-CG1 3.1Å; A240-I243 PolarHBondContact O-N 3.12Å; A240-T244 WeakPolarHBondContact O-CG2 3.32Å; A240-T244 PolarHBondContact O-N 3.05Å; A240-T244 PolarHBondContact O-OG1 3.19Å; A240-I310 HydrophobicContact CB-CD1 3.76Å |
| 241 | Q | 92.6 | Very high | 88.8 | Confident | 114 Ų | 114 | 55.4 Ų | 55.4 | 53% | 0.533 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -60.7 | -42.7 | 175.1 | -73.8 | 176 | -34.3 | 0 | 0 | 112.1 | V237 I238 I239 T244 Q245 | V237-Q241 WeakPolarHBondContact O-CG 3.29Å; V237-Q241 PolarHBondContact O-N 3.43Å; I238-Q241 PolarHBondContact O-N 2.74Å; I239-Q241 VanDerWaalsContact C-N 3.33Å; I239-Q241 PolarHBondContact O-N 2.94Å; Q241-T244 PolarHBondContact O-OG1 2.84Å; Q241-Q245 WeakPolarHBondContact O-CG 3.37Å; Q241-Q245 PolarHBondContact O-NE2 3.45Å |
| 242 | Y | 91.1 | Very high | 88.4 | Confident | 19 Ų | 19 | 64.7 Ų | 64.7 | 8% | 0.075 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -66.8 | -44.3 | 178.7 | -178.8 | -114.4 | 0 | 0 | 0 | 113 | I238 I239 A240 T244 Q245 F318 L330 P331 Y336 | I238-Y242 PolarHBondContact O-N 3.47Å; I238-Y242 VanDerWaalsContact O-N 3.08Å; I239-Y242 PolarHBondContact O-N 3.01Å; I239-Y242 VanDerWaalsContact O-N 3.15Å; A240-Y242 PolarHBondContact O-N 3.29Å; Y242-T244 VanDerWaalsContact C-N 3.25Å; Y242-T244 PolarHBondContact O-N 2.97Å; Y242-Q245 PolarHBondContact O-N 3.49Å; Y242-F318 HydrophobicContact CD1-CZ 4.26Å; Y242-F318 HydrophobicContact CE1-CE1 4.17Å; Y242-F318 AromaticContact CE1-CZ 3.82Å; Y242-F318 HydrophobicContact CE1-CZ 3.82Å; Y242-L330 HydrophobicContact CD1-CD2 3.65Å; Y242-L330 HydrophobicContact CE1-CD2 4.19Å; Y242-L330 HydrophobicContact CG-CD2 4.43Å; Y242-P331 HydrophobicContact CE1-CG 4.43Å; Y242-P331 HydrophobicContact CE2-CG 4.17Å; Y242-P331 WeakPolarHBondContact OH-CD 3.28Å; Y242-Y336 HydrophobicContact CD2-CE1 4.47Å; Y242-Y336 HydrophobicContact CD2-CE2 4.24Å; Y242-Y336 AromaticContact CD2-CZ 3.73Å; Y242-Y336 WeakPolarHBondContact CD2-OH 3.36Å; Y242-Y336 HydrophobicContact CE2-CE2 4.39Å; Y242-Y336 HydrophobicContact CG-CE1 4.24Å; Y242-Y336 AromaticContact CG-CZ 3.94Å |
| 243 | I | 91.7 | Very high | 88.3 | Confident | 0 Ų | 0 | 65.3 Ų | 65.3 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -70.6 | -19.8 | -179.7 | 66.5 | -177.9 | 0 | 0 | 0 | 113.4 | I239 A240 Q245 I310 L313 R317 F318 I326 | I239-I243 HydrophobicContact CG2-CG2 4.4Å; I239-I243 PolarHBondContact O-N 3.24Å; A240-I243 WeakPolarHBondContact O-CG1 3.1Å; A240-I243 PolarHBondContact O-N 3.12Å; I243-Q245 VanDerWaalsContact C-N 3.32Å; I243-I310 HydrophobicContact CD1-CD1 4.05Å; I243-L313 HydrophobicContact CD1-CB 3.75Å; I243-L313 HydrophobicContact CG1-CB 4.03Å; I243-R317 HydrophobicContact CB-CB 4.3Å; I243-F318 HydrophobicContact CG2-CE2 3.81Å; I243-F318 HydrophobicContact CG2-CZ 4.36Å; I243-I326 HydrophobicContact CG2-CG2 4.26Å |
| 244 | T | 90.7 | Very high | 88.4 | Confident | 77 Ų | 77 | 63.8 Ų | 63.8 | 47% | 0.472 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.1 | -10.5 | 172.8 | 53.6 | 0 | 0 | 0 | 0 | 114.5 | A240 Q241 Y242 L313 | A240-T244 WeakPolarHBondContact O-CG2 3.32Å; A240-T244 PolarHBondContact O-N 3.05Å; A240-T244 PolarHBondContact O-OG1 3.19Å; Q241-T244 PolarHBondContact O-OG1 2.84Å; Y242-T244 VanDerWaalsContact C-N 3.25Å; Y242-T244 PolarHBondContact O-N 2.97Å; T244-L313 HydrophobicContact CG2-CD1 3.96Å |
| 245 | Q | 85.9 | Confident | 88.3 | Confident | 84 Ų | 84 | 65.2 Ų | 65.2 | 39% | 0.393 | 35% | 0.346 | S | S | . | . | S | Bend | trans | -85.8 | 138.6 | 178.4 | -67.4 | 164 | 25.5 | 0 | 0 | 110.2 | Q241 Y242 I243 I247 R317 | Q241-Q245 WeakPolarHBondContact O-CG 3.37Å; Q241-Q245 PolarHBondContact O-NE2 3.45Å; Y242-Q245 PolarHBondContact O-N 3.49Å; I243-Q245 VanDerWaalsContact C-N 3.32Å; Q245-I247 PolarHBondContact O-N 3.48Å; Q245-R317 WeakPolarHBondContact O-CD 3.4Å; Q245-R317 VanDerWaalsContact O-CZ 3.24Å; Q245-R317 PolarHBondContact O-NE 3.08Å |
| 246 | E | 82 | Confident | 88.3 | Confident | 129 Ų | 129 | 68.9 Ų | 68.9 | 60% | 0.603 | 37% | 0.368 | S | S | * | . | S | Bend | trans | 49.9 | 52.6 | 171.8 | -61.2 | 171.4 | 169.1 | 0 | 0 | 113.9 | P248 R317 | E246-P248 WeakPolarHBondContact O-CD 3.43Å; E246-R317 PolarHBondContact O-NH1 3.46Å; E246-R317 IonicContact OE2-CZ 2.71Å; E246-R317 IonicContact OE2-NH1 2.74Å; E246-R317 PolarHBondContact OE2-NH1 3.06Å; E246-R317 VanDerWaalsContact OE2-NH1 3.17Å; E246-R317 IonicContact OE2-NH2 3.51Å; E246-R317 PolarHBondContact OE2-NH2 3.31Å |
| 247 | I | 84.1 | Confident | 88.3 | Confident | 75 Ų | 75 | 69.6 Ų | 69.6 | 39% | 0.385 | 38% | 0.376 | S | S | . | . | trans | -66.2 | 120.8 | 175.5 | -63.3 | 171.9 | 0 | 0 | 0 | 108.9 | Q245 L313 L316 | Q245-I247 PolarHBondContact O-N 3.48Å; I247-L313 HydrophobicContact CD1-CD2 3.92Å; I247-L316 HydrophobicContact CG2-CB 3.97Å | ||
| 248 | P | 83.2 | Confident | 88.3 | Confident | 66 Ų | 66 | 69.3 Ų | 69.3 | 43% | 0.429 | 38% | 0.377 | S | S | . | . | trans | -71.3 | 165.3 | 177.8 | 31.4 | -36.2 | 0 | 0 | 0 | 111.8 | E246 P250 L316 | E246-P248 WeakPolarHBondContact O-CD 3.43Å; P248-P250 WeakPolarHBondContact O-CD 3.3Å; P248-L316 WeakPolarHBondContact CD-O 3.38Å; P248-L316 WeakPolarHBondContact CG-O 3.38Å | ||
| 249 | D | 82.6 | Confident | 88.1 | Confident | 88 Ų | 88 | 76.6 Ų | 76.6 | 47% | 0.471 | 40% | 0.402 | S | S | . | . | trans | -58.5 | 115.4 | -179.9 | 173.5 | 17.6 | 0 | 0 | 0 | 111.8 | S251 | D249-S251 PolarHBondContact O-N 2.98Å; D249-S251 WeakPolarHBondContact OD1-CB 3.1Å; D249-S251 PolarHBondContact OD1-N 3.06Å; D249-S251 PolarHBondContact OD1-OG 3.38Å | ||
| 250 | P | 82.4 | Confident | 88 | Confident | 67 Ų | 67 | 83.9 Ų | 83.9 | 44% | 0.435 | 43% | 0.434 | S | S | . | . | G | 310 helix | trans | -68.6 | -13.9 | -177.4 | 29.4 | -36.7 | 0 | 0 | 0 | 113.3 | P248 R252 L253 L316 | P248-P250 WeakPolarHBondContact O-CD 3.3Å; P250-R252 PolarHBondContact O-N 2.89Å; P250-L253 PolarHBondContact O-N 2.82Å; P250-L316 HydrophobicContact CB-CD2 3.81Å |
| 251 | S | 81.2 | Confident | 87.9 | Confident | 101 Ų | 101 | 84.1 Ų | 84.1 | 71% | 0.706 | 43% | 0.432 | S | S | * | . | G | 310 helix | trans | -60.4 | -14.4 | -176.4 | -50 | 0 | 0 | 0 | 0 | 114.1 | D249 | D249-S251 PolarHBondContact O-N 2.98Å; D249-S251 WeakPolarHBondContact OD1-CB 3.1Å; D249-S251 PolarHBondContact OD1-N 3.06Å; D249-S251 PolarHBondContact OD1-OG 3.38Å |
| 252 | R | 81.2 | Confident | 88.1 | Confident | 220 Ų | 220 | 81.2 Ų | 81.2 | 83% | 0.83 | 42% | 0.417 | S | S | * | . | G | 310 helix | trans | -92.2 | -11.6 | 178.1 | -57.7 | -176.8 | -175.8 | -166.8 | -0.5 | 113.9 | P250 | P250-R252 PolarHBondContact O-N 2.89Š|
| 253 | L | 88.3 | Confident | 88.3 | Confident | 22 Ų | 22 | 81 Ų | 81 | 12% | 0.115 | 42% | 0.418 | C | S | . | . | S | Bend | trans | -91.5 | 141.2 | -176.1 | -62.1 | 175.2 | 0 | 0 | 0 | 111.5 | I81 P250 L255 Y315 L316 | I81-L253 HydrophobicContact CB-CB 4.46Å; I81-L253 HydrophobicContact CG2-CB 4.26Å; P250-L253 PolarHBondContact O-N 2.82Å; L253-L255 PolarHBondContact O-N 3.15Å; L253-Y315 HydrophobicContact CB-CE1 4.46Å; L253-Y315 HydrophobicContact CD1-CE1 4.31Å; L253-Y315 HydrophobicContact CD2-CE2 4.27Å; L253-L316 HydrophobicContact CD1-CD2 3.98Å |
| 254 | P | 89.5 | Confident | 88.5 | Confident | 57 Ų | 57 | 81.4 Ų | 81.4 | 37% | 0.37 | 42% | 0.42 | S | S | . | . | trans | -65.9 | 122 | 178.1 | 26.9 | -34.7 | 0 | 0 | 0 | 111.4 | G80 I81 V256 Y315 | G80-P254 CarbonylContact C-O 3.59Å; G80-P254 VanDerWaalsContact CA-O 3.25Å; G80-P254 WeakPolarHBondContact CA-O 3.5Å; I81-P254 PolarHBondContact N-O 3.48Å; P254-V256 PolarHBondContact O-N 2.94Å; P254-Y315 WeakPolarHBondContact CD-OH 3.13Å | ||
| 255 | L | 89.8 | Confident | 88.8 | Confident | 110 Ų | 110 | 77.7 Ų | 77.7 | 58% | 0.576 | 40% | 0.397 | S | S | * | . | S | Bend | trans | -57.9 | -39.9 | 174.5 | -76.1 | 74.9 | 0 | 0 | 0 | 111.3 | G80 I81 L82 M83 L253 | G80-L255 CarbonylContact C-O 3.55Å; I81-L255 PolarHBondContact N-O 3.24Å; L82-L255 HydrophobicContact CB-CB 4.15Å; L82-L255 WeakPolarHBondContact CB-O 3.33Å; L82-L255 HydrophobicContact CD2-CD2 4.33Å; L82-L255 PolarHBondContact N-O 3.12Å; M83-L255 PolarHBondContact N-O 3.49Å; M83-L255 VanDerWaalsContact N-O 3.16Å; L253-L255 PolarHBondContact O-N 3.15Å |
| 256 | V | 93.4 | Very high | 89.3 | Confident | 77 Ų | 77 | 74.1 Ų | 74.1 | 47% | 0.467 | 38% | 0.38 | S | S | . | . | S | Bend | trans | -130.5 | 126.2 | 174.4 | -170.2 | 0 | 0 | 0 | 0 | 107.4 | M83 P254 | M83-V256 HydrophobicContact CB-CG1 4.27Å; M83-V256 HydrophobicContact CB-CG2 4.31Å; M83-V256 HydrophobicContact CG-CG1 4.48Å; P254-V256 PolarHBondContact O-N 2.94Å |
| 257 | A | 92.3 | Very high | 90 | Very high | 22 Ų | 22 | 68 Ų | 68 | 18% | 0.182 | 35% | 0.352 | C | S | . | . | trans | -83.2 | -171.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | K77 A79 | K77-A257 WeakPolarHBondContact O-CB 3.49Å; A79-A257 VanDerWaalsContact C-CB 3.41Å; A79-A257 PolarHBondContact O-N 3.16Å | ||
| 258 | S | 91.3 | Very high | 90.6 | Very high | 67 Ų | 67 | 64.8 Ų | 64.8 | 47% | 0.469 | 34% | 0.336 | S | S | . | . | trans | -66 | 136.4 | 178.8 | -169.3 | 0 | 0 | 0 | 0 | 112 | K260 T261 Y262 | S258-K260 PolarHBondContact O-N 3.26Å; S258-K260 PolarHBondContact OG-N 3.48Å; S258-T261 PolarHBondContact O-N 2.96Å; S258-T261 PolarHBondContact O-OG1 3.09Å; S258-Y262 PolarHBondContact O-N 3.21Å | ||
| 259 | W | 90.3 | Very high | 91.2 | Very high | 184 Ų | 184 | 61.6 Ų | 61.6 | 70% | 0.697 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.2 | -19.8 | 169.7 | -68.5 | 107.7 | 0 | 0 | 0 | 113.5 | P263 | W259-P263 WeakPolarHBondContact O-CD 3.34Š|
| 260 | K | 90.2 | Very high | 91.8 | Very high | 153 Ų | 153 | 57.5 Ų | 57.5 | 67% | 0.665 | 29% | 0.293 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.1 | -30.8 | 174.1 | -64.6 | -171.7 | 178.3 | -175.9 | 0 | 113.6 | S258 P263 Q458 | S258-K260 PolarHBondContact O-N 3.26Å; S258-K260 PolarHBondContact OG-N 3.48Å; K260-P263 WeakPolarHBondContact O-CD 3.48Å; K260-Q458 WeakPolarHBondContact O-CG 3.48Å; K260-Q458 PolarHBondContact O-NE2 3.08Å |
| 261 | T | 92.8 | Very high | 92.4 | Very high | 34 Ų | 34 | 54.8 Ų | 54.8 | 21% | 0.209 | 27% | 0.274 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93 | -17.1 | -178.6 | 50 | 0 | 0 | 0 | 0 | 112.8 | N78 S258 P263 L264 F265 | N78-T261 CarbonylContact O-C 3.52Å; N78-T261 WeakPolarHBondContact O-CB 3.28Å; N78-T261 PolarHBondContact O-OG1 2.75Å; S258-T261 PolarHBondContact O-N 2.96Å; S258-T261 PolarHBondContact O-OG1 3.09Å; T261-P263 VanDerWaalsContact C-N 3.35Å; T261-L264 WeakPolarHBondContact O-CB 3.47Å; T261-L264 PolarHBondContact O-N 3.12Å; T261-F265 PolarHBondContact O-N 3.36Å |
| 262 | Y | 95.7 | Very high | 93.1 | Very high | 54 Ų | 54 | 50.1 Ų | 50.1 | 21% | 0.212 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -55 | -35.6 | 176 | -169.1 | -90.4 | 0 | 0 | 0 | 115.1 | N78 A79 M83 S87 S258 L264 F265 F266 | N78-Y262 PolarHBondContact O-N 3.06Å; A79-Y262 HydrophobicContact CB-CD2 4.11Å; A79-Y262 HydrophobicContact CB-CE2 4.38Å; M83-Y262 HydrophobicContact CE-CE2 3.94Å; M83-Y262 HydrophobicContact CG-CE2 4.1Å; S87-Y262 PolarHBondContact OG-OH 3.29Å; S258-Y262 PolarHBondContact O-N 3.21Å; Y262-L264 VanDerWaalsContact C-N 3.29Å; Y262-L264 PolarHBondContact O-N 2.97Å; Y262-F265 HydrophobicContact CD2-CD1 4.12Å; Y262-F265 AromaticContact CE2-CD1 3.76Å; Y262-F265 HydrophobicContact CE2-CD1 3.76Å; Y262-F265 HydrophobicContact CE2-CE1 4.08Å; Y262-F265 AromaticContact CZ-CD1 4Å; Y262-F265 WeakPolarHBondContact O-CB 3.36Å; Y262-F265 PolarHBondContact O-N 2.8Å; Y262-F266 PolarHBondContact O-N 2.92Å |
| 263 | P | 95.9 | Very high | 93.7 | Very high | 14 Ų | 14 | 39.7 Ų | 39.7 | 9% | 0.091 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -62.5 | -32.3 | 173.4 | -22.5 | 34.4 | 0 | 0 | 0 | 113.6 | W259 K260 T261 F266 G267 V454 Q458 | W259-P263 WeakPolarHBondContact O-CD 3.34Å; K260-P263 WeakPolarHBondContact O-CD 3.48Å; T261-P263 VanDerWaalsContact C-N 3.35Å; P263-F266 PolarHBondContact O-N 3.42Å; P263-G267 PolarHBondContact O-N 2.81Å; P263-V454 HydrophobicContact CB-CG1 4.04Å; P263-V454 HydrophobicContact CG-CG1 3.59Å; P263-Q458 HydrophobicContact CB-CB 3.89Å; P263-Q458 HydrophobicContact CB-CG 4.28Å; P263-Q458 HydrophobicContact CG-CB 4.31Å; P263-Q458 HydrophobicContact CG-CG 4.46Å |
| 264 | L | 94.9 | Very high | 93.7 | Very high | 8 Ų | 8 | 39.2 Ų | 39.2 | 4% | 0.042 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -68.2 | -40.2 | 173.4 | -55.1 | 175.7 | 0 | 0 | 0 | 111.9 | T261 Y262 T268 L402 S405 Q458 E462 | T261-L264 WeakPolarHBondContact O-CB 3.47Å; T261-L264 PolarHBondContact O-N 3.12Å; Y262-L264 VanDerWaalsContact C-N 3.29Å; Y262-L264 PolarHBondContact O-N 2.97Å; L264-T268 WeakPolarHBondContact O-CB 3.41Å; L264-T268 PolarHBondContact O-N 2.9Å; L264-T268 PolarHBondContact O-OG1 2.66Å; L264-L402 HydrophobicContact CD2-CD2 4.26Å; L264-S405 WeakPolarHBondContact CA-OG 3.26Å; L264-Q458 HydrophobicContact CD2-CG 4.02Å; L264-Q458 HydrophobicContact CG-CG 4.16Å; L264-E462 WeakPolarHBondContact CD1-OE1 3.41Å; L264-E462 WeakPolarHBondContact CD1-OE2 3.39Å |
| 265 | F | 97.1 | Very high | 93.5 | Very high | 0 Ų | 0 | 36.7 Ų | 36.7 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -59.7 | -48.3 | 171.5 | 161.9 | -92.9 | 0 | 0 | 0 | 110.4 | A75 N78 A79 S87 L88 T261 Y262 G267 T268 A269 | A75-F265 HydrophobicContact CB-CD2 3.73Å; A75-F265 HydrophobicContact CB-CE2 4.42Å; A75-F265 VanDerWaalsContact O-CD2 3.25Å; A75-F265 WeakPolarHBondContact O-CD2 3.31Å; N78-F265 HydrophobicContact CB-CB 4.25Å; A79-F265 HydrophobicContact CB-CB 4.03Å; A79-F265 HydrophobicContact CB-CD1 4.12Å; A79-F265 HydrophobicContact CB-CD2 3.84Å; A79-F265 HydrophobicContact CB-CE2 4.38Å; A79-F265 HydrophobicContact CB-CG 3.69Å; S87-F265 VanDerWaalsContact CB-CZ 3.47Å; L88-F265 HydrophobicContact CD2-CE2 3.73Å; L88-F265 HydrophobicContact CD2-CZ 3.84Å; L88-F265 HydrophobicContact CG-CE2 3.78Å; L88-F265 HydrophobicContact CG-CZ 3.88Å; T261-F265 PolarHBondContact O-N 3.36Å; Y262-F265 HydrophobicContact CD2-CD1 4.12Å; Y262-F265 AromaticContact CE2-CD1 3.76Å; Y262-F265 HydrophobicContact CE2-CD1 3.76Å; Y262-F265 HydrophobicContact CE2-CE1 4.08Å; Y262-F265 AromaticContact CZ-CD1 4Å; Y262-F265 WeakPolarHBondContact O-CB 3.36Å; Y262-F265 PolarHBondContact O-N 2.8Å; F265-G267 PolarHBondContact O-N 3.24Å; F265-T268 PolarHBondContact O-N 3.14Å; F265-A269 HydrophobicContact CE1-CB 4.32Å; F265-A269 HydrophobicContact CE2-CB 4.28Å; F265-A269 HydrophobicContact CZ-CB 4.04Å; F265-A269 VanDerWaalsContact O-CB 3.24Å; F265-A269 WeakPolarHBondContact O-CB 3.24Å; F265-A269 PolarHBondContact O-N 3.05Å |
| 266 | F | 97.1 | Very high | 93.4 | Very high | 8 Ų | 8 | 31.6 Ų | 31.6 | 4% | 0.035 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -57.5 | -49 | 179.1 | 175.5 | -85.4 | 0 | 0 | 0 | 111.6 | M91 Y262 P263 T268 A269 I270 L417 | M91-F266 HydrophobicContact CE-CD2 4.08Å; M91-F266 HydrophobicContact CE-CE2 3.54Å; M91-F266 HydrophobicContact CE-CZ 4.35Å; M91-F266 HydrophobicContact SD-CD2 4.47Å; M91-F266 HydrophobicContact SD-CE2 4.36Å; Y262-F266 PolarHBondContact O-N 2.92Å; P263-F266 PolarHBondContact O-N 3.42Å; F266-T268 PolarHBondContact O-N 3.03Å; F266-A269 PolarHBondContact O-N 3.31Å; F266-I270 HydrophobicContact CE1-CG1 4.12Å; F266-I270 HydrophobicContact CE2-CG1 4.18Å; F266-I270 HydrophobicContact CZ-CG1 3.92Å; F266-I270 WeakPolarHBondContact O-CB 3.25Å; F266-I270 PolarHBondContact O-N 3.28Å; F266-L417 HydrophobicContact CE2-CD1 4.12Å; F266-L417 HydrophobicContact CZ-CD1 3.67Å |
| 267 | G | 96.3 | Very high | 93 | Very high | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -57.1 | -50.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | P263 F265 A269 I270 F271 S405 G408 | P263-G267 PolarHBondContact O-N 2.81Å; F265-G267 PolarHBondContact O-N 3.24Å; G267-A269 PolarHBondContact O-N 3.33Å; G267-I270 PolarHBondContact O-N 3.18Å; G267-F271 VanDerWaalsContact O-CB 3.32Å; G267-F271 WeakPolarHBondContact O-CB 3.14Å; G267-F271 PolarHBondContact O-N 2.94Å; G267-S405 WeakPolarHBondContact CA-O 3.3Å; G267-G408 WeakPolarHBondContact O-CA 3.37Å |
| 268 | T | 96.3 | Very high | 92.8 | Very high | 8 Ų | 8 | 30.8 Ų | 30.8 | 5% | 0.049 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -65 | -37.6 | -179.4 | -54.7 | 0 | 0 | 0 | 0 | 113.4 | A75 L264 F265 F266 S272 I404 | A75-T268 HydrophobicContact CB-CG2 3.67Å; L264-T268 WeakPolarHBondContact O-CB 3.41Å; L264-T268 PolarHBondContact O-N 2.9Å; L264-T268 PolarHBondContact O-OG1 2.66Å; F265-T268 PolarHBondContact O-N 3.14Å; F266-T268 PolarHBondContact O-N 3.03Å; T268-S272 WeakPolarHBondContact O-CB 3.4Å; T268-S272 PolarHBondContact O-N 2.86Å; T268-S272 PolarHBondContact O-OG 3.3Å; T268-I404 HydrophobicContact CG2-CG2 3.73Å |
| 269 | A | 96.7 | Very high | 92.8 | Very high | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -67.2 | -46 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | L88 F265 F266 G267 S272 F273 | L88-A269 HydrophobicContact CD2-CB 3.76Å; F265-A269 HydrophobicContact CE1-CB 4.32Å; F265-A269 HydrophobicContact CE2-CB 4.28Å; F265-A269 HydrophobicContact CZ-CB 4.04Å; F265-A269 VanDerWaalsContact O-CB 3.24Å; F265-A269 WeakPolarHBondContact O-CB 3.24Å; F265-A269 PolarHBondContact O-N 3.05Å; F266-A269 PolarHBondContact O-N 3.31Å; G267-A269 PolarHBondContact O-N 3.33Å; A269-S272 WeakPolarHBondContact O-CB 3.46Å; A269-S272 PolarHBondContact O-N 2.96Å; A269-S272 VanDerWaalsContact O-N 3.15Å; A269-F273 VanDerWaalsContact O-CD2 3.28Å; A269-F273 WeakPolarHBondContact O-CD2 3.35Å; A269-F273 PolarHBondContact O-N 2.94Å |
| 270 | I | 96 | Very high | 92.9 | Very high | 1 Ų | 1 | 18.9 Ų | 18.9 | 1% | 0.005 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -69.4 | -38.8 | 178.2 | -76.5 | -55.8 | 0 | 0 | 0 | 112.3 | M91 F266 G267 S272 F273 E274 G408 L417 | M91-I270 HydrophobicContact CE-CD1 3.45Å; M91-I270 VanDerWaalsContact CE-CD1 3.45Å; M91-I270 HydrophobicContact CE-CG1 3.78Å; F266-I270 HydrophobicContact CE1-CG1 4.12Å; F266-I270 HydrophobicContact CE2-CG1 4.18Å; F266-I270 HydrophobicContact CZ-CG1 3.92Å; F266-I270 WeakPolarHBondContact O-CB 3.25Å; F266-I270 PolarHBondContact O-N 3.28Å; G267-I270 PolarHBondContact O-N 3.18Å; I270-S272 PolarHBondContact O-N 2.85Å; I270-F273 PolarHBondContact O-N 3.36Å; I270-E274 WeakPolarHBondContact O-CB 3.32Å; I270-E274 PolarHBondContact O-N 2.86Å; I270-G408 WeakPolarHBondContact CG2-O 3.32Å; I270-L417 HydrophobicContact CD1-CD1 3.84Å; I270-L417 HydrophobicContact CD1-CD2 4.17Å; I270-L417 HydrophobicContact CD1-CG 4.08Å; I270-L417 HydrophobicContact CG1-CD1 4.07Å |
| 271 | F | 94.9 | Very high | 92.9 | Very high | 10 Ų | 10 | 13.8 Ų | 13.8 | 4% | 0.044 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -53.5 | -42.4 | 167.4 | 178.4 | -83.6 | 0 | 0 | 0 | 111.6 | F158 V161 G267 E274 I404 V407 | F158-F271 HydrophobicContact CD1-CD2 4.06Å; F158-F271 AromaticContact CD1-CE2 3.31Å; F158-F271 HydrophobicContact CD1-CE2 3.31Å; F158-F271 AromaticContact CD1-CZ 3.79Å; F158-F271 HydrophobicContact CD1-CZ 3.79Å; F158-F271 AromaticContact CE1-CD2 3.67Å; F158-F271 HydrophobicContact CE1-CD2 3.67Å; F158-F271 AromaticContact CE1-CE2 3.39Å; F158-F271 HydrophobicContact CE1-CE2 3.39Å; F158-F271 HydrophobicContact CE1-CG 4.44Å; F158-F271 AromaticContact CE1-CZ 3.95Å; F158-F271 HydrophobicContact CE1-CZ 3.95Å; F158-F271 HydrophobicContact CG-CE2 4.31Å; F158-F271 HydrophobicContact CG-CZ 4.39Å; F158-F271 HydrophobicContact CZ-CE2 4.43Å; V161-F271 HydrophobicContact CB-CZ 4.21Å; V161-F271 HydrophobicContact CG1-CZ 3.96Å; V161-F271 HydrophobicContact CG2-CE2 3.84Å; V161-F271 HydrophobicContact CG2-CZ 3.96Å; G267-F271 VanDerWaalsContact O-CB 3.32Å; G267-F271 WeakPolarHBondContact O-CB 3.14Å; G267-F271 PolarHBondContact O-N 2.94Å; F271-E274 WeakPolarHBondContact O-CB 3.31Å; F271-E274 PolarHBondContact O-N 3.03Å; F271-I404 HydrophobicContact CB-CG2 4.09Å; F271-I404 HydrophobicContact CD1-CG2 3.78Å; F271-I404 HydrophobicContact CD2-CG2 4.3Å; F271-I404 HydrophobicContact CE1-CG1 4.3Å; F271-I404 HydrophobicContact CE1-CG2 4.3Å; F271-I404 HydrophobicContact CG-CG2 3.81Å; F271-I404 HydrophobicContact CZ-CG1 4.29Å; F271-V407 HydrophobicContact CD2-CB 4.04Å; F271-V407 HydrophobicContact CD2-CG1 3.98Å; F271-V407 HydrophobicContact CE2-CB 4.24Å; F271-V407 HydrophobicContact CE2-CG1 4.07Å |
| 272 | S | 95.1 | Very high | 92.7 | Very high | 4 Ų | 4 | 12.9 Ų | 12.9 | 3% | 0.028 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -72.4 | -35.1 | -177.8 | -58.2 | 0 | 0 | 0 | 0 | 112.8 | G68 L72 T268 A269 I270 E274 Y307 | G68-S272 WeakPolarHBondContact CA-OG 3.41Å; G68-S272 PolarHBondContact O-OG 3.4Å; L72-S272 WeakPolarHBondContact CD2-OG 3.36Å; T268-S272 WeakPolarHBondContact O-CB 3.4Å; T268-S272 PolarHBondContact O-N 2.86Å; T268-S272 PolarHBondContact O-OG 3.3Å; A269-S272 WeakPolarHBondContact O-CB 3.46Å; A269-S272 PolarHBondContact O-N 2.96Å; A269-S272 VanDerWaalsContact O-N 3.15Å; I270-S272 PolarHBondContact O-N 2.85Å; S272-E274 VanDerWaalsContact C-N 3.32Å; S272-Y307 VanDerWaalsContact O-CE2 3.25Å; S272-Y307 WeakPolarHBondContact O-CE2 2.97Å; S272-Y307 PolarHBondContact O-OH 2.85Å |
| 273 | F | 93.6 | Very high | 92.6 | Very high | 0 Ų | 0 | 10.8 Ų | 10.8 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -85.1 | 1.6 | 175.8 | -73.6 | -65 | 0 | 0 | 0 | 114.1 | L88 M91 G92 A95 M99 A269 I270 S275 M300 V303 T304 Y307 | L88-F273 HydrophobicContact CD2-CE2 4.31Å; L88-F273 WeakPolarHBondContact O-CE2 3.41Å; M91-F273 HydrophobicContact CB-CD2 4.27Å; M91-F273 HydrophobicContact CB-CE2 4.23Å; G92-F273 VanDerWaalsContact CA-CZ 3.41Å; A95-F273 HydrophobicContact CB-CB 3.94Å; A95-F273 HydrophobicContact CB-CG 4.38Å; M99-F273 VanDerWaalsContact CE-O 3.28Å; M99-F273 WeakPolarHBondContact CE-O 3.34Å; A269-F273 VanDerWaalsContact O-CD2 3.28Å; A269-F273 WeakPolarHBondContact O-CD2 3.35Å; A269-F273 PolarHBondContact O-N 2.94Å; I270-F273 PolarHBondContact O-N 3.36Å; F273-S275 PolarHBondContact O-N 3.47Å; F273-M300 HydrophobicContact CD1-CE 3.9Å; F273-V303 HydrophobicContact CD1-CG1 4.38Å; F273-V303 HydrophobicContact CE1-CG1 4.23Å; F273-T304 WeakPolarHBondContact CE1-OG1 3.21Å; F273-T304 HydrophobicContact CZ-CG2 4.19Å; F273-Y307 AromaticContact CD1-CD2 3.94Å; F273-Y307 HydrophobicContact CD1-CD2 3.94Å; F273-Y307 AromaticContact CD1-CE2 3.78Å; F273-Y307 HydrophobicContact CD1-CE2 3.78Å; F273-Y307 HydrophobicContact CD2-CD2 4.44Å; F273-Y307 AromaticContact CE1-CD2 3.51Å; F273-Y307 HydrophobicContact CE1-CD2 3.51Å; F273-Y307 AromaticContact CE1-CE2 3.83Å; F273-Y307 HydrophobicContact CE1-CE2 3.83Å; F273-Y307 HydrophobicContact CE2-CD2 4.06Å; F273-Y307 HydrophobicContact CG-CD2 4.39Å; F273-Y307 HydrophobicContact CG-CE2 4.19Å; F273-Y307 AromaticContact CZ-CD2 3.58Å; F273-Y307 HydrophobicContact CZ-CD2 3.58Å; F273-Y307 HydrophobicContact CZ-CE2 4.27Å |
| 274 | E | 87.9 | Confident | 92.3 | Very high | 13 Ų | 13 | 13.1 Ų | 13.1 | 6% | 0.061 | 8% | 0.079 | C | C | . | . | trans | -73.9 | 83.8 | 179.5 | -178.7 | 59.8 | -160.3 | 0 | 0 | 111.6 | T154 F158 I270 F271 S272 I276 S412 | T154-E274 HydrophobicContact CG2-CG 3.82Å; F158-E274 HydrophobicContact CE1-CG 4.42Å; F158-E274 HydrophobicContact CZ-CB 3.97Å; F158-E274 HydrophobicContact CZ-CG 3.66Å; I270-E274 WeakPolarHBondContact O-CB 3.32Å; I270-E274 PolarHBondContact O-N 2.86Å; F271-E274 WeakPolarHBondContact O-CB 3.31Å; F271-E274 PolarHBondContact O-N 3.03Å; S272-E274 VanDerWaalsContact C-N 3.32Å; E274-I276 WeakPolarHBondContact OE1-CG2 3.27Å; E274-S412 WeakPolarHBondContact CG-OG 3.18Å; E274-S412 WeakPolarHBondContact OE2-CB 3.41Å | ||
| 275 | S | 86.6 | Confident | 92 | Very high | 4 Ų | 4 | 19.3 Ų | 19.3 | 3% | 0.028 | 11% | 0.106 | C | C | . | . | trans | -121.5 | 7.7 | 167.4 | 62 | 0 | 0 | 0 | 0 | 113.6 | N64 M99 F273 G277 V278 V279 | N64-S275 VanDerWaalsContact CG-OG 3.29Å; N64-S275 VanDerWaalsContact ND2-CB 3.28Å; N64-S275 WeakPolarHBondContact ND2-CB 3.48Å; N64-S275 PolarHBondContact ND2-OG 2.92Å; N64-S275 WeakPolarHBondContact OD1-CB 3.24Å; N64-S275 PolarHBondContact OD1-OG 3.5Å; M99-S275 VanDerWaalsContact CE-OG 3.23Å; M99-S275 WeakPolarHBondContact CE-OG 3.31Å; F273-S275 PolarHBondContact O-N 3.47Å; S275-G277 PolarHBondContact O-N 3.39Å; S275-G277 VanDerWaalsContact O-N 3.14Å; S275-V278 WeakPolarHBondContact O-CG2 3.23Å; S275-V278 PolarHBondContact O-N 2.86Å; S275-V279 PolarHBondContact O-N 2.89Å | ||
| 276 | I | 87.3 | Confident | 91.6 | Very high | 2 Ų | 2 | 20.1 Ų | 20.1 | 1% | 0.01 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -59.1 | -33.8 | -173.9 | -164.4 | 164.6 | 0 | 0 | 0 | 112.8 | M99 L102 Y120 E274 V278 V279 L415 P420 | M99-I276 HydrophobicContact CG-CB 4.37Å; M99-I276 HydrophobicContact CG-CG1 4.24Å; L102-I276 HydrophobicContact CB-CD1 4.42Å; L102-I276 HydrophobicContact CD2-CD1 3.79Å; L102-I276 HydrophobicContact CD2-CG1 3.47Å; L102-I276 VanDerWaalsContact CD2-CG1 3.47Å; Y120-I276 HydrophobicContact CE1-CD1 4.2Å; Y120-I276 HydrophobicContact CE1-CG1 4.19Å; Y120-I276 HydrophobicContact CE1-CG2 4.13Å; E274-I276 WeakPolarHBondContact OE1-CG2 3.27Å; I276-V278 VanDerWaalsContact C-N 3.26Å; I276-V278 PolarHBondContact O-N 3.27Å; I276-V279 PolarHBondContact O-N 3.06Å; I276-L415 HydrophobicContact CG2-CB 3.98Å; I276-P420 HydrophobicContact CD1-CG 3.6Å |
| 277 | G | 84.9 | Confident | 91.1 | Very high | 23 Ų | 23 | 25.7 Ų | 25.7 | 24% | 0.237 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -64.3 | -18.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | S275 P281 | S275-G277 PolarHBondContact O-N 3.39Å; S275-G277 VanDerWaalsContact O-N 3.14Å; G277-P281 WeakPolarHBondContact O-CD 3.3Å |
| 278 | V | 87.3 | Confident | 90.6 | Very high | 59 Ų | 59 | 30.4 Ų | 30.4 | 36% | 0.358 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -98.7 | -13.3 | 174.6 | -59.2 | 0 | 0 | 0 | 0 | 113.7 | S275 I276 L282 | S275-V278 WeakPolarHBondContact O-CG2 3.23Å; S275-V278 PolarHBondContact O-N 2.86Å; I276-V278 VanDerWaalsContact C-N 3.26Å; I276-V278 PolarHBondContact O-N 3.27Å; V278-L282 WeakPolarHBondContact O-CB 3.47Å; V278-L282 PolarHBondContact O-N 3.28Å |
| 279 | V | 92.1 | Very high | 90.1 | Very high | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -60.9 | -56.9 | -175.5 | 172.3 | 0 | 0 | 0 | 0 | 111.8 | M99 V103 S275 I276 L282 E283 F292 L296 | M99-V279 HydrophobicContact CB-CG1 4.46Å; M99-V279 HydrophobicContact CB-CG2 4.21Å; M99-V279 HydrophobicContact CG-CG2 3.92Å; M99-V279 HydrophobicContact SD-CG2 3.78Å; V103-V279 HydrophobicContact CG2-CG1 3.49Å; V103-V279 VanDerWaalsContact CG2-CG1 3.49Å; S275-V279 PolarHBondContact O-N 2.89Å; I276-V279 PolarHBondContact O-N 3.06Å; V279-L282 PolarHBondContact O-N 2.92Å; V279-E283 PolarHBondContact O-N 3.01Å; V279-F292 HydrophobicContact CG1-CE1 3.59Å; V279-F292 HydrophobicContact CG1-CZ 3.84Å; V279-F292 VanDerWaalsContact O-CZ 3.28Å; V279-F292 WeakPolarHBondContact O-CZ 3.48Å; V279-L296 HydrophobicContact CG2-CD1 4.3Å |
| 280 | L | 92.3 | Very high | 89.7 | Confident | 1 Ų | 1 | 43 Ų | 43 | 1% | 0.005 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -66.5 | -46.8 | -179.5 | -62.4 | 179.7 | 0 | 0 | 0 | 112.7 | L102 V103 A106 L282 E283 N284 | L102-L280 HydrophobicContact CD1-CD1 3.97Å; L102-L280 HydrophobicContact CD2-CD1 3.99Å; L102-L280 HydrophobicContact CD2-CG 4.08Å; L102-L280 HydrophobicContact CG-CD1 3.86Å; L102-L280 HydrophobicContact CG-CD2 4.25Å; L102-L280 HydrophobicContact CG-CG 4.06Å; V103-L280 HydrophobicContact CG2-CD2 4.27Å; A106-L280 HydrophobicContact CB-CD1 4.09Å; A106-L280 HydrophobicContact CB-CD2 3.5Å; A106-L280 HydrophobicContact CB-CG 4.46Å; L280-L282 PolarHBondContact O-N 3.25Å; L280-L282 VanDerWaalsContact O-N 3.15Å; L280-E283 PolarHBondContact O-N 3.2Å; L280-N284 VanDerWaalsContact O-CB 3.32Å; L280-N284 WeakPolarHBondContact O-CB 3.45Å; L280-N284 PolarHBondContact O-N 2.76Å; L280-N284 PolarHBondContact O-ND2 2.92Å |
| 281 | P | 89.8 | Confident | 89.4 | Confident | 46 Ų | 46 | 47.9 Ų | 47.9 | 30% | 0.299 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -58.9 | -26.8 | 175.1 | -26.8 | 36.3 | 0 | 0 | 0 | 114.5 | G277 K285 | G277-P281 WeakPolarHBondContact O-CD 3.3Å; P281-K285 WeakPolarHBondContact O-CD 3.26Å; P281-K285 WeakPolarHBondContact O-CG 3.35Å |
| 282 | L | 89.9 | Confident | 89.3 | Confident | 16 Ų | 16 | 47.4 Ų | 47.4 | 8% | 0.084 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -77 | -46.9 | 175.7 | -175.4 | 65.2 | 0 | 0 | 0 | 111.6 | I51 H59 L60 V278 V279 L280 N284 K285 M286 F292 | I51-L282 HydrophobicContact CD1-CD1 3.35Å; I51-L282 HydrophobicContact CD1-CG 4.26Å; H59-L282 HydrophobicContact CB-CD1 3.59Å; H59-L282 HydrophobicContact CB-CD2 4.38Å; L60-L282 HydrophobicContact CB-CD2 3.78Å; L60-L282 HydrophobicContact CD1-CD2 4.4Å; V278-L282 WeakPolarHBondContact O-CB 3.47Å; V278-L282 PolarHBondContact O-N 3.28Å; V279-L282 PolarHBondContact O-N 2.92Å; L280-L282 PolarHBondContact O-N 3.25Å; L280-L282 VanDerWaalsContact O-N 3.15Å; L282-N284 VanDerWaalsContact C-N 3.34Å; L282-N284 PolarHBondContact O-N 2.7Å; L282-K285 PolarHBondContact O-N 3.22Å; L282-M286 PolarHBondContact O-N 3.27Å; L282-F292 HydrophobicContact CB-CE2 4.4Å; L282-F292 HydrophobicContact CB-CZ 4.48Å; L282-F292 HydrophobicContact CD2-CE2 3.93Å; L282-F292 HydrophobicContact CD2-CZ 4.42Å; L282-F292 HydrophobicContact CG-CE2 4.07Å |
| 283 | E | 91.9 | Very high | 89.2 | Confident | 10 Ų | 10 | 49 Ų | 49 | 5% | 0.047 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -54.7 | -50.3 | 173.2 | -172.9 | 177.3 | -168.9 | 0 | 0 | 111.4 | Q107 V279 L280 K285 M286 A289 F292 | Q107-E283 WeakPolarHBondContact CG-OE1 3.22Å; Q107-E283 PolarHBondContact NE2-OE1 3.17Å; V279-E283 PolarHBondContact O-N 3.01Å; L280-E283 PolarHBondContact O-N 3.2Å; E283-K285 PolarHBondContact O-N 3.16Å; E283-M286 WeakPolarHBondContact O-CB 3.41Å; E283-M286 PolarHBondContact O-N 2.71Å; E283-A289 HydrophobicContact CG-CB 3.88Å; E283-F292 HydrophobicContact CB-CD1 3.57Å; E283-F292 HydrophobicContact CB-CD2 4.43Å; E283-F292 HydrophobicContact CB-CE1 3.64Å; E283-F292 HydrophobicContact CB-CE2 4.5Å; E283-F292 HydrophobicContact CB-CG 3.98Å; E283-F292 HydrophobicContact CB-CZ 4.12Å; E283-F292 HydrophobicContact CG-CB 4.09Å; E283-F292 HydrophobicContact CG-CD1 3.6Å; E283-F292 HydrophobicContact CG-CE1 4.2Å; E283-F292 HydrophobicContact CG-CG 3.91Å |
| 284 | N | 90.3 | Very high | 89.2 | Confident | 62 Ų | 62 | 52.3 Ų | 52.3 | 33% | 0.332 | 27% | 0.272 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60 | -17.5 | -178.2 | -67.4 | -27.1 | 0 | 0 | 0 | 113.5 | F117 M118 L280 L282 | F117-N284 HydrophobicContact CB-CB 4Å; F117-N284 VanDerWaalsContact CB-CG 3.46Å; F117-N284 WeakPolarHBondContact CB-OD1 3.42Å; M118-N284 PolarHBondContact O-ND2 3.36Å; L280-N284 VanDerWaalsContact O-CB 3.32Å; L280-N284 WeakPolarHBondContact O-CB 3.45Å; L280-N284 PolarHBondContact O-N 2.76Å; L280-N284 PolarHBondContact O-ND2 2.92Å; L282-N284 VanDerWaalsContact C-N 3.34Å; L282-N284 PolarHBondContact O-N 2.7Å |
| 285 | K | 88.7 | Confident | 89.6 | Confident | 138 Ų | 138 | 52.1 Ų | 52.1 | 60% | 0.6 | 27% | 0.271 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.2 | -6.7 | 178.4 | -71.7 | 172.7 | -175.7 | 168 | 0 | 113.7 | G50 I51 P281 L282 E283 | G50-K285 CarbonylContact C-O 3.4Å; G50-K285 WeakPolarHBondContact CA-O 3.42Å; I51-K285 HydrophobicContact CD1-CB 4.49Å; I51-K285 PolarHBondContact N-O 3.5Å; P281-K285 WeakPolarHBondContact O-CD 3.26Å; P281-K285 WeakPolarHBondContact O-CG 3.35Å; L282-K285 PolarHBondContact O-N 3.22Å; E283-K285 PolarHBondContact O-N 3.16Å |
| 286 | M | 89.1 | Confident | 90 | Very high | 18 Ų | 18 | 52 Ų | 52 | 9% | 0.089 | 27% | 0.27 | C | S | . | . | B | Isolated β-bridge | trans | -71.7 | 145.7 | 179.6 | -76.5 | -164.9 | 68.1 | 0 | 0 | 112.8 | I51 V53 A56 L282 E283 N288 F292 I295 | I51-M286 HydrophobicContact CD1-CG 4.15Å; I51-M286 HydrophobicContact CG1-CB 4.47Å; I51-M286 HydrophobicContact CG1-CG 3.93Å; V53-M286 HydrophobicContact CG2-CE 4.33Å; A56-M286 HydrophobicContact CB-CE 4.22Å; A56-M286 HydrophobicContact CB-CG 4.07Å; A56-M286 HydrophobicContact CB-SD 3.94Å; L282-M286 PolarHBondContact O-N 3.27Å; E283-M286 WeakPolarHBondContact O-CB 3.41Å; E283-M286 PolarHBondContact O-N 2.71Å; M286-N288 VanDerWaalsContact C-N 3.3Å; M286-N288 PolarHBondContact O-N 2.7Å; M286-F292 HydrophobicContact SD-CB 3.77Å; M286-F292 HydrophobicContact SD-CD2 3.52Å; M286-F292 VanDerWaalsContact SD-CD2 3.52Å; M286-F292 HydrophobicContact SD-CG 4.04Å; M286-I295 HydrophobicContact CE-CD1 3.32Å; M286-I295 HydrophobicContact SD-CD1 3.95Å |
| 287 | K | 86.8 | Confident | 90.4 | Very high | 125 Ų | 125 | 54.1 Ų | 54.1 | 54% | 0.543 | 29% | 0.285 | S | S | . | . | S | Bend | trans | -60.5 | -40.4 | 168.1 | -64.4 | -177.8 | -176.1 | -178.4 | 0 | 112.6 | G50 I51 | G50-K287 WeakPolarHBondContact O-CE 3.43Å; G50-K287 VanDerWaalsContact O-CG 3.3Å; G50-K287 WeakPolarHBondContact O-CG 3.36Å; I51-K287 PolarHBondContact O-N 3.47Å |
| 288 | N | 85.3 | Confident | 90.9 | Very high | 98 Ų | 98 | 57.5 Ų | 57.5 | 52% | 0.524 | 30% | 0.297 | S | S | . | . | trans | -133.9 | 76.7 | -172.5 | -71.3 | -21.1 | 0 | 0 | 0 | 110.8 | M286 R290 H291 | M286-N288 VanDerWaalsContact C-N 3.3Å; M286-N288 PolarHBondContact O-N 2.7Å; N288-R290 PolarHBondContact O-N 2.87Å; N288-H291 PolarHBondContact O-N 3.19Å; N288-H291 VanDerWaalsContact O-N 3.14Å | ||
| 289 | A | 86.4 | Confident | 91.3 | Very high | 36 Ų | 36 | 54.7 Ų | 54.7 | 30% | 0.298 | 28% | 0.28 | S | S | . | . | G | 310 helix | trans | -54.5 | -23.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | E283 H291 F292 | E283-A289 HydrophobicContact CG-CB 3.88Å; A289-H291 PolarHBondContact O-N 3.12Å; A289-H291 VanDerWaalsContact O-N 3.07Å; A289-F292 WeakPolarHBondContact O-CB 3.11Å; A289-F292 PolarHBondContact O-N 3.01Å |
| 290 | R | 86.5 | Confident | 91.5 | Very high | 237 Ų | 237 | 54.8 Ų | 54.8 | 89% | 0.894 | 28% | 0.281 | S | S | * | . | G | 310 helix | trans | -54.4 | -27.8 | 174.7 | -64.3 | -173.2 | -175.2 | -176 | 1.9 | 114.3 | N288 | N288-R290 PolarHBondContact O-N 2.87Š|
| 291 | H | 89.7 | Confident | 91.7 | Very high | 103 Ų | 103 | 57.9 Ų | 57.9 | 48% | 0.477 | 30% | 0.303 | S | S | . | . | G | 310 helix | trans | -89.5 | -7.7 | 177.8 | -59.8 | 90.1 | 0 | 0 | 0 | 113.2 | N288 A289 A294 I295 | N288-H291 PolarHBondContact O-N 3.19Å; N288-H291 VanDerWaalsContact O-N 3.14Å; A289-H291 PolarHBondContact O-N 3.12Å; A289-H291 VanDerWaalsContact O-N 3.07Å; H291-A294 PolarHBondContact O-N 2.82Å; H291-A294 VanDerWaalsContact O-N 3.16Å; H291-I295 HydrophobicContact CB-CD1 4.4Å; H291-I295 WeakPolarHBondContact O-CG1 3.22Å; H291-I295 PolarHBondContact O-N 2.7Å |
| 292 | F | 93.1 | Very high | 92 | Very high | 0 Ų | 0 | 59.2 Ų | 59.2 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -59 | -40.5 | -174.8 | -173.6 | -117 | 0 | 0 | 0 | 113.9 | V103 V279 L282 E283 M286 A289 A294 I295 L296 | V103-F292 HydrophobicContact CG1-CD1 4.25Å; V103-F292 HydrophobicContact CG2-CD1 3.94Å; V103-F292 HydrophobicContact CG2-CE1 3.64Å; V279-F292 HydrophobicContact CG1-CE1 3.59Å; V279-F292 HydrophobicContact CG1-CZ 3.84Å; V279-F292 VanDerWaalsContact O-CZ 3.28Å; V279-F292 WeakPolarHBondContact O-CZ 3.48Å; L282-F292 HydrophobicContact CB-CE2 4.4Å; L282-F292 HydrophobicContact CB-CZ 4.48Å; L282-F292 HydrophobicContact CD2-CE2 3.93Å; L282-F292 HydrophobicContact CD2-CZ 4.42Å; L282-F292 HydrophobicContact CG-CE2 4.07Å; E283-F292 HydrophobicContact CB-CD1 3.57Å; E283-F292 HydrophobicContact CB-CD2 4.43Å; E283-F292 HydrophobicContact CB-CE1 3.64Å; E283-F292 HydrophobicContact CB-CE2 4.5Å; E283-F292 HydrophobicContact CB-CG 3.98Å; E283-F292 HydrophobicContact CB-CZ 4.12Å; E283-F292 HydrophobicContact CG-CB 4.09Å; E283-F292 HydrophobicContact CG-CD1 3.6Å; E283-F292 HydrophobicContact CG-CE1 4.2Å; E283-F292 HydrophobicContact CG-CG 3.91Å; M286-F292 HydrophobicContact SD-CB 3.77Å; M286-F292 HydrophobicContact SD-CD2 3.52Å; M286-F292 VanDerWaalsContact SD-CD2 3.52Å; M286-F292 HydrophobicContact SD-CG 4.04Å; A289-F292 WeakPolarHBondContact O-CB 3.11Å; A289-F292 PolarHBondContact O-N 3.01Å; F292-A294 VanDerWaalsContact C-N 3.31Å; F292-A294 PolarHBondContact O-N 3.48Å; F292-I295 PolarHBondContact O-N 2.99Å; F292-I295 VanDerWaalsContact O-N 3.13Å; F292-L296 WeakPolarHBondContact O-CB 3.49Å; F292-L296 PolarHBondContact O-N 3.35Å |
| 293 | P | 93.6 | Very high | 92.2 | Very high | 38 Ų | 38 | 58.4 Ų | 58.4 | 25% | 0.247 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -57.5 | -39.7 | 175 | -27.3 | 36.9 | 0 | 0 | 0 | 113.5 | H100 V103 L296 S297 | H100-P293 PolarHBondContact CE1-O 2.96Å; V103-P293 HydrophobicContact CG1-CG 4.43Å; P293-L296 PolarHBondContact O-N 3.01Å; P293-S297 PolarHBondContact O-N 2.84Å; P293-S297 PolarHBondContact O-OG 2.83Å |
| 294 | A | 94.3 | Very high | 92.5 | Very high | 70 Ų | 70 | 58.4 Ų | 58.4 | 58% | 0.579 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -68.6 | -38.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | H291 F292 L296 L298 | H291-A294 PolarHBondContact O-N 2.82Å; H291-A294 VanDerWaalsContact O-N 3.16Å; F292-A294 VanDerWaalsContact C-N 3.31Å; F292-A294 PolarHBondContact O-N 3.48Å; A294-L296 VanDerWaalsContact C-N 3.34Å; A294-L298 WeakPolarHBondContact O-CB 3.21Å; A294-L298 PolarHBondContact O-N 2.95Å |
| 295 | I | 94.8 | Very high | 92.8 | Very high | 9 Ų | 9 | 59 Ų | 59 | 5% | 0.046 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -65.8 | -39.6 | 175 | -62 | 165.8 | 0 | 0 | 0 | 110.8 | V53 A56 L57 M286 H291 F292 L298 G299 | V53-I295 HydrophobicContact CB-CD1 4.13Å; V53-I295 HydrophobicContact CG1-CD1 3.75Å; V53-I295 HydrophobicContact CG1-CG1 3.95Å; V53-I295 HydrophobicContact CG2-CD1 4.15Å; A56-I295 HydrophobicContact CB-CD1 4.34Å; A56-I295 HydrophobicContact CB-CG2 4.39Å; L57-I295 HydrophobicContact CB-CG2 4Å; L57-I295 HydrophobicContact CD1-CG2 4.16Å; M286-I295 HydrophobicContact CE-CD1 3.32Å; M286-I295 HydrophobicContact SD-CD1 3.95Å; H291-I295 HydrophobicContact CB-CD1 4.4Å; H291-I295 WeakPolarHBondContact O-CG1 3.22Å; H291-I295 PolarHBondContact O-N 2.7Å; F292-I295 PolarHBondContact O-N 2.99Å; F292-I295 VanDerWaalsContact O-N 3.13Å; I295-L298 PolarHBondContact O-N 3.09Å; I295-G299 PolarHBondContact O-N 3.42Å |
| 296 | L | 95.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.2 | -52.1 | 176.9 | -178.3 | 63 | 0 | 0 | 0 | 110.8 | L60 M99 V103 V279 F292 P293 A294 L298 G299 M300 | L60-L296 HydrophobicContact CD1-CD1 4.13Å; L60-L296 HydrophobicContact CD2-CD1 4.02Å; M99-L296 HydrophobicContact CB-CD1 4.08Å; M99-L296 HydrophobicContact CB-CD2 3.78Å; M99-L296 HydrophobicContact CB-CG 4.4Å; M99-L296 HydrophobicContact SD-CD1 3.99Å; V103-L296 HydrophobicContact CG2-CD2 4.37Å; V279-L296 HydrophobicContact CG2-CD1 4.3Å; F292-L296 WeakPolarHBondContact O-CB 3.49Å; F292-L296 PolarHBondContact O-N 3.35Å; P293-L296 PolarHBondContact O-N 3.01Å; A294-L296 VanDerWaalsContact C-N 3.34Å; L296-L298 VanDerWaalsContact C-N 3.34Å; L296-L298 PolarHBondContact O-N 3.27Å; L296-G299 PolarHBondContact O-N 3.34Å; L296-M300 HydrophobicContact CD1-CG 4.04Å; L296-M300 WeakPolarHBondContact O-CB 3.35Å; L296-M300 VanDerWaalsContact O-CG 3.32Å; L296-M300 WeakPolarHBondContact O-CG 3.36Å; L296-M300 PolarHBondContact O-N 2.94Å |
| 297 | S | 96.3 | Very high | 93.5 | Very high | 47 Ų | 47 | 53.5 Ų | 53.5 | 33% | 0.329 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -57.9 | -45.1 | 175.6 | -64.4 | 0 | 0 | 0 | 0 | 112.3 | H100 P293 S301 | H100-S297 PolarHBondContact CE1-OG 2.98Å; H100-S297 PolarHBondContact NE2-OG 3.42Å; P293-S297 PolarHBondContact O-N 2.84Å; P293-S297 PolarHBondContact O-OG 2.83Å; S297-S301 VanDerWaalsContact O-CB 3.31Å; S297-S301 WeakPolarHBondContact O-CB 3.21Å; S297-S301 PolarHBondContact O-N 3.01Å; S297-S301 PolarHBondContact O-OG 3.43Å |
| 298 | L | 96.4 | Very high | 94 | Very high | 94 Ų | 94 | 49.5 Ų | 49.5 | 49% | 0.492 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -65.1 | -47.5 | 180 | 178.8 | 60.2 | 0 | 0 | 0 | 111.8 | L57 A294 I295 L296 S301 I302 | L57-L298 HydrophobicContact CD1-CB 4.39Å; L57-L298 HydrophobicContact CD1-CD2 4.28Å; L57-L298 HydrophobicContact CD1-CG 4.12Å; L57-L298 HydrophobicContact CD2-CD2 3.91Å; L57-L298 HydrophobicContact CD2-CG 4.43Å; A294-L298 WeakPolarHBondContact O-CB 3.21Å; A294-L298 PolarHBondContact O-N 2.95Å; I295-L298 PolarHBondContact O-N 3.09Å; L296-L298 VanDerWaalsContact C-N 3.34Å; L296-L298 PolarHBondContact O-N 3.27Å; L298-S301 WeakPolarHBondContact O-CB 3.32Å; L298-S301 PolarHBondContact O-N 3.3Å; L298-I302 HydrophobicContact CD1-CD1 4.16Å; L298-I302 HydrophobicContact CG-CD1 4.11Å; L298-I302 WeakPolarHBondContact O-CG1 3.38Å; L298-I302 PolarHBondContact O-N 3.2Å |
| 299 | G | 94.9 | Very high | 94.5 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -62.9 | -46.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | I295 L296 S301 I302 V303 | I295-G299 PolarHBondContact O-N 3.42Å; L296-G299 PolarHBondContact O-N 3.34Å; G299-S301 VanDerWaalsContact C-N 3.3Å; G299-S301 PolarHBondContact O-N 2.91Å; G299-I302 PolarHBondContact O-N 3.23Å; G299-V303 VanDerWaalsContact O-CG2 3.29Å; G299-V303 WeakPolarHBondContact O-CG2 3.36Å; G299-V303 PolarHBondContact O-N 3.36Å |
| 300 | M | 95.7 | Very high | 94.9 | Very high | 2 Ų | 2 | 45.5 Ų | 45.5 | 1% | 0.01 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -66.9 | -31.1 | 176.7 | -65.1 | -52.3 | -67 | 0 | 0 | 112.5 | C96 M99 F273 L296 T304 | C96-M300 HydrophobicContact CB-CB 3.95Å; C96-M300 HydrophobicContact CB-CG 4.2Å; M99-M300 HydrophobicContact CE-CE 3.75Å; M99-M300 HydrophobicContact CE-SD 4.19Å; M99-M300 HydrophobicContact SD-CE 4.05Å; M99-M300 HydrophobicContact SD-CG 4.23Å; M99-M300 HydrophobicContact SD-SD 3.86Å; F273-M300 HydrophobicContact CD1-CE 3.9Å; L296-M300 HydrophobicContact CD1-CG 4.04Å; L296-M300 WeakPolarHBondContact O-CB 3.35Å; L296-M300 VanDerWaalsContact O-CG 3.32Å; L296-M300 WeakPolarHBondContact O-CG 3.36Å; L296-M300 PolarHBondContact O-N 2.94Å; M300-T304 VanDerWaalsContact O-CB 3.26Å; M300-T304 WeakPolarHBondContact O-CB 3.4Å; M300-T304 PolarHBondContact O-N 3.19Å; M300-T304 PolarHBondContact O-OG1 2.98Å |
| 301 | S | 96.9 | Very high | 95.4 | Very high | 67 Ų | 67 | 34.2 Ų | 34.2 | 47% | 0.469 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -65.3 | -43.4 | 172.2 | -59.4 | 0 | 0 | 0 | 0 | 111.8 | S297 L298 G299 S305 | S297-S301 VanDerWaalsContact O-CB 3.31Å; S297-S301 WeakPolarHBondContact O-CB 3.21Å; S297-S301 PolarHBondContact O-N 3.01Å; S297-S301 PolarHBondContact O-OG 3.43Å; L298-S301 WeakPolarHBondContact O-CB 3.32Å; L298-S301 PolarHBondContact O-N 3.3Å; G299-S301 VanDerWaalsContact C-N 3.3Å; G299-S301 PolarHBondContact O-N 2.91Å; S301-S305 WeakPolarHBondContact O-CB 3.33Å; S301-S305 PolarHBondContact O-N 3.26Å; S301-S305 PolarHBondContact O-OG 3.26Å |
| 302 | I | 95.9 | Very high | 95.7 | Very high | 73 Ų | 73 | 30.5 Ų | 30.5 | 37% | 0.374 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -62.7 | -48.7 | 175.1 | -67.9 | 163.8 | 0 | 0 | 0 | 110.6 | L57 V61 L298 G299 S305 L306 | L57-I302 HydrophobicContact CD1-CD1 4.44Å; V61-I302 HydrophobicContact CG2-CG2 4.33Å; L298-I302 HydrophobicContact CD1-CD1 4.16Å; L298-I302 HydrophobicContact CG-CD1 4.11Å; L298-I302 WeakPolarHBondContact O-CG1 3.38Å; L298-I302 PolarHBondContact O-N 3.2Å; G299-I302 PolarHBondContact O-N 3.23Å; I302-S305 PolarHBondContact O-N 2.93Å; I302-L306 WeakPolarHBondContact O-CB 3.34Å; I302-L306 PolarHBondContact O-N 3.5Å |
| 303 | V | 95.4 | Very high | 95.8 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.2 | -48.4 | 178.1 | 169.5 | 0 | 0 | 0 | 0 | 111.1 | V61 N64 F273 G299 S305 L306 Y307 | V61-V303 HydrophobicContact CG1-CG2 4.45Å; V61-V303 HydrophobicContact CG2-CG2 4.37Å; N64-V303 HydrophobicContact CB-CB 4.4Å; N64-V303 HydrophobicContact CB-CG1 3.73Å; N64-V303 HydrophobicContact CB-CG2 3.7Å; F273-V303 HydrophobicContact CD1-CG1 4.38Å; F273-V303 HydrophobicContact CE1-CG1 4.23Å; G299-V303 VanDerWaalsContact O-CG2 3.29Å; G299-V303 WeakPolarHBondContact O-CG2 3.36Å; G299-V303 PolarHBondContact O-N 3.36Å; V303-S305 VanDerWaalsContact C-N 3.35Å; V303-S305 PolarHBondContact O-N 2.96Å; V303-L306 PolarHBondContact O-N 3.34Å; V303-Y307 HydrophobicContact CG1-CD1 4.2Å; V303-Y307 HydrophobicContact CG1-CD2 3.97Å; V303-Y307 HydrophobicContact CG1-CE1 3.8Å; V303-Y307 HydrophobicContact CG1-CE2 3.53Å; V303-Y307 HydrophobicContact CG1-CG 4.28Å; V303-Y307 VanDerWaalsContact CG1-CZ 3.45Å; V303-Y307 WeakPolarHBondContact O-CB 3.3Å; V303-Y307 WeakPolarHBondContact O-CD1 3.5Å; V303-Y307 VanDerWaalsContact O-CG 3.25Å; V303-Y307 PolarHBondContact O-N 3.47Å |
| 304 | T | 96.9 | Very high | 95.8 | Very high | 9 Ų | 9 | 30.9 Ų | 30.9 | 6% | 0.055 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.2 | -43 | 179.1 | -56.2 | 0 | 0 | 0 | 0 | 111.5 | L89 F273 M300 L306 Y307 I308 | L89-T304 HydrophobicContact CD1-CG2 4.12Å; F273-T304 WeakPolarHBondContact CE1-OG1 3.21Å; F273-T304 HydrophobicContact CZ-CG2 4.19Å; M300-T304 VanDerWaalsContact O-CB 3.26Å; M300-T304 WeakPolarHBondContact O-CB 3.4Å; M300-T304 PolarHBondContact O-N 3.19Å; M300-T304 PolarHBondContact O-OG1 2.98Å; T304-L306 PolarHBondContact O-N 3.39Å; T304-Y307 PolarHBondContact O-N 3.41Å; T304-I308 HydrophobicContact CG2-CD1 3.8Å; T304-I308 HydrophobicContact CG2-CG1 4.49Å; T304-I308 WeakPolarHBondContact O-CB 3.32Å; T304-I308 VanDerWaalsContact O-CG1 3.3Å; T304-I308 WeakPolarHBondContact O-CG1 3.44Å; T304-I308 PolarHBondContact O-N 3.17Å |
| 305 | S | 96.8 | Very high | 95.8 | Very high | 75 Ų | 75 | 27.6 Ų | 27.6 | 52% | 0.524 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -64.5 | -40.2 | 177.7 | -55.8 | 0 | 0 | 0 | 0 | 112 | S301 I302 V303 S309 | S301-S305 WeakPolarHBondContact O-CB 3.33Å; S301-S305 PolarHBondContact O-N 3.26Å; S301-S305 PolarHBondContact O-OG 3.26Å; I302-S305 PolarHBondContact O-N 2.93Å; V303-S305 VanDerWaalsContact C-N 3.35Å; V303-S305 PolarHBondContact O-N 2.96Å; S305-S309 WeakPolarHBondContact O-CB 3.35Å; S305-S309 PolarHBondContact O-N 3.05Å; S305-S309 PolarHBondContact O-OG 2.59Å |
| 306 | L | 95.3 | Very high | 95.8 | Very high | 41 Ų | 41 | 28.4 Ų | 28.4 | 22% | 0.215 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -67.4 | -39.6 | 176.1 | -175.8 | 65 | 0 | 0 | 0 | 112 | M65 I69 L236 I302 V303 T304 S309 I310 | M65-L306 HydrophobicContact CE-CD2 3.74Å; M65-L306 HydrophobicContact CG-CD2 4.38Å; M65-L306 HydrophobicContact SD-CD2 4.04Å; I69-L306 HydrophobicContact CD1-CD1 4.46Å; I69-L306 HydrophobicContact CD1-CD2 3.7Å; I69-L306 HydrophobicContact CD1-CG 3.67Å; L236-L306 HydrophobicContact CD2-CD1 4.23Å; L236-L306 HydrophobicContact CD2-CD2 3.99Å; L236-L306 HydrophobicContact CD2-CG 4.46Å; I302-L306 WeakPolarHBondContact O-CB 3.34Å; I302-L306 PolarHBondContact O-N 3.5Å; V303-L306 PolarHBondContact O-N 3.34Å; T304-L306 PolarHBondContact O-N 3.39Å; L306-S309 WeakPolarHBondContact CA-OG 3.49Å; L306-S309 PolarHBondContact O-OG 3.17Å; L306-S309 VanDerWaalsContact O-OG 3.06Å; L306-I310 HydrophobicContact CD1-CG1 3.93Å; L306-I310 HydrophobicContact CG-CG1 4.41Å; L306-I310 WeakPolarHBondContact O-CB 3.34Å; L306-I310 WeakPolarHBondContact O-CG1 3.39Å; L306-I310 PolarHBondContact O-N 3.33Å |
| 307 | Y | 96.5 | Very high | 95.6 | Very high | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -67.3 | -45.3 | 177.6 | -76.8 | 7.4 | 0 | 0 | 0 | 112.6 | N64 I69 L72 S272 F273 V303 T304 G311 | N64-Y307 PolarHBondContact O-OH 2.89Å; I69-Y307 HydrophobicContact CB-CD1 4.23Å; I69-Y307 HydrophobicContact CB-CE1 3.9Å; I69-Y307 HydrophobicContact CD1-CD1 4.01Å; I69-Y307 HydrophobicContact CD1-CE1 4.11Å; I69-Y307 HydrophobicContact CG1-CD1 3.9Å; I69-Y307 HydrophobicContact CG1-CE1 4.04Å; L72-Y307 VanDerWaalsContact CD1-CB 3.42Å; L72-Y307 HydrophobicContact CD1-CD1 3.69Å; L72-Y307 HydrophobicContact CD1-CD2 3.79Å; L72-Y307 HydrophobicContact CD1-CE1 4.38Å; L72-Y307 HydrophobicContact CD1-CE2 4.47Å; L72-Y307 HydrophobicContact CD1-CG 3.35Å; S272-Y307 VanDerWaalsContact O-CE2 3.25Å; S272-Y307 WeakPolarHBondContact O-CE2 2.97Å; S272-Y307 PolarHBondContact O-OH 2.85Å; F273-Y307 AromaticContact CD1-CD2 3.94Å; F273-Y307 HydrophobicContact CD1-CD2 3.94Å; F273-Y307 AromaticContact CD1-CE2 3.78Å; F273-Y307 HydrophobicContact CD1-CE2 3.78Å; F273-Y307 HydrophobicContact CD2-CD2 4.44Å; F273-Y307 AromaticContact CE1-CD2 3.51Å; F273-Y307 HydrophobicContact CE1-CD2 3.51Å; F273-Y307 AromaticContact CE1-CE2 3.83Å; F273-Y307 HydrophobicContact CE1-CE2 3.83Å; F273-Y307 HydrophobicContact CE2-CD2 4.06Å; F273-Y307 HydrophobicContact CG-CD2 4.39Å; F273-Y307 HydrophobicContact CG-CE2 4.19Å; F273-Y307 AromaticContact CZ-CD2 3.58Å; F273-Y307 HydrophobicContact CZ-CD2 3.58Å; F273-Y307 HydrophobicContact CZ-CE2 4.27Å; V303-Y307 HydrophobicContact CG1-CD1 4.2Å; V303-Y307 HydrophobicContact CG1-CD2 3.97Å; V303-Y307 HydrophobicContact CG1-CE1 3.8Å; V303-Y307 HydrophobicContact CG1-CE2 3.53Å; V303-Y307 HydrophobicContact CG1-CG 4.28Å; V303-Y307 VanDerWaalsContact CG1-CZ 3.45Å; V303-Y307 WeakPolarHBondContact O-CB 3.3Å; V303-Y307 WeakPolarHBondContact O-CD1 3.5Å; V303-Y307 VanDerWaalsContact O-CG 3.25Å; V303-Y307 PolarHBondContact O-N 3.47Å; T304-Y307 PolarHBondContact O-N 3.41Å; Y307-G311 WeakPolarHBondContact O-CA 3.32Å; Y307-G311 PolarHBondContact O-N 3.2Å |
| 308 | I | 97.6 | Very high | 95.4 | Very high | 40 Ų | 40 | 29.5 Ų | 29.5 | 21% | 0.205 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -62.3 | -47.4 | 175.6 | -70.3 | 167.2 | 0 | 0 | 0 | 110.1 | P85 L88 L89 T304 T312 | P85-I308 HydrophobicContact CB-CG2 3.93Å; L88-I308 HydrophobicContact CB-CG1 3.79Å; L88-I308 HydrophobicContact CD1-CG1 4.47Å; L89-I308 HydrophobicContact CB-CD1 3.8Å; L89-I308 HydrophobicContact CD1-CD1 4.18Å; T304-I308 HydrophobicContact CG2-CD1 3.8Å; T304-I308 HydrophobicContact CG2-CG1 4.49Å; T304-I308 WeakPolarHBondContact O-CB 3.32Å; T304-I308 VanDerWaalsContact O-CG1 3.3Å; T304-I308 WeakPolarHBondContact O-CG1 3.44Å; T304-I308 PolarHBondContact O-N 3.17Å; I308-T312 WeakPolarHBondContact O-CB 3.37Å; I308-T312 PolarHBondContact O-N 3.48Å; I308-T312 PolarHBondContact O-OG1 2.96Å |
| 309 | S | 95.9 | Very high | 95.1 | Very high | 47 Ų | 47 | 25.5 Ų | 25.5 | 33% | 0.329 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -65.2 | -55 | -178.5 | 51.3 | 0 | 0 | 0 | 0 | 112.5 | S305 L306 L313 | S305-S309 WeakPolarHBondContact O-CB 3.35Å; S305-S309 PolarHBondContact O-N 3.05Å; S305-S309 PolarHBondContact O-OG 2.59Å; L306-S309 WeakPolarHBondContact CA-OG 3.49Å; L306-S309 PolarHBondContact O-OG 3.17Å; L306-S309 VanDerWaalsContact O-OG 3.06Å; S309-L313 WeakPolarHBondContact O-CB 3.42Å; S309-L313 WeakPolarHBondContact O-CD1 3.46Å; S309-L313 WeakPolarHBondContact O-CG 3.28Å; S309-L313 PolarHBondContact O-N 3.47Å |
| 310 | I | 95.4 | Very high | 94.8 | Very high | 4 Ų | 4 | 30.7 Ų | 30.7 | 2% | 0.021 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.8 | -44.4 | -179.7 | -62.7 | -62.1 | 0 | 0 | 0 | 111.4 | I69 S73 L236 A240 I243 L306 G314 I326 | I69-I310 HydrophobicContact CD1-CB 4.48Å; I69-I310 HydrophobicContact CD1-CG1 4.23Å; I69-I310 HydrophobicContact CG1-CB 4.32Å; I69-I310 HydrophobicContact CG1-CG2 4.17Å; S73-I310 PolarHBondContact OG-O 2.69Å; S73-I310 VanDerWaalsContact OG-O 3.09Å; L236-I310 HydrophobicContact CD1-CD1 4.44Å; L236-I310 HydrophobicContact CD1-CG1 4.44Å; A240-I310 HydrophobicContact CB-CD1 3.76Å; I243-I310 HydrophobicContact CD1-CD1 4.05Å; L306-I310 HydrophobicContact CD1-CG1 3.93Å; L306-I310 HydrophobicContact CG-CG1 4.41Å; L306-I310 WeakPolarHBondContact O-CB 3.34Å; L306-I310 WeakPolarHBondContact O-CG1 3.39Å; L306-I310 PolarHBondContact O-N 3.33Å; I310-G314 PolarHBondContact O-N 3.15Å; I310-I326 HydrophobicContact CG2-CD1 3.47Å; I310-I326 VanDerWaalsContact CG2-CD1 3.47Å |
| 311 | G | 96.2 | Very high | 94.6 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -57.5 | -53.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | S73 Y307 Y315 | S73-G311 WeakPolarHBondContact CA-O 3.47Å; S73-G311 WeakPolarHBondContact CB-O 3.2Å; S73-G311 PolarHBondContact OG-O 3.19Å; Y307-G311 WeakPolarHBondContact O-CA 3.32Å; Y307-G311 PolarHBondContact O-N 3.2Å; G311-Y315 PolarHBondContact O-N 2.83Å; G311-Y315 VanDerWaalsContact O-N 3.15Å |
| 312 | T | 95.8 | Very high | 94.4 | Very high | 25 Ų | 25 | 34.3 Ų | 34.3 | 15% | 0.153 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -67.5 | -48.5 | -177.4 | -48.6 | 0 | 0 | 0 | 0 | 112 | I81 I308 G314 Y315 L316 | I81-T312 HydrophobicContact CD1-CG2 3.61Å; I308-T312 WeakPolarHBondContact O-CB 3.37Å; I308-T312 PolarHBondContact O-N 3.48Å; I308-T312 PolarHBondContact O-OG1 2.96Å; T312-G314 VanDerWaalsContact C-N 3.34Å; T312-G314 PolarHBondContact O-N 3.08Å; T312-Y315 PolarHBondContact O-N 3.27Å; T312-L316 HydrophobicContact CG2-CD1 4.21Å; T312-L316 WeakPolarHBondContact O-CG 3.49Å; T312-L316 PolarHBondContact O-N 3.23Å |
| 313 | L | 95.1 | Very high | 94.2 | Very high | 45 Ų | 45 | 35.5 Ų | 35.5 | 24% | 0.236 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.1 | -37.8 | -179.2 | -69.3 | 169.2 | 0 | 0 | 0 | 112.2 | I243 T244 I247 S309 L316 R317 | I243-L313 HydrophobicContact CD1-CB 3.75Å; I243-L313 HydrophobicContact CG1-CB 4.03Å; T244-L313 HydrophobicContact CG2-CD1 3.96Å; I247-L313 HydrophobicContact CD1-CD2 3.92Å; S309-L313 WeakPolarHBondContact O-CB 3.42Å; S309-L313 WeakPolarHBondContact O-CD1 3.46Å; S309-L313 WeakPolarHBondContact O-CG 3.28Å; S309-L313 PolarHBondContact O-N 3.47Å; L313-L316 HydrophobicContact CD2-CD1 4.4Å; L313-L316 PolarHBondContact O-N 2.93Å; L313-R317 WeakPolarHBondContact O-CB 3.49Å; L313-R317 PolarHBondContact O-N 3.16Å |
| 314 | G | 94.6 | Very high | 94 | Very high | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -67.7 | -37.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | S73 I310 T312 R317 F318 | S73-G314 VanDerWaalsContact OG-CA 3.3Å; S73-G314 WeakPolarHBondContact OG-CA 3.39Å; I310-G314 PolarHBondContact O-N 3.15Å; T312-G314 VanDerWaalsContact C-N 3.34Å; T312-G314 PolarHBondContact O-N 3.08Å; G314-R317 PolarHBondContact O-N 3.18Å; G314-F318 VanDerWaalsContact O-CD2 3.27Å; G314-F318 WeakPolarHBondContact O-CD2 3.41Å; G314-F318 PolarHBondContact O-N 3.43Å; G314-F318 VanDerWaalsContact O-N 3.12Å |
| 315 | Y | 94.9 | Very high | 93.8 | Very high | 1 Ų | 1 | 35.9 Ų | 35.9 | 0% | 0.004 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -68.4 | -39.3 | 172.8 | -177.8 | -136.5 | 0 | 0 | 0 | 111.9 | V76 K77 I81 L253 P254 G311 T312 R317 G319 I322 | V76-Y315 HydrophobicContact CG1-CD1 3.82Å; V76-Y315 HydrophobicContact CG1-CG 4.32Å; K77-Y315 HydrophobicContact CB-CD2 3.59Å; K77-Y315 HydrophobicContact CB-CE2 3.45Å; K77-Y315 VanDerWaalsContact CB-CE2 3.45Å; K77-Y315 HydrophobicContact CB-CG 4.22Å; K77-Y315 HydrophobicContact CD-CE2 4.02Å; K77-Y315 HydrophobicContact CG-CD2 4.18Å; K77-Y315 HydrophobicContact CG-CE2 3.56Å; I81-Y315 HydrophobicContact CB-CD1 4.23Å; I81-Y315 HydrophobicContact CB-CE1 4.09Å; I81-Y315 HydrophobicContact CD1-CD1 3.84Å; L253-Y315 HydrophobicContact CB-CE1 4.46Å; L253-Y315 HydrophobicContact CD1-CE1 4.31Å; L253-Y315 HydrophobicContact CD2-CE2 4.27Å; P254-Y315 WeakPolarHBondContact CD-OH 3.13Å; G311-Y315 PolarHBondContact O-N 2.83Å; G311-Y315 VanDerWaalsContact O-N 3.15Å; T312-Y315 PolarHBondContact O-N 3.27Å; Y315-R317 PolarHBondContact O-N 3.3Å; Y315-G319 WeakPolarHBondContact CD2-O 3.41Å; Y315-G319 VanDerWaalsContact CE2-O 3.32Å; Y315-G319 WeakPolarHBondContact CE2-O 3.42Å; Y315-G319 VanDerWaalsContact O-CA 3.31Å; Y315-G319 WeakPolarHBondContact O-CA 3.3Å; Y315-G319 PolarHBondContact O-N 2.83Å; Y315-I322 HydrophobicContact CD2-CG2 4.46Å |
| 316 | L | 93.8 | Very high | 93.6 | Very high | 27 Ų | 27 | 32.3 Ų | 32.3 | 14% | 0.141 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -59 | -45.7 | 173.8 | -73.3 | 172.7 | 0 | 0 | 0 | 112.1 | I81 I247 P248 P250 L253 T312 L313 | I81-L316 HydrophobicContact CD1-CD1 4.46Å; I81-L316 HydrophobicContact CD1-CD2 3.58Å; I81-L316 HydrophobicContact CD1-CG 3.7Å; I81-L316 HydrophobicContact CG1-CD2 3.93Å; I247-L316 HydrophobicContact CG2-CB 3.97Å; P248-L316 WeakPolarHBondContact CD-O 3.38Å; P248-L316 WeakPolarHBondContact CG-O 3.38Å; P250-L316 HydrophobicContact CB-CD2 3.81Å; L253-L316 HydrophobicContact CD1-CD2 3.98Å; T312-L316 HydrophobicContact CG2-CD1 4.21Å; T312-L316 WeakPolarHBondContact O-CG 3.49Å; T312-L316 PolarHBondContact O-N 3.23Å; L313-L316 HydrophobicContact CD2-CD1 4.4Å; L313-L316 PolarHBondContact O-N 2.93Å |
| 317 | R | 92.1 | Very high | 93.5 | Very high | 43 Ų | 43 | 30.4 Ų | 30.4 | 16% | 0.162 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -69.3 | -41.7 | -177.8 | -178.8 | 57.8 | 166.2 | 151 | -4.6 | 113.4 | I243 Q245 E246 L313 G314 Y315 | I243-R317 HydrophobicContact CB-CB 4.3Å; Q245-R317 WeakPolarHBondContact O-CD 3.4Å; Q245-R317 VanDerWaalsContact O-CZ 3.24Å; Q245-R317 PolarHBondContact O-NE 3.08Å; E246-R317 PolarHBondContact O-NH1 3.46Å; E246-R317 IonicContact OE2-CZ 2.71Å; E246-R317 IonicContact OE2-NH1 2.74Å; E246-R317 PolarHBondContact OE2-NH1 3.06Å; E246-R317 VanDerWaalsContact OE2-NH1 3.17Å; E246-R317 IonicContact OE2-NH2 3.51Å; E246-R317 PolarHBondContact OE2-NH2 3.31Å; L313-R317 WeakPolarHBondContact O-CB 3.49Å; L313-R317 PolarHBondContact O-N 3.16Å; G314-R317 PolarHBondContact O-N 3.18Å; Y315-R317 PolarHBondContact O-N 3.3Å |
| 318 | F | 90.8 | Very high | 93.2 | Very high | 26 Ų | 26 | 30.9 Ų | 30.9 | 11% | 0.114 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -104.2 | -13.3 | -171.4 | -61 | -65.3 | 0 | 0 | 0 | 114.7 | Y242 I243 G314 D320 D321 I322 I326 N329 | Y242-F318 HydrophobicContact CD1-CZ 4.26Å; Y242-F318 HydrophobicContact CE1-CE1 4.17Å; Y242-F318 AromaticContact CE1-CZ 3.82Å; Y242-F318 HydrophobicContact CE1-CZ 3.82Å; I243-F318 HydrophobicContact CG2-CE2 3.81Å; I243-F318 HydrophobicContact CG2-CZ 4.36Å; G314-F318 VanDerWaalsContact O-CD2 3.27Å; G314-F318 WeakPolarHBondContact O-CD2 3.41Å; G314-F318 PolarHBondContact O-N 3.43Å; G314-F318 VanDerWaalsContact O-N 3.12Å; F318-D320 PolarHBondContact O-N 3.01Å; F318-D321 PolarHBondContact O-N 2.84Å; F318-I322 HydrophobicContact CB-CB 4.05Å; F318-I322 HydrophobicContact CB-CD1 4.06Å; F318-I322 HydrophobicContact CD2-CD1 3.67Å; F318-I322 HydrophobicContact CG-CD1 4.2Å; F318-I326 HydrophobicContact CE2-CG2 4.16Å; F318-N329 HydrophobicContact CD1-CB 3.94Å; F318-N329 HydrophobicContact CD2-CB 4.07Å; F318-N329 HydrophobicContact CE1-CB 3.69Å; F318-N329 HydrophobicContact CE2-CB 3.82Å; F318-N329 HydrophobicContact CG-CB 4.13Å; F318-N329 HydrophobicContact CZ-CB 3.62Å |
| 319 | G | 90.8 | Very high | 92.8 | Very high | 11 Ų | 11 | 30 Ų | 30 | 11% | 0.113 | 16% | 0.16 | C | C | . | . | G | 310 helix | trans | 51 | -126.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y315 D321 I322 | Y315-G319 WeakPolarHBondContact CD2-O 3.41Å; Y315-G319 VanDerWaalsContact CE2-O 3.32Å; Y315-G319 WeakPolarHBondContact CE2-O 3.42Å; Y315-G319 VanDerWaalsContact O-CA 3.31Å; Y315-G319 WeakPolarHBondContact O-CA 3.3Å; Y315-G319 PolarHBondContact O-N 2.83Å; G319-D321 VanDerWaalsContact C-N 3.32Å; G319-D321 PolarHBondContact O-N 3.48Å; G319-I322 VanDerWaalsContact O-CG2 3.31Å; G319-I322 WeakPolarHBondContact O-CG2 3.09Å |
| 320 | D | 89.4 | Confident | 92.5 | Very high | 109 Ų | 109 | 28 Ų | 28 | 58% | 0.583 | 15% | 0.146 | S | C | * | . | G | 310 helix | trans | -74 | -17.7 | 179.6 | -72.3 | -46.9 | 0 | 0 | 0 | 114.4 | K77 F318 I322 | K77-D320 VanDerWaalsContact CE-OD1 3.25Å; K77-D320 WeakPolarHBondContact CE-OD1 3.38Å; K77-D320 PolarHBondContact NZ-O 3.25Å; K77-D320 IonicContact NZ-OD1 3.55Å; F318-D320 PolarHBondContact O-N 3.01Å; D320-I322 VanDerWaalsContact C-N 3.25Å; D320-I322 PolarHBondContact O-N 3.38Å |
| 321 | D | 90.1 | Very high | 92.1 | Very high | 135 Ų | 135 | 29.2 Ų | 29.2 | 72% | 0.722 | 15% | 0.154 | S | C | * | . | G | 310 helix | trans | -81.9 | 1.5 | 179.6 | -63.9 | -48.4 | 0 | 0 | 0 | 113.7 | F318 G319 K323 N329 | F318-D321 PolarHBondContact O-N 2.84Å; G319-D321 VanDerWaalsContact C-N 3.32Å; G319-D321 PolarHBondContact O-N 3.48Å; D321-K323 PolarHBondContact O-N 3.07Å; D321-N329 PolarHBondContact O-ND2 3.28Å |
| 322 | I | 92.4 | Very high | 91.3 | Very high | 9 Ų | 9 | 30.9 Ų | 30.9 | 5% | 0.046 | 16% | 0.163 | C | C | . | . | trans | -60.3 | 127 | 174.6 | -169.3 | 70.2 | 0 | 0 | 0 | 111.2 | L74 K77 Y315 F318 G319 D320 I326 | L74-I322 HydrophobicContact CB-CG1 4.46Å; L74-I322 HydrophobicContact CD1-CG2 4.12Å; K77-I322 HydrophobicContact CB-CG2 4.03Å; K77-I322 HydrophobicContact CD-CG2 3.38Å; K77-I322 HydrophobicContact CG-CG2 4.32Å; Y315-I322 HydrophobicContact CD2-CG2 4.46Å; F318-I322 HydrophobicContact CB-CB 4.05Å; F318-I322 HydrophobicContact CB-CD1 4.06Å; F318-I322 HydrophobicContact CD2-CD1 3.67Å; F318-I322 HydrophobicContact CG-CD1 4.2Å; G319-I322 VanDerWaalsContact O-CG2 3.31Å; G319-I322 WeakPolarHBondContact O-CG2 3.09Å; D320-I322 VanDerWaalsContact C-N 3.25Å; D320-I322 PolarHBondContact O-N 3.38Å; I322-I326 HydrophobicContact CD1-CG1 4.25Å | ||
| 323 | K | 92.9 | Very high | 90.8 | Very high | 98 Ų | 98 | 29.7 Ų | 29.7 | 43% | 0.426 | 16% | 0.156 | S | C | . | . | trans | -93.2 | 177.5 | 177.8 | -59.9 | 174.1 | -169.9 | 168.4 | 0 | 110.4 | D321 S325 L328 N329 | D321-K323 PolarHBondContact O-N 3.07Å; K323-S325 PolarHBondContact O-N 3.13Å; K323-L328 HydrophobicContact CB-CB 4.12Å; K323-L328 HydrophobicContact CD-CB 3.85Å; K323-L328 WeakPolarHBondContact CD-O 3.4Å; K323-L328 PolarHBondContact NZ-O 3.2Å; K323-N329 WeakPolarHBondContact CB-OD1 3.33Å; K323-N329 PolarHBondContact N-OD1 3.49Å | ||
| 324 | A | 90.4 | Very high | 90.4 | Very high | 17 Ų | 17 | 34.1 Ų | 34.1 | 14% | 0.14 | 17% | 0.17 | C | C | . | . | S | Bend | trans | -58.5 | -14.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | L74 L400 D401 | L74-A324 HydrophobicContact CD2-CB 4.34Å; A324-L400 HydrophobicContact CB-CB 3.82Å; A324-L400 HydrophobicContact CB-CD2 4.07Å; A324-L400 HydrophobicContact CB-CG 4.21Å; A324-D401 HydrophobicContact CB-CB 3.82Å |
| 325 | S | 93.4 | Very high | 90.2 | Very high | 1 Ų | 1 | 38.2 Ų | 38.2 | 1% | 0.007 | 19% | 0.191 | C | C | . | . | S | Bend | trans | -145.4 | 137.2 | 169.5 | 165.1 | 0 | 0 | 0 | 0 | 109.7 | L70 K323 S327 L328 | L70-S325 WeakPolarHBondContact CB-OG 3.38Å; L70-S325 CarbonylContact O-C 3.38Å; L70-S325 WeakPolarHBondContact O-CA 3.11Å; K323-S325 PolarHBondContact O-N 3.13Å; S325-S327 PolarHBondContact O-N 3.09Å; S325-S327 VanDerWaalsContact O-N 3.12Å; S325-S327 PolarHBondContact OG-N 3.2Å; S325-S327 VanDerWaalsContact OG-N 3.16Å; S325-S327 PolarHBondContact OG-OG 2.81Å; S325-L328 WeakPolarHBondContact O-CB 3.43Å; S325-L328 PolarHBondContact O-N 2.92Å |
| 326 | I | 93.1 | Very high | 90 | Very high | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 19% | 0.193 | C | C | . | . | G | 310 helix | trans | -53.2 | -32.9 | 173.2 | -60.2 | 160.8 | 0 | 0 | 0 | 111.6 | L70 S73 I239 I243 I310 F318 I322 L328 N329 | L70-I326 WeakPolarHBondContact O-CG1 3.37Å; L70-I326 PolarHBondContact O-N 3.02Å; S73-I326 VanDerWaalsContact OG-CD1 3.26Å; S73-I326 WeakPolarHBondContact OG-CD1 3.41Å; I239-I326 HydrophobicContact CG2-CG2 3.51Å; I243-I326 HydrophobicContact CG2-CG2 4.26Å; I310-I326 HydrophobicContact CG2-CD1 3.47Å; I310-I326 VanDerWaalsContact CG2-CD1 3.47Å; F318-I326 HydrophobicContact CE2-CG2 4.16Å; I322-I326 HydrophobicContact CD1-CG1 4.25Å; I326-L328 PolarHBondContact O-N 3.46Å; I326-N329 WeakPolarHBondContact O-CB 3.42Å; I326-N329 PolarHBondContact O-N 2.9Å |
| 327 | S | 91.9 | Very high | 89.9 | Confident | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 19% | 0.188 | C | C | . | . | G | 310 helix | trans | -58.8 | -30.5 | 177.3 | 69.6 | 0 | 0 | 0 | 0 | 112.8 | N169 S325 N329 L330 K340 | N169-S327 PolarHBondContact ND2-OG 3.38Å; N169-S327 VanDerWaalsContact OD1-CB 3.31Å; N169-S327 WeakPolarHBondContact OD1-CB 3.33Å; N169-S327 PolarHBondContact OD1-OG 3.1Å; S325-S327 PolarHBondContact O-N 3.09Å; S325-S327 VanDerWaalsContact O-N 3.12Å; S325-S327 PolarHBondContact OG-N 3.2Å; S325-S327 VanDerWaalsContact OG-N 3.16Å; S325-S327 PolarHBondContact OG-OG 2.81Å; S327-N329 VanDerWaalsContact C-N 3.29Å; S327-N329 PolarHBondContact O-N 3.46Å; S327-L330 PolarHBondContact O-N 3.12Å; S327-K340 WeakPolarHBondContact O-CE 3.14Å |
| 328 | L | 89.8 | Confident | 89.8 | Confident | 10 Ų | 10 | 38.4 Ų | 38.4 | 5% | 0.052 | 20% | 0.199 | C | C | . | . | G | 310 helix | trans | -80 | -10.5 | -179.5 | -58.7 | 176.1 | 0 | 0 | 0 | 113 | D168 Q172 K323 S325 I326 | D168-L328 HydrophobicContact CB-CD1 4.08Å; D168-L328 HydrophobicContact CB-CD2 3.92Å; Q172-L328 HydrophobicContact CG-CD2 4.24Å; Q172-L328 PolarHBondContact NE2-O 3.33Å; Q172-L328 PolarHBondContact OE1-O 3.43Å; K323-L328 HydrophobicContact CB-CB 4.12Å; K323-L328 HydrophobicContact CD-CB 3.85Å; K323-L328 WeakPolarHBondContact CD-O 3.4Å; K323-L328 PolarHBondContact NZ-O 3.2Å; S325-L328 WeakPolarHBondContact O-CB 3.43Å; S325-L328 PolarHBondContact O-N 2.92Å; I326-L328 PolarHBondContact O-N 3.46Å |
| 329 | N | 91 | Very high | 90 | Very high | 22 Ų | 22 | 37.3 Ų | 37.3 | 12% | 0.118 | 19% | 0.194 | C | C | . | . | G | 310 helix | trans | -94.9 | -9.3 | 175.1 | -75.9 | 89.6 | 0 | 0 | 0 | 113.3 | F318 D321 K323 I326 S327 | F318-N329 HydrophobicContact CD1-CB 3.94Å; F318-N329 HydrophobicContact CD2-CB 4.07Å; F318-N329 HydrophobicContact CE1-CB 3.69Å; F318-N329 HydrophobicContact CE2-CB 3.82Å; F318-N329 HydrophobicContact CG-CB 4.13Å; F318-N329 HydrophobicContact CZ-CB 3.62Å; D321-N329 PolarHBondContact O-ND2 3.28Å; K323-N329 WeakPolarHBondContact CB-OD1 3.33Å; K323-N329 PolarHBondContact N-OD1 3.49Å; I326-N329 WeakPolarHBondContact O-CB 3.42Å; I326-N329 PolarHBondContact O-N 2.9Å; S327-N329 VanDerWaalsContact C-N 3.29Å; S327-N329 PolarHBondContact O-N 3.46Å |
| 330 | L | 89 | Confident | 90 | Very high | 4 Ų | 4 | 36.8 Ų | 36.8 | 2% | 0.021 | 19% | 0.188 | C | C | . | . | S | Bend | trans | -70.1 | 138.2 | 179.1 | -59 | 174.2 | 0 | 0 | 0 | 112.1 | I239 Y242 S327 Y336 V339 K340 | I239-L330 HydrophobicContact CD1-CD1 4.29Å; I239-L330 HydrophobicContact CG1-CD1 3.94Å; I239-L330 HydrophobicContact CG1-CD2 4.26Å; Y242-L330 HydrophobicContact CD1-CD2 3.65Å; Y242-L330 HydrophobicContact CE1-CD2 4.19Å; Y242-L330 HydrophobicContact CG-CD2 4.43Å; S327-L330 PolarHBondContact O-N 3.12Å; L330-Y336 HydrophobicContact CB-CG 4.14Å; L330-Y336 HydrophobicContact CD1-CD1 4.24Å; L330-Y336 HydrophobicContact CD1-CG 4.5Å; L330-Y336 HydrophobicContact CD2-CD1 4.21Å; L330-V339 HydrophobicContact CD1-CB 4.45Å; L330-V339 HydrophobicContact CD1-CG1 3.7Å; L330-K340 PolarHBondContact O-NZ 3.43Å; L330-K340 VanDerWaalsContact O-NZ 3.15Å |
| 331 | P | 85.7 | Confident | 90.2 | Very high | 30 Ų | 30 | 35.4 Ų | 35.4 | 20% | 0.195 | 18% | 0.181 | C | C | . | . | trans | -71.9 | 162.2 | -176.9 | 29.4 | -33.8 | 0 | 0 | 0 | 112.6 | Y242 C333 Y336 | Y242-P331 HydrophobicContact CE1-CG 4.43Å; Y242-P331 HydrophobicContact CE2-CG 4.17Å; Y242-P331 WeakPolarHBondContact OH-CD 3.28Å; P331-C333 VanDerWaalsContact C-N 3.28Å; P331-C333 PolarHBondContact O-N 3.1Å; P331-Y336 HydrophobicContact CG-CD2 3.59Å; P331-Y336 HydrophobicContact CG-CE2 3.65Å; P331-Y336 WeakPolarHBondContact O-CB 3.42Å | ||
| 332 | N | 81.2 | Confident | 90.3 | Very high | 35 Ų | 35 | 32.3 Ų | 32.3 | 19% | 0.187 | 16% | 0.164 | C | C | . | . | S | Bend | trans | -84.4 | 57.1 | -168.6 | -66.1 | -31.3 | 0 | 0 | 0 | 113.5 | A176 T180 T181 Q337 | A176-N332 HydrophobicContact CB-CB 4.08Å; T180-N332 WeakPolarHBondContact CA-O 3.12Å; T181-N332 PolarHBondContact N-O 3.32Å; N332-Q337 PolarHBondContact OD1-NE2 3.45Å |
| 333 | C | 85.2 | Confident | 90.3 | Very high | 1 Ų | 1 | 32.1 Ų | 32.1 | 1% | 0.007 | 16% | 0.162 | C | C | . | . | B | Isolated β-bridge | trans | -112.8 | 155.6 | 170 | 81.4 | 0 | 0 | 0 | 0 | 112.3 | T181 C184 P331 L335 Y336 Q337 | T181-C333 VanDerWaalsContact O-CA 3.28Å; T181-C333 WeakPolarHBondContact O-CA 3.49Å; T181-C333 VanDerWaalsContact O-CB 3.23Å; T181-C333 WeakPolarHBondContact O-CB 3.24Å; C184-C333 HydrophobicContact CB-CB 3.91Å; C184-C333 WeakPolarHBondContact CB-SG 3.32Å; C184-C333 WeakPolarHBondContact SG-CB 3.36Å; C184-C333 CovalentContact SG-SG 2.04Å; C184-C333 PolarHBondContact SG-SG 3.03Å; P331-C333 VanDerWaalsContact C-N 3.28Å; P331-C333 PolarHBondContact O-N 3.1Å; C333-L335 PolarHBondContact O-N 3.05Å; C333-L335 VanDerWaalsContact O-N 3.08Å; C333-Y336 PolarHBondContact O-N 3.01Å; C333-Y336 WeakPolarHBondContact SG-CD2 3.33Å; C333-Q337 PolarHBondContact O-N 2.92Å |
| 334 | W | 86.8 | Confident | 90.3 | Very high | 138 Ų | 138 | 28 Ų | 28 | 52% | 0.523 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -53.4 | -33.9 | -172.3 | -77.5 | 103.5 | 0 | 0 | 0 | 115 | T180 S338 | T180-W334 HydrophobicContact CG2-CB 4.49Å; T180-W334 HydrophobicContact CG2-CD2 3.72Å; T180-W334 HydrophobicContact CG2-CE3 4.42Å; T180-W334 HydrophobicContact CG2-CG 3.73Å; T180-W334 HydrophobicContact CG2-CZ2 4.28Å; W334-S338 WeakPolarHBondContact O-CB 3.39Å; W334-S338 PolarHBondContact O-N 3.33Å; W334-S338 PolarHBondContact O-OG 3.3Å |
| 335 | L | 90.3 | Very high | 90.3 | Very high | 85 Ų | 85 | 29.6 Ų | 29.6 | 45% | 0.445 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -60.7 | -49.5 | 175.2 | -179.2 | 65.8 | 0 | 0 | 0 | 111.5 | I238 C333 S338 V339 | I238-L335 HydrophobicContact CD1-CD1 4.39Å; I238-L335 HydrophobicContact CG2-CD2 4.25Å; I238-L335 HydrophobicContact CG2-CG 4.27Å; C333-L335 PolarHBondContact O-N 3.05Å; C333-L335 VanDerWaalsContact O-N 3.08Å; L335-S338 WeakPolarHBondContact O-CB 3.46Å; L335-S338 PolarHBondContact O-N 3.24Å; L335-V339 PolarHBondContact O-N 2.85Å |
| 336 | Y | 90.5 | Very high | 90.2 | Very high | 15 Ų | 15 | 29.6 Ų | 29.6 | 6% | 0.059 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -79.3 | -28.2 | -178 | -57.2 | -53.8 | 0 | 0 | 0 | 113 | C184 I238 Y242 L330 P331 C333 S338 V339 K340 | C184-Y336 HydrophobicContact CB-CE2 4.2Å; I238-Y336 HydrophobicContact CG2-CD1 4.13Å; I238-Y336 HydrophobicContact CG2-CE1 3.84Å; Y242-Y336 HydrophobicContact CD2-CE1 4.47Å; Y242-Y336 HydrophobicContact CD2-CE2 4.24Å; Y242-Y336 AromaticContact CD2-CZ 3.73Å; Y242-Y336 WeakPolarHBondContact CD2-OH 3.36Å; Y242-Y336 HydrophobicContact CE2-CE2 4.39Å; Y242-Y336 HydrophobicContact CG-CE1 4.24Å; Y242-Y336 AromaticContact CG-CZ 3.94Å; L330-Y336 HydrophobicContact CB-CG 4.14Å; L330-Y336 HydrophobicContact CD1-CD1 4.24Å; L330-Y336 HydrophobicContact CD1-CG 4.5Å; L330-Y336 HydrophobicContact CD2-CD1 4.21Å; P331-Y336 HydrophobicContact CG-CD2 3.59Å; P331-Y336 HydrophobicContact CG-CE2 3.65Å; P331-Y336 WeakPolarHBondContact O-CB 3.42Å; C333-Y336 PolarHBondContact O-N 3.01Å; C333-Y336 WeakPolarHBondContact SG-CD2 3.33Å; Y336-S338 VanDerWaalsContact C-N 3.3Å; Y336-V339 WeakPolarHBondContact O-CB 3.22Å; Y336-V339 PolarHBondContact O-N 3.33Å; Y336-K340 WeakPolarHBondContact O-CG 3.37Å; Y336-K340 PolarHBondContact O-N 3.03Å |
| 337 | Q | 90.4 | Very high | 90.1 | Very high | 5 Ų | 5 | 29.6 Ų | 29.6 | 2% | 0.023 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -63.7 | -38.9 | 167.7 | -61.1 | -59.5 | 0.7 | 0 | 0 | 111.1 | T180 N332 C333 V339 K340 L341 | T180-Q337 HydrophobicContact CG2-CG 4.05Å; N332-Q337 PolarHBondContact OD1-NE2 3.45Å; C333-Q337 PolarHBondContact O-N 2.92Å; Q337-V339 PolarHBondContact O-N 3.48Å; Q337-K340 PolarHBondContact O-N 2.93Å; Q337-L341 WeakPolarHBondContact O-CG 3.34Å; Q337-L341 PolarHBondContact O-N 2.75Å |
| 338 | S | 91.8 | Very high | 90.1 | Very high | 56 Ų | 56 | 31.4 Ų | 31.4 | 39% | 0.392 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -62.4 | -41.4 | 172.2 | -57.3 | 0 | 0 | 0 | 0 | 111.6 | W334 L335 Y336 L341 L342 | W334-S338 WeakPolarHBondContact O-CB 3.39Å; W334-S338 PolarHBondContact O-N 3.33Å; W334-S338 PolarHBondContact O-OG 3.3Å; L335-S338 WeakPolarHBondContact O-CB 3.46Å; L335-S338 PolarHBondContact O-N 3.24Å; Y336-S338 VanDerWaalsContact C-N 3.3Å; S338-L341 PolarHBondContact O-N 3.12Å; S338-L342 WeakPolarHBondContact O-CB 3.38Å; S338-L342 VanDerWaalsContact O-CG 3.27Å; S338-L342 WeakPolarHBondContact O-CG 3.49Å; S338-L342 PolarHBondContact O-N 2.85Å |
| 339 | V | 93.2 | Very high | 90 | Very high | 2 Ų | 2 | 32.1 Ų | 32.1 | 1% | 0.012 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -58 | -47.2 | 172.1 | 160.9 | 0 | 0 | 0 | 0 | 111.9 | I238 I239 L330 L335 Y336 Q337 L341 L342 Y343 | I238-V339 HydrophobicContact CB-CG2 4Å; I238-V339 HydrophobicContact CD1-CG2 3.88Å; I238-V339 HydrophobicContact CG2-CG2 3.8Å; I239-V339 HydrophobicContact CD1-CG1 4Å; I239-V339 HydrophobicContact CG1-CG1 4.03Å; L330-V339 HydrophobicContact CD1-CB 4.45Å; L330-V339 HydrophobicContact CD1-CG1 3.7Å; L335-V339 PolarHBondContact O-N 2.85Å; Y336-V339 WeakPolarHBondContact O-CB 3.22Å; Y336-V339 PolarHBondContact O-N 3.33Å; Q337-V339 PolarHBondContact O-N 3.48Å; V339-L341 PolarHBondContact O-N 3.16Å; V339-L342 PolarHBondContact O-N 3.17Å; V339-Y343 HydrophobicContact CG1-CD2 4.11Å; V339-Y343 HydrophobicContact CG1-CE2 4.37Å; V339-Y343 WeakPolarHBondContact O-CD2 3.47Å; V339-Y343 PolarHBondContact O-N 2.96Å |
| 340 | K | 92.7 | Very high | 89.9 | Confident | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -59.8 | -45.5 | 176.4 | -67.2 | 176.6 | -161.6 | -175.4 | 0 | 111.1 | V173 S327 L330 Y336 Q337 Y343 I344 | V173-K340 HydrophobicContact CG2-CB 3.71Å; V173-K340 HydrophobicContact CG2-CD 4.19Å; S327-K340 WeakPolarHBondContact O-CE 3.14Å; L330-K340 PolarHBondContact O-NZ 3.43Å; L330-K340 VanDerWaalsContact O-NZ 3.15Å; Y336-K340 WeakPolarHBondContact O-CG 3.37Å; Y336-K340 PolarHBondContact O-N 3.03Å; Q337-K340 PolarHBondContact O-N 2.93Å; K340-Y343 PolarHBondContact O-N 3.18Å; K340-I344 VanDerWaalsContact O-CG1 3.3Å; K340-I344 WeakPolarHBondContact O-CG1 3.16Å; K340-I344 PolarHBondContact O-N 2.67Å |
| 341 | L | 92.9 | Very high | 90 | Very high | 81 Ų | 81 | 31.6 Ų | 31.6 | 42% | 0.424 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -64.7 | -40.8 | 177.5 | -72.8 | 171.9 | 0 | 0 | 0 | 113.5 | V173 Q337 S338 V339 Y343 I344 A345 | V173-L341 HydrophobicContact CG1-CD2 4.13Å; V173-L341 HydrophobicContact CG1-CG 4.32Å; V173-L341 HydrophobicContact CG2-CD2 4.42Å; V173-L341 HydrophobicContact CG2-CG 4.34Å; Q337-L341 WeakPolarHBondContact O-CG 3.34Å; Q337-L341 PolarHBondContact O-N 2.75Å; S338-L341 PolarHBondContact O-N 3.12Å; V339-L341 PolarHBondContact O-N 3.16Å; L341-Y343 VanDerWaalsContact C-N 3.34Å; L341-I344 HydrophobicContact CD2-CD1 4.41Å; L341-I344 PolarHBondContact O-N 3.33Å; L341-A345 PolarHBondContact O-N 3.37Å |
| 342 | L | 92.8 | Very high | 90.1 | Very high | 69 Ų | 69 | 30.6 Ų | 30.6 | 36% | 0.361 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -65.8 | -37.1 | 175.8 | -71.7 | 175.8 | 0 | 0 | 0 | 111.8 | S235 S338 V339 G346 | S235-L342 WeakPolarHBondContact OG-CB 3.23Å; S338-L342 WeakPolarHBondContact O-CB 3.38Å; S338-L342 VanDerWaalsContact O-CG 3.27Å; S338-L342 WeakPolarHBondContact O-CG 3.49Å; S338-L342 PolarHBondContact O-N 2.85Å; V339-L342 PolarHBondContact O-N 3.17Å; L342-G346 PolarHBondContact O-N 2.79Å |
| 343 | Y | 91.9 | Very high | 90.3 | Very high | 5 Ų | 5 | 31.3 Ų | 31.3 | 2% | 0.02 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -66.7 | -40.8 | 170.7 | -94.9 | -72.2 | 0 | 0 | 0 | 112.4 | L70 F165 M232 L236 I239 V339 K340 L341 G346 I347 | L70-Y343 HydrophobicContact CD1-CD1 4.03Å; L70-Y343 HydrophobicContact CD1-CE1 3.76Å; L70-Y343 HydrophobicContact CG-CE1 4.5Å; F165-Y343 HydrophobicContact CZ-CD1 4.36Å; F165-Y343 HydrophobicContact CZ-CG 4.43Å; M232-Y343 HydrophobicContact CB-CD1 4.46Å; M232-Y343 HydrophobicContact CB-CE1 4.1Å; M232-Y343 HydrophobicContact CE-CD1 4.03Å; M232-Y343 HydrophobicContact CE-CE1 3.85Å; M232-Y343 HydrophobicContact CG-CD1 3.87Å; M232-Y343 HydrophobicContact CG-CE1 4Å; M232-Y343 PolarHBondContact O-OH 3.22Å; L236-Y343 WeakPolarHBondContact CB-OH 3.28Å; I239-Y343 HydrophobicContact CD1-CD2 4.5Å; I239-Y343 HydrophobicContact CD1-CE2 3.73Å; V339-Y343 HydrophobicContact CG1-CD2 4.11Å; V339-Y343 HydrophobicContact CG1-CE2 4.37Å; V339-Y343 WeakPolarHBondContact O-CD2 3.47Å; V339-Y343 PolarHBondContact O-N 2.96Å; K340-Y343 PolarHBondContact O-N 3.18Å; L341-Y343 VanDerWaalsContact C-N 3.34Å; Y343-G346 PolarHBondContact O-N 3.35Å; Y343-I347 WeakPolarHBondContact O-CB 3.46Å; Y343-I347 VanDerWaalsContact O-CG1 3.32Å; Y343-I347 WeakPolarHBondContact O-CG1 3.36Å; Y343-I347 PolarHBondContact O-N 3.28Å |
| 344 | I | 92.8 | Very high | 90.4 | Very high | 13 Ų | 13 | 32.9 Ų | 32.9 | 7% | 0.067 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -58.6 | -51.9 | 174.9 | -72.7 | 162.4 | 0 | 0 | 0 | 110.5 | L166 N169 L170 F205 K340 L341 G346 I347 L348 | L166-I344 HydrophobicContact CD2-CB 4.08Å; L166-I344 HydrophobicContact CD2-CG1 4.26Å; L166-I344 HydrophobicContact CD2-CG2 3.79Å; L166-I344 WeakPolarHBondContact CD2-O 3.41Å; N169-I344 HydrophobicContact CB-CD1 3.94Å; N169-I344 HydrophobicContact CB-CG1 3.97Å; L170-I344 HydrophobicContact CB-CD1 4.1Å; F205-I344 HydrophobicContact CE1-CG2 4.41Å; F205-I344 HydrophobicContact CZ-CG2 4.17Å; K340-I344 VanDerWaalsContact O-CG1 3.3Å; K340-I344 WeakPolarHBondContact O-CG1 3.16Å; K340-I344 PolarHBondContact O-N 2.67Å; L341-I344 HydrophobicContact CD2-CD1 4.41Å; L341-I344 PolarHBondContact O-N 3.33Å; I344-G346 VanDerWaalsContact C-N 3.3Å; I344-G346 PolarHBondContact O-N 2.77Å; I344-I347 PolarHBondContact O-N 3.15Å; I344-L348 HydrophobicContact CG2-CD1 4.21Å; I344-L348 WeakPolarHBondContact O-CG 3.49Å; I344-L348 PolarHBondContact O-N 3.49Å |
| 345 | A | 91.1 | Very high | 90.6 | Very high | 50 Ų | 50 | 26.5 Ų | 26.5 | 41% | 0.413 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -60.2 | -40.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L341 C349 | L341-A345 PolarHBondContact O-N 3.37Å; A345-C349 PolarHBondContact O-N 3.45Å; A345-C349 PolarHBondContact O-SG 2.78Å |
| 346 | G | 90.2 | Very high | 90.5 | Very high | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -69.9 | -39.8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | M232 L342 Y343 I344 C349 T350 | M232-G346 VanDerWaalsContact SD-C 3.54Å; L342-G346 PolarHBondContact O-N 2.79Å; Y343-G346 PolarHBondContact O-N 3.35Å; I344-G346 VanDerWaalsContact C-N 3.3Å; I344-G346 PolarHBondContact O-N 2.77Å; G346-C349 PolarHBondContact O-N 3.04Å; G346-T350 WeakPolarHBondContact O-CB 3.12Å; G346-T350 PolarHBondContact O-N 3.34Å; G346-T350 PolarHBondContact O-OG1 3.45Å |
| 347 | I | 91.9 | Very high | 90.4 | Very high | 0 Ų | 0 | 27.3 Ų | 27.3 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -71.6 | -35.9 | 175.6 | -67.5 | -55.5 | 0 | 0 | 0 | 111.2 | T67 Y162 F165 L166 M232 Y343 I344 C349 T350 Y351 | T67-I347 HydrophobicContact CG2-CD1 3.63Å; T67-I347 HydrophobicContact CG2-CG1 4.01Å; Y162-I347 HydrophobicContact CD1-CD1 4.35Å; Y162-I347 HydrophobicContact CD1-CG2 3.74Å; Y162-I347 HydrophobicContact CD2-CG2 4.29Å; Y162-I347 HydrophobicContact CE1-CD1 4.16Å; Y162-I347 HydrophobicContact CE1-CG2 4.49Å; Y162-I347 HydrophobicContact CG-CG2 3.62Å; F165-I347 HydrophobicContact CD1-CB 4.48Å; F165-I347 HydrophobicContact CD1-CG1 4.06Å; F165-I347 HydrophobicContact CD1-CG2 4.39Å; F165-I347 HydrophobicContact CE1-CG1 3.9Å; L166-I347 HydrophobicContact CD1-CG2 4.26Å; L166-I347 HydrophobicContact CD2-CB 4.24Å; L166-I347 HydrophobicContact CD2-CG2 4.18Å; L166-I347 HydrophobicContact CG-CG2 4.01Å; M232-I347 HydrophobicContact CE-CD1 3.57Å; M232-I347 HydrophobicContact CE-CG1 4.34Å; M232-I347 HydrophobicContact SD-CD1 4.24Å; Y343-I347 WeakPolarHBondContact O-CB 3.46Å; Y343-I347 VanDerWaalsContact O-CG1 3.32Å; Y343-I347 WeakPolarHBondContact O-CG1 3.36Å; Y343-I347 PolarHBondContact O-N 3.28Å; I344-I347 PolarHBondContact O-N 3.15Å; I347-C349 PolarHBondContact O-N 3.13Å; I347-T350 PolarHBondContact O-N 3.42Å; I347-T350 VanDerWaalsContact O-N 3.15Å; I347-Y351 WeakPolarHBondContact O-CB 3.45Å; I347-Y351 PolarHBondContact O-N 2.87Å |
| 348 | L | 90.6 | Very high | 90.5 | Very high | 38 Ų | 38 | 27 Ų | 27 | 20% | 0.199 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -56.8 | -50.5 | 169.8 | -75.8 | 167.8 | 0 | 0 | 0 | 111.5 | L166 F205 L209 L212 I344 T350 Y351 | L166-L348 HydrophobicContact CD1-CD2 3.68Å; L166-L348 HydrophobicContact CD1-CG 4.09Å; L166-L348 HydrophobicContact CD2-CD2 4.32Å; L166-L348 HydrophobicContact CD2-CG 3.86Å; F205-L348 HydrophobicContact CD1-CD2 4.28Å; F205-L348 HydrophobicContact CE1-CD1 4.31Å; F205-L348 HydrophobicContact CE1-CD2 4.46Å; L209-L348 HydrophobicContact CD2-CD2 3.69Å; L212-L348 WeakPolarHBondContact CD2-O 3.44Å; I344-L348 HydrophobicContact CG2-CD1 4.21Å; I344-L348 WeakPolarHBondContact O-CG 3.49Å; I344-L348 PolarHBondContact O-N 3.49Å; L348-T350 PolarHBondContact O-N 3.02Å; L348-Y351 WeakPolarHBondContact O-CB 3.37Å; L348-Y351 PolarHBondContact O-N 3.44Å |
| 349 | C | 88.4 | Confident | 90.5 | Very high | 25 Ų | 25 | 24.4 Ų | 24.4 | 17% | 0.169 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -62.6 | -30.4 | 176.8 | -65.9 | 0 | 0 | 0 | 0 | 113.4 | A228 A345 G346 I347 | A228-C349 HydrophobicContact CB-CB 3.84Å; A345-C349 PolarHBondContact O-N 3.45Å; A345-C349 PolarHBondContact O-SG 2.78Å; G346-C349 PolarHBondContact O-N 3.04Å; I347-C349 PolarHBondContact O-N 3.13Å |
| 350 | T | 88.4 | Confident | 90.3 | Very high | 16 Ų | 16 | 29.6 Ų | 29.6 | 10% | 0.098 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -81 | -34.6 | -179.4 | -56.7 | 0 | 0 | 0 | 0 | 112 | Y162 G346 I347 L348 A352 L353 Q354 | Y162-T350 HydrophobicContact CE2-CG2 4.16Å; G346-T350 WeakPolarHBondContact O-CB 3.12Å; G346-T350 PolarHBondContact O-N 3.34Å; G346-T350 PolarHBondContact O-OG1 3.45Å; I347-T350 PolarHBondContact O-N 3.42Å; I347-T350 VanDerWaalsContact O-N 3.15Å; L348-T350 PolarHBondContact O-N 3.02Å; T350-A352 VanDerWaalsContact C-N 3.3Å; T350-A352 PolarHBondContact O-N 3.34Å; T350-L353 PolarHBondContact O-N 2.69Å; T350-L353 VanDerWaalsContact O-N 3.13Å; T350-Q354 PolarHBondContact O-N 3.31Å |
| 351 | Y | 91.2 | Very high | 90.2 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -52 | -48.5 | 173.1 | 178.6 | -80.3 | 0 | 0 | 0 | 111.4 | C159 Y162 I163 L209 V213 I347 L348 L353 Q354 F355 T390 | C159-Y351 HydrophobicContact CB-CD2 4.02Å; C159-Y351 HydrophobicContact CB-CE2 3.45Å; C159-Y351 VanDerWaalsContact CB-CE2 3.45Å; C159-Y351 WeakPolarHBondContact O-CE2 3.23Å; Y162-Y351 HydrophobicContact CD2-CD2 4.15Å; I163-Y351 HydrophobicContact CD1-CE2 3.97Å; I163-Y351 HydrophobicContact CG1-CE2 3.9Å; L209-Y351 HydrophobicContact CB-CE1 4.32Å; L209-Y351 HydrophobicContact CD1-CE2 4.43Å; L209-Y351 HydrophobicContact CD2-CD1 3.8Å; L209-Y351 HydrophobicContact CD2-CD2 4.11Å; L209-Y351 HydrophobicContact CD2-CE1 3.94Å; L209-Y351 HydrophobicContact CD2-CE2 4.23Å; L209-Y351 HydrophobicContact CD2-CG 3.91Å; V213-Y351 HydrophobicContact CG2-CD1 4.32Å; V213-Y351 HydrophobicContact CG2-CE1 3.78Å; I347-Y351 WeakPolarHBondContact O-CB 3.45Å; I347-Y351 PolarHBondContact O-N 2.87Å; L348-Y351 WeakPolarHBondContact O-CB 3.37Å; L348-Y351 PolarHBondContact O-N 3.44Å; Y351-L353 VanDerWaalsContact C-N 3.3Å; Y351-L353 PolarHBondContact O-N 3.27Å; Y351-Q354 PolarHBondContact O-N 2.94Å; Y351-Q354 VanDerWaalsContact O-N 3.17Å; Y351-F355 HydrophobicContact CE1-CB 4.37Å; Y351-F355 HydrophobicContact CE1-CD2 4.29Å; Y351-F355 VanDerWaalsContact O-CB 3.26Å; Y351-F355 WeakPolarHBondContact O-CB 3.48Å; Y351-F355 PolarHBondContact O-N 3.45Å; Y351-T390 PolarHBondContact OH-OG1 3.42Å |
| 352 | A | 87.9 | Confident | 90.2 | Very high | 8 Ų | 8 | 30.5 Ų | 30.5 | 7% | 0.066 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -66 | -30.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | L212 L221 T350 Y356 | L212-A352 HydrophobicContact CD2-CB 3.75Å; L212-A352 HydrophobicContact CG-CB 3.76Å; L221-A352 HydrophobicContact CD1-CB 3.93Å; L221-A352 HydrophobicContact CD2-CB 3.58Å; L221-A352 HydrophobicContact CG-CB 4.34Å; T350-A352 VanDerWaalsContact C-N 3.3Å; T350-A352 PolarHBondContact O-N 3.34Å; A352-Y356 PolarHBondContact O-N 2.77Å |
| 353 | L | 85.1 | Confident | 90.1 | Very high | 51 Ų | 51 | 27.5 Ų | 27.5 | 27% | 0.267 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -72.5 | -41.6 | 171.7 | -66.3 | -175.5 | 0 | 0 | 0 | 111.7 | L221 S225 T350 Y351 Y356 | L221-L353 HydrophobicContact CD2-CD2 3.95Å; L221-L353 HydrophobicContact CG-CD2 4.22Å; S225-L353 WeakPolarHBondContact OG-CD1 3.5Å; T350-L353 PolarHBondContact O-N 2.69Å; T350-L353 VanDerWaalsContact O-N 3.13Å; Y351-L353 VanDerWaalsContact C-N 3.3Å; Y351-L353 PolarHBondContact O-N 3.27Å; L353-Y356 WeakPolarHBondContact O-CB 3.26Å; L353-Y356 PolarHBondContact O-N 3.06Å |
| 354 | Q | 88.4 | Confident | 90.1 | Very high | 34 Ų | 34 | 31 Ų | 31 | 16% | 0.159 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -68.5 | -39.8 | -179.4 | -151.3 | 66.6 | 12.9 | 0 | 0 | 112 | Q155 F158 Y162 T350 Y351 Y356 V357 P358 | Q155-Q354 HydrophobicContact CB-CG 4.33Å; Q155-Q354 VanDerWaalsContact CD-NE2 3.26Å; Q155-Q354 HydrophobicContact CG-CG 4.41Å; F158-Q354 HydrophobicContact CB-CG 3.9Å; F158-Q354 HydrophobicContact CD2-CG 3.85Å; F158-Q354 VanDerWaalsContact CD2-NE2 3.27Å; F158-Q354 HydrophobicContact CG-CG 4.34Å; Y162-Q354 HydrophobicContact CE2-CB 4.18Å; T350-Q354 PolarHBondContact O-N 3.31Å; Y351-Q354 PolarHBondContact O-N 2.94Å; Y351-Q354 VanDerWaalsContact O-N 3.17Å; Q354-Y356 PolarHBondContact O-N 3.49Å; Q354-V357 PolarHBondContact O-N 2.85Å; Q354-P358 WeakPolarHBondContact O-CD 3.45Å |
| 355 | F | 91 | Very high | 89.9 | Confident | 3 Ų | 3 | 36.5 Ų | 36.5 | 1% | 0.013 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -62.7 | -27.2 | 173.5 | -173.1 | -82.3 | 0 | 0 | 0 | 112.8 | V213 Y351 V357 P358 A359 R383 M386 V387 | V213-F355 HydrophobicContact CB-CD1 4.26Å; V213-F355 HydrophobicContact CB-CE1 4.26Å; V213-F355 HydrophobicContact CG1-CD1 3.6Å; V213-F355 HydrophobicContact CG1-CE1 3.19Å; V213-F355 HydrophobicContact CG1-CE2 4.39Å; V213-F355 HydrophobicContact CG1-CG 4.38Å; V213-F355 HydrophobicContact CG1-CZ 3.62Å; V213-F355 HydrophobicContact CG2-CB 4.22Å; V213-F355 HydrophobicContact CG2-CD1 3.65Å; V213-F355 HydrophobicContact CG2-CD2 4.08Å; V213-F355 HydrophobicContact CG2-CE1 4.04Å; V213-F355 HydrophobicContact CG2-CE2 4.4Å; V213-F355 HydrophobicContact CG2-CG 3.69Å; V213-F355 HydrophobicContact CG2-CZ 4.37Å; Y351-F355 HydrophobicContact CE1-CB 4.37Å; Y351-F355 HydrophobicContact CE1-CD2 4.29Å; Y351-F355 VanDerWaalsContact O-CB 3.26Å; Y351-F355 WeakPolarHBondContact O-CB 3.48Å; Y351-F355 PolarHBondContact O-N 3.45Å; F355-V357 VanDerWaalsContact C-N 3.33Å; F355-V357 PolarHBondContact O-N 3.38Å; F355-P358 VanDerWaalsContact O-CD 3.24Å; F355-P358 WeakPolarHBondContact O-CD 3.35Å; F355-P358 VanDerWaalsContact O-CG 3.3Å; F355-P358 WeakPolarHBondContact O-CG 3.38Å; F355-A359 HydrophobicContact CD1-CB 4.33Å; F355-A359 HydrophobicContact CE1-CB 4.1Å; F355-A359 WeakPolarHBondContact O-CB 3.28Å; F355-A359 PolarHBondContact O-N 2.98Å; F355-R383 HydrophobicContact CE1-CB 4.46Å; F355-R383 HydrophobicContact CE1-CG 4.22Å; F355-R383 WeakPolarHBondContact CZ-O 3.32Å; F355-M386 HydrophobicContact CE1-CE 3.88Å; F355-M386 HydrophobicContact CE2-CB 3.63Å; F355-M386 HydrophobicContact CE2-CE 4.37Å; F355-M386 HydrophobicContact CZ-CB 3.68Å; F355-M386 HydrophobicContact CZ-CE 3.54Å; F355-V387 HydrophobicContact CD2-CG2 4.06Å; F355-V387 HydrophobicContact CE2-CB 4.45Å; F355-V387 HydrophobicContact CE2-CG2 3.4Å; F355-V387 VanDerWaalsContact CE2-CG2 3.4Å; F355-V387 HydrophobicContact CZ-CG2 3.71Å |
| 356 | Y | 87.7 | Confident | 89.9 | Confident | 65 Ų | 65 | 35.2 Ų | 35.2 | 26% | 0.255 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -65.5 | -35 | -178.1 | -172.9 | -105.6 | 0 | 0 | 0 | 112.9 | L218 A352 L353 Q354 A359 E360 | L218-Y356 HydrophobicContact CD1-CD1 4.13Å; L218-Y356 HydrophobicContact CD1-CD2 4.19Å; L218-Y356 HydrophobicContact CD1-CE1 3.56Å; L218-Y356 HydrophobicContact CD1-CE2 3.64Å; L218-Y356 HydrophobicContact CD1-CG 4.42Å; L218-Y356 HydrophobicContact CD2-CD1 4.48Å; L218-Y356 HydrophobicContact CD2-CD2 3.65Å; L218-Y356 HydrophobicContact CD2-CE2 3.82Å; L218-Y356 HydrophobicContact CD2-CG 4.02Å; L218-Y356 HydrophobicContact CG-CD2 4.46Å; L218-Y356 HydrophobicContact CG-CE2 4.15Å; A352-Y356 PolarHBondContact O-N 2.77Å; L353-Y356 WeakPolarHBondContact O-CB 3.26Å; L353-Y356 PolarHBondContact O-N 3.06Å; Q354-Y356 PolarHBondContact O-N 3.49Å; Y356-A359 WeakPolarHBondContact O-CB 3.43Å; Y356-A359 PolarHBondContact O-N 3.27Å; Y356-E360 HydrophobicContact CD1-CG 4.06Å; Y356-E360 HydrophobicContact CE1-CG 3.41Å; Y356-E360 VanDerWaalsContact CE1-CG 3.41Å; Y356-E360 WeakPolarHBondContact CE1-OE1 3.5Å; Y356-E360 WeakPolarHBondContact CE1-OE2 3.43Å; Y356-E360 HydrophobicContact CE2-CG 4.13Å; Y356-E360 VanDerWaalsContact CZ-CG 3.4Å; Y356-E360 PolarHBondContact O-N 3Å; Y356-E360 VanDerWaalsContact OH-CD 3.26Å; Y356-E360 WeakPolarHBondContact OH-CG 3.36Å; Y356-E360 PolarHBondContact OH-OE1 3.07Å |
| 357 | V | 88.4 | Confident | 90 | Very high | 52 Ų | 52 | 37.5 Ų | 37.5 | 32% | 0.315 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -61.6 | -55.5 | 179.7 | 177.7 | 0 | 0 | 0 | 0 | 113.1 | Q155 Q354 F355 A359 E360 I361 | Q155-V357 HydrophobicContact CG-CB 3.88Å; Q155-V357 HydrophobicContact CG-CG1 3.94Å; Q354-V357 PolarHBondContact O-N 2.85Å; F355-V357 VanDerWaalsContact C-N 3.33Å; F355-V357 PolarHBondContact O-N 3.38Å; V357-A359 PolarHBondContact O-N 3.37Å; V357-E360 PolarHBondContact O-N 2.68Å; V357-I361 HydrophobicContact CG1-CD1 4.26Å; V357-I361 WeakPolarHBondContact O-CG1 3.3Å; V357-I361 PolarHBondContact O-N 2.91Å |
| 358 | P | 92.3 | Very high | 89.9 | Confident | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -64.5 | -30.8 | 176.3 | 25.3 | -33.3 | 0 | 0 | 0 | 111.7 | I152 Q155 L156 Q354 F355 I361 I362 | I152-P358 HydrophobicContact CB-CB 4.39Å; I152-P358 HydrophobicContact CG1-CB 4.07Å; I152-P358 HydrophobicContact CG2-CB 4.28Å; Q155-P358 HydrophobicContact CB-CB 4.49Å; Q155-P358 HydrophobicContact CB-CG 3.81Å; L156-P358 HydrophobicContact CD2-CB 3.66Å; L156-P358 HydrophobicContact CD2-CG 3.47Å; L156-P358 VanDerWaalsContact CD2-CG 3.47Å; Q354-P358 WeakPolarHBondContact O-CD 3.45Å; F355-P358 VanDerWaalsContact O-CD 3.24Å; F355-P358 WeakPolarHBondContact O-CD 3.35Å; F355-P358 VanDerWaalsContact O-CG 3.3Å; F355-P358 WeakPolarHBondContact O-CG 3.38Å; P358-I361 PolarHBondContact O-N 2.99Å; P358-I362 HydrophobicContact CB-CD1 4.41Å; P358-I362 WeakPolarHBondContact O-CB 3.39Å; P358-I362 WeakPolarHBondContact O-CG1 3.32Å; P358-I362 PolarHBondContact O-N 2.96Å |
| 359 | A | 91.3 | Very high | 89.9 | Confident | 1 Ų | 1 | 49 Ų | 49 | 1% | 0.008 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -63.7 | -42.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | F355 Y356 V357 I361 I363 M386 | F355-A359 HydrophobicContact CD1-CB 4.33Å; F355-A359 HydrophobicContact CE1-CB 4.1Å; F355-A359 WeakPolarHBondContact O-CB 3.28Å; F355-A359 PolarHBondContact O-N 2.98Å; Y356-A359 WeakPolarHBondContact O-CB 3.43Å; Y356-A359 PolarHBondContact O-N 3.27Å; V357-A359 PolarHBondContact O-N 3.37Å; A359-I361 VanDerWaalsContact C-N 3.29Å; A359-I361 PolarHBondContact O-N 3.23Å; A359-I363 HydrophobicContact CB-CD1 3.83Å; A359-I363 WeakPolarHBondContact O-CB 3.47Å; A359-I363 VanDerWaalsContact O-CG1 3.28Å; A359-I363 WeakPolarHBondContact O-CG1 3.27Å; A359-I363 PolarHBondContact O-N 3.24Å; A359-M386 HydrophobicContact CB-CE 4.07Å |
| 360 | E | 88.9 | Confident | 90.1 | Very high | 110 Ų | 110 | 50.7 Ų | 50.7 | 51% | 0.514 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -66.1 | -27.1 | 173.4 | -80.2 | -162.7 | 142.5 | 0 | 0 | 113.6 | Y356 V357 P364 | Y356-E360 HydrophobicContact CD1-CG 4.06Å; Y356-E360 HydrophobicContact CE1-CG 3.41Å; Y356-E360 VanDerWaalsContact CE1-CG 3.41Å; Y356-E360 WeakPolarHBondContact CE1-OE1 3.5Å; Y356-E360 WeakPolarHBondContact CE1-OE2 3.43Å; Y356-E360 HydrophobicContact CE2-CG 4.13Å; Y356-E360 VanDerWaalsContact CZ-CG 3.4Å; Y356-E360 PolarHBondContact O-N 3Å; Y356-E360 VanDerWaalsContact OH-CD 3.26Å; Y356-E360 WeakPolarHBondContact OH-CG 3.36Å; Y356-E360 PolarHBondContact OH-OE1 3.07Å; V357-E360 PolarHBondContact O-N 2.68Å; E360-P364 WeakPolarHBondContact O-CD 3.49Å; E360-P364 VanDerWaalsContact O-CG 3.22Å; E360-P364 WeakPolarHBondContact O-CG 3.31Å |
| 361 | I | 90.3 | Very high | 90.1 | Very high | 52 Ų | 52 | 53.4 Ų | 53.4 | 27% | 0.267 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -80.2 | -47 | 177.4 | -60 | 166.4 | 0 | 0 | 0 | 110.8 | L151 I152 V357 P358 A359 | L151-I361 HydrophobicContact CB-CD1 4.28Å; I152-I361 HydrophobicContact CD1-CB 4.24Å; I152-I361 HydrophobicContact CD1-CG2 3.72Å; I152-I361 HydrophobicContact CG1-CB 4.29Å; I152-I361 HydrophobicContact CG1-CD1 4.14Å; I152-I361 HydrophobicContact CG1-CG2 4.21Å; V357-I361 HydrophobicContact CG1-CD1 4.26Å; V357-I361 WeakPolarHBondContact O-CG1 3.3Å; V357-I361 PolarHBondContact O-N 2.91Å; P358-I361 PolarHBondContact O-N 2.99Å; A359-I361 VanDerWaalsContact C-N 3.29Å; A359-I361 PolarHBondContact O-N 3.23Å |
| 362 | I | 93 | Very high | 90 | Very high | 49 Ų | 49 | 59.9 Ų | 59.9 | 25% | 0.251 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -82 | -44.7 | -170.9 | -64.2 | 164.2 | 0 | 0 | 0 | 112.3 | I152 P358 F365 A366 I382 M386 | I152-I362 HydrophobicContact CD1-CD1 3.91Å; I152-I362 HydrophobicContact CD1-CG1 3.63Å; I152-I362 HydrophobicContact CG1-CD1 4.11Å; I152-I362 HydrophobicContact CG1-CG1 4.2Å; I152-I362 HydrophobicContact CG2-CD1 3.91Å; P358-I362 HydrophobicContact CB-CD1 4.41Å; P358-I362 WeakPolarHBondContact O-CB 3.39Å; P358-I362 WeakPolarHBondContact O-CG1 3.32Å; P358-I362 PolarHBondContact O-N 2.96Å; I362-F365 PolarHBondContact O-N 3.17Å; I362-A366 PolarHBondContact O-N 3.19Å; I362-A366 VanDerWaalsContact O-N 3.09Å; I362-I382 HydrophobicContact CG2-CG2 3.91Å; I362-M386 HydrophobicContact CD1-SD 3.52Å; I362-M386 VanDerWaalsContact CD1-SD 3.52Å |
| 363 | I | 92.2 | Very high | 90.1 | Very high | 6 Ų | 6 | 70.4 Ų | 70.4 | 3% | 0.031 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -67.2 | -46.1 | -168.4 | -63.9 | 173 | 0 | 0 | 0 | 112.4 | A359 F365 A366 I367 D379 I382 R383 | A359-I363 HydrophobicContact CB-CD1 3.83Å; A359-I363 WeakPolarHBondContact O-CB 3.47Å; A359-I363 VanDerWaalsContact O-CG1 3.28Å; A359-I363 WeakPolarHBondContact O-CG1 3.27Å; A359-I363 PolarHBondContact O-N 3.24Å; I363-F365 VanDerWaalsContact C-N 3.29Å; I363-F365 PolarHBondContact O-N 3.23Å; I363-A366 PolarHBondContact O-N 2.95Å; I363-I367 HydrophobicContact CG2-CD1 3.43Å; I363-I367 VanDerWaalsContact CG2-CD1 3.43Å; I363-I367 HydrophobicContact CG2-CG1 3.96Å; I363-I367 WeakPolarHBondContact O-CB 3.32Å; I363-I367 WeakPolarHBondContact O-CG1 3.49Å; I363-I367 PolarHBondContact O-N 2.99Å; I363-D379 HydrophobicContact CG2-CB 4.06Å; I363-I382 HydrophobicContact CD1-CG2 4.42Å; I363-I382 HydrophobicContact CG1-CB 4.23Å; I363-I382 HydrophobicContact CG1-CG2 3.72Å; I363-R383 HydrophobicContact CD1-CG 3.82Å |
| 364 | P | 91.1 | Very high | 90.4 | Very high | 77 Ų | 77 | 76.2 Ų | 76.2 | 50% | 0.5 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -62 | -37.3 | 178.6 | -24.7 | 37 | 0 | 0 | 0 | 112.6 | E360 S368 | E360-P364 WeakPolarHBondContact O-CD 3.49Å; E360-P364 VanDerWaalsContact O-CG 3.22Å; E360-P364 WeakPolarHBondContact O-CG 3.31Å; P364-S368 WeakPolarHBondContact O-CB 3.39Å; P364-S368 PolarHBondContact O-N 3.12Å |
| 365 | F | 89.1 | Confident | 90.5 | Very high | 129 Ų | 129 | 75.5 Ų | 75.5 | 57% | 0.566 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -61 | -47.2 | 174.8 | 179.7 | -95.2 | 0 | 0 | 0 | 111.3 | I362 I363 S368 | I362-F365 PolarHBondContact O-N 3.17Å; I363-F365 VanDerWaalsContact C-N 3.29Å; I363-F365 PolarHBondContact O-N 3.23Å; F365-S368 PolarHBondContact O-OG 3.38Å |
| 366 | A | 90.3 | Very high | 90.4 | Very high | 23 Ų | 23 | 80 Ų | 80 | 19% | 0.19 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -67.4 | -44 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | I362 I363 S368 R369 L378 I382 | I362-A366 PolarHBondContact O-N 3.19Å; I362-A366 VanDerWaalsContact O-N 3.09Å; I363-A366 PolarHBondContact O-N 2.95Å; A366-S368 VanDerWaalsContact C-N 3.3Å; A366-S368 PolarHBondContact O-N 3.15Å; A366-R369 PolarHBondContact O-N 3Å; A366-L378 HydrophobicContact CB-CD2 4.06Å; A366-I382 HydrophobicContact CB-CD1 3.36Å |
| 367 | I | 91.8 | Very high | 90.6 | Very high | 49 Ų | 49 | 79.4 Ų | 79.4 | 25% | 0.251 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.6 | -36.2 | 178.4 | -70 | 178.7 | 0 | 0 | 0 | 111.5 | I363 R369 V370 A375 L378 D379 | I363-I367 HydrophobicContact CG2-CD1 3.43Å; I363-I367 VanDerWaalsContact CG2-CD1 3.43Å; I363-I367 HydrophobicContact CG2-CG1 3.96Å; I363-I367 WeakPolarHBondContact O-CB 3.32Å; I363-I367 WeakPolarHBondContact O-CG1 3.49Å; I363-I367 PolarHBondContact O-N 2.99Å; I367-R369 PolarHBondContact O-N 3.38Å; I367-V370 WeakPolarHBondContact O-CG2 3.5Å; I367-V370 PolarHBondContact O-N 2.93Å; I367-V370 VanDerWaalsContact O-N 3.1Å; I367-A375 HydrophobicContact CD1-CB 4.37Å; I367-A375 HydrophobicContact CG1-CB 4.41Å; I367-A375 HydrophobicContact CG2-CB 3.75Å; I367-L378 HydrophobicContact CG1-CD2 4.47Å; I367-D379 HydrophobicContact CD1-CB 4.22Å |
| 368 | S | 91 | Very high | 90.8 | Very high | 86 Ų | 86 | 79.2 Ų | 79.2 | 60% | 0.601 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.9 | -16.6 | 178.4 | 76.2 | 0 | 0 | 0 | 0 | 114.6 | P364 F365 A366 | P364-S368 WeakPolarHBondContact O-CB 3.39Å; P364-S368 PolarHBondContact O-N 3.12Å; F365-S368 PolarHBondContact O-OG 3.38Å; A366-S368 VanDerWaalsContact C-N 3.3Å; A366-S368 PolarHBondContact O-N 3.15Å |
| 369 | R | 90.4 | Very high | 90.8 | Very high | 192 Ų | 192 | 79.7 Ų | 79.7 | 73% | 0.725 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96 | -6 | -179.4 | -58.3 | -64.2 | -174.3 | 154.8 | 1.3 | 113.9 | A366 I367 | A366-R369 PolarHBondContact O-N 3Å; I367-R369 PolarHBondContact O-N 3.38Å |
| 370 | V | 91.6 | Very high | 90.8 | Very high | 62 Ų | 62 | 82.7 Ų | 82.7 | 38% | 0.376 | 42% | 0.418 | S | S | . | . | S | Bend | trans | -125.1 | 160.7 | -175 | -60.9 | 0 | 0 | 0 | 0 | 112.4 | I367 W374 L378 | I367-V370 WeakPolarHBondContact O-CG2 3.5Å; I367-V370 PolarHBondContact O-N 2.93Å; I367-V370 VanDerWaalsContact O-N 3.1Å; V370-W374 HydrophobicContact CB-CB 4.35Å; V370-W374 HydrophobicContact CG2-CB 4.35Å; V370-L378 HydrophobicContact CB-CD2 4.46Å; V370-L378 HydrophobicContact CG1-CD2 3.99Å; V370-L378 HydrophobicContact CG2-CD2 3.6Å |
| 371 | S | 89.9 | Confident | 91 | Very high | 72 Ų | 72 | 80.8 Ų | 80.8 | 50% | 0.503 | 42% | 0.417 | S | S | . | . | trans | -72.9 | 153.3 | 175.9 | 66.5 | 0 | 0 | 0 | 0 | 111.9 | R373 W374 A375 | S371-R373 PolarHBondContact O-N 2.85Å; S371-W374 PolarHBondContact O-N 3.46Å; S371-A375 PolarHBondContact O-N 3.37Å | ||
| 372 | T | 89 | Confident | 91.2 | Very high | 136 Ų | 136 | 79.6 Ų | 79.6 | 83% | 0.834 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -53.2 | -27.4 | -174.8 | -38.8 | 0 | 0 | 0 | 0 | 114.2 | W374 A375 | T372-W374 VanDerWaalsContact C-N 3.32Å; T372-W374 PolarHBondContact O-N 3.01Å; T372-A375 PolarHBondContact O-N 2.92Å |
| 373 | R | 89.6 | Confident | 91.2 | Very high | 229 Ų | 229 | 78.2 Ų | 78.2 | 86% | 0.864 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -64.8 | -33.5 | 176.2 | -65.5 | -175 | 179.9 | -176.4 | 0.2 | 113 | S371 | S371-R373 PolarHBondContact O-N 2.85Å |
| 374 | W | 90.8 | Very high | 91.3 | Very high | 173 Ų | 173 | 81.8 Ų | 81.8 | 66% | 0.655 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -94.4 | -10 | -179.2 | -69 | 103.8 | 0 | 0 | 0 | 113.5 | V370 S371 T372 L376 P377 L378 | V370-W374 HydrophobicContact CB-CB 4.35Å; V370-W374 HydrophobicContact CG2-CB 4.35Å; S371-W374 PolarHBondContact O-N 3.46Å; T372-W374 VanDerWaalsContact C-N 3.32Å; T372-W374 PolarHBondContact O-N 3.01Å; W374-L376 PolarHBondContact O-N 3.31Å; W374-P377 HydrophobicContact CE3-CB 4.36Å; W374-P377 HydrophobicContact CE3-CG 4.5Å; W374-P377 WeakPolarHBondContact O-CD 3.44Å; W374-L378 WeakPolarHBondContact O-CB 3.38Å; W374-L378 PolarHBondContact O-N 3.43Å |
| 375 | A | 89.9 | Confident | 91.5 | Very high | 19 Ų | 19 | 80.9 Ų | 80.9 | 16% | 0.157 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -57.8 | -42.7 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | I367 S371 T372 D379 | I367-A375 HydrophobicContact CD1-CB 4.37Å; I367-A375 HydrophobicContact CG1-CB 4.41Å; I367-A375 HydrophobicContact CG2-CB 3.75Å; S371-A375 PolarHBondContact O-N 3.37Å; T372-A375 PolarHBondContact O-N 2.92Å; A375-D379 PolarHBondContact O-N 3.35Å |
| 376 | L | 89.8 | Confident | 91.8 | Very high | 98 Ų | 98 | 75.4 Ų | 75.4 | 51% | 0.513 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -74.4 | -47.6 | 179.8 | -179.8 | 148 | 0 | 0 | 0 | 112.8 | W374 L378 D379 L380 | W374-L376 PolarHBondContact O-N 3.31Å; L376-L378 VanDerWaalsContact C-N 3.26Å; L376-L378 PolarHBondContact O-N 2.99Å; L376-D379 PolarHBondContact O-N 2.89Å; L376-L380 HydrophobicContact CD2-CD1 3.65Å; L376-L380 HydrophobicContact CG-CD1 4.3Å; L376-L380 VanDerWaalsContact O-CG 3.31Å; L376-L380 WeakPolarHBondContact O-CG 3.28Å; L376-L380 PolarHBondContact O-N 3.5Å |
| 377 | P | 92.2 | Very high | 92.1 | Very high | 52 Ų | 52 | 74.3 Ų | 74.3 | 34% | 0.338 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -53.2 | -43 | 169.5 | -28.9 | 35.2 | 0 | 0 | 0 | 112.8 | W374 L380 S381 | W374-P377 HydrophobicContact CE3-CB 4.36Å; W374-P377 HydrophobicContact CE3-CG 4.5Å; W374-P377 WeakPolarHBondContact O-CD 3.44Å; P377-L380 PolarHBondContact O-N 2.88Å; P377-S381 WeakPolarHBondContact O-CB 3.2Å; P377-S381 PolarHBondContact O-N 3.44Å; P377-S381 PolarHBondContact O-OG 3.02Å |
| 378 | L | 92.8 | Very high | 92.2 | Very high | 49 Ų | 49 | 74.5 Ų | 74.5 | 26% | 0.257 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -67.7 | -42.4 | -179.2 | -173.7 | 62.3 | 0 | 0 | 0 | 113.2 | A366 I367 V370 W374 L376 L380 S381 I382 | A366-L378 HydrophobicContact CB-CD2 4.06Å; I367-L378 HydrophobicContact CG1-CD2 4.47Å; V370-L378 HydrophobicContact CB-CD2 4.46Å; V370-L378 HydrophobicContact CG1-CD2 3.99Å; V370-L378 HydrophobicContact CG2-CD2 3.6Å; W374-L378 WeakPolarHBondContact O-CB 3.38Å; W374-L378 PolarHBondContact O-N 3.43Å; L376-L378 VanDerWaalsContact C-N 3.26Å; L376-L378 PolarHBondContact O-N 2.99Å; L378-L380 VanDerWaalsContact C-N 3.34Å; L378-L380 PolarHBondContact O-N 3.45Å; L378-S381 PolarHBondContact O-N 3Å; L378-I382 HydrophobicContact CD1-CD1 3.84Å; L378-I382 HydrophobicContact CD1-CG1 4.08Å; L378-I382 HydrophobicContact CD2-CD1 4.48Å; L378-I382 HydrophobicContact CG-CD1 3.76Å; L378-I382 HydrophobicContact CG-CG1 4.38Å; L378-I382 WeakPolarHBondContact O-CB 3.38Å; L378-I382 VanDerWaalsContact O-CG1 3.27Å; L378-I382 WeakPolarHBondContact O-CG1 3.47Å; L378-I382 PolarHBondContact O-N 3.24Å |
| 379 | D | 91.4 | Very high | 92.4 | Very high | 10 Ų | 10 | 74.2 Ų | 74.2 | 5% | 0.053 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -53.7 | -51.4 | 172.2 | 174.1 | 102.4 | 0 | 0 | 0 | 110.7 | I363 I367 A375 L376 I382 R383 | I363-D379 HydrophobicContact CG2-CB 4.06Å; I367-D379 HydrophobicContact CD1-CB 4.22Å; A375-D379 PolarHBondContact O-N 3.35Å; L376-D379 PolarHBondContact O-N 2.89Å; D379-I382 PolarHBondContact O-N 3.27Å; D379-R383 WeakPolarHBondContact O-CB 3.48Å; D379-R383 VanDerWaalsContact O-CG 3.28Å; D379-R383 WeakPolarHBondContact O-CG 3.32Å; D379-R383 PolarHBondContact O-N 3.4Å; D379-R383 IonicContact OD1-CZ 3.77Å; D379-R383 IonicContact OD1-NE 3.93Å; D379-R383 PolarHBondContact OD1-NE 2.97Å; D379-R383 IonicContact OD1-NH2 3.27Å; D379-R383 PolarHBondContact OD1-NH2 2.88Å; D379-R383 WeakPolarHBondContact OD2-CD 3.32Å; D379-R383 IonicContact OD2-CZ 2.71Å; D379-R383 IonicContact OD2-NE 3.74Å; D379-R383 PolarHBondContact OD2-NE 3.35Å; D379-R383 IonicContact OD2-NH2 3.7Å |
| 380 | L | 91.7 | Very high | 92.6 | Very high | 63 Ų | 63 | 65 Ų | 65 | 33% | 0.33 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -65.7 | -42.5 | -178.5 | -60.8 | 172 | 0 | 0 | 0 | 111.9 | L214 L376 P377 L378 R383 L384 | L214-L380 HydrophobicContact CD2-CD2 3.65Å; L376-L380 HydrophobicContact CD2-CD1 3.65Å; L376-L380 HydrophobicContact CG-CD1 4.3Å; L376-L380 VanDerWaalsContact O-CG 3.31Å; L376-L380 WeakPolarHBondContact O-CG 3.28Å; L376-L380 PolarHBondContact O-N 3.5Å; P377-L380 PolarHBondContact O-N 2.88Å; L378-L380 VanDerWaalsContact C-N 3.34Å; L378-L380 PolarHBondContact O-N 3.45Å; L380-R383 PolarHBondContact O-N 3.39Å; L380-L384 WeakPolarHBondContact O-CB 3.47Å; L380-L384 PolarHBondContact O-N 3.29Å |
| 381 | S | 93.2 | Very high | 92.7 | Very high | 71 Ų | 71 | 62.3 Ų | 62.3 | 50% | 0.497 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -64.6 | -41.9 | 177.5 | -66.1 | 0 | 0 | 0 | 0 | 112.5 | P377 L378 L384 A385 | P377-S381 WeakPolarHBondContact O-CB 3.2Å; P377-S381 PolarHBondContact O-N 3.44Å; P377-S381 PolarHBondContact O-OG 3.02Å; L378-S381 PolarHBondContact O-N 3Å; S381-L384 PolarHBondContact O-N 2.89Å; S381-A385 VanDerWaalsContact O-CB 3.27Å; S381-A385 WeakPolarHBondContact O-CB 3.26Å; S381-A385 PolarHBondContact O-N 3.44Å |
| 382 | I | 93.9 | Very high | 92.9 | Very high | 26 Ų | 26 | 64.3 Ų | 64.3 | 13% | 0.133 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -66 | -43.4 | 176.7 | -70.5 | 169.6 | 0 | 0 | 0 | 110.5 | I362 I363 A366 L378 D379 L384 A385 M386 | I362-I382 HydrophobicContact CG2-CG2 3.91Å; I363-I382 HydrophobicContact CD1-CG2 4.42Å; I363-I382 HydrophobicContact CG1-CB 4.23Å; I363-I382 HydrophobicContact CG1-CG2 3.72Å; A366-I382 HydrophobicContact CB-CD1 3.36Å; L378-I382 HydrophobicContact CD1-CD1 3.84Å; L378-I382 HydrophobicContact CD1-CG1 4.08Å; L378-I382 HydrophobicContact CD2-CD1 4.48Å; L378-I382 HydrophobicContact CG-CD1 3.76Å; L378-I382 HydrophobicContact CG-CG1 4.38Å; L378-I382 WeakPolarHBondContact O-CB 3.38Å; L378-I382 VanDerWaalsContact O-CG1 3.27Å; L378-I382 WeakPolarHBondContact O-CG1 3.47Å; L378-I382 PolarHBondContact O-N 3.24Å; D379-I382 PolarHBondContact O-N 3.27Å; I382-L384 PolarHBondContact O-N 3.09Å; I382-A385 PolarHBondContact O-N 2.9Å; I382-M386 HydrophobicContact CG2-CE 3.75Å; I382-M386 HydrophobicContact CG2-SD 4.23Å; I382-M386 WeakPolarHBondContact O-CG 3.4Å; I382-M386 PolarHBondContact O-N 3.45Å |
| 383 | R | 94.1 | Very high | 93.1 | Very high | 21 Ų | 21 | 61.3 Ų | 61.3 | 8% | 0.079 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -56.9 | -50.6 | 174.3 | -74.9 | 178.6 | -164 | -73 | -17.7 | 111.6 | V213 F355 I363 D379 L380 M386 V387 | V213-R383 HydrophobicContact CG1-CB 3.83Å; V213-R383 HydrophobicContact CG1-CG 4.1Å; F355-R383 HydrophobicContact CE1-CB 4.46Å; F355-R383 HydrophobicContact CE1-CG 4.22Å; F355-R383 WeakPolarHBondContact CZ-O 3.32Å; I363-R383 HydrophobicContact CD1-CG 3.82Å; D379-R383 WeakPolarHBondContact O-CB 3.48Å; D379-R383 VanDerWaalsContact O-CG 3.28Å; D379-R383 WeakPolarHBondContact O-CG 3.32Å; D379-R383 PolarHBondContact O-N 3.4Å; D379-R383 IonicContact OD1-CZ 3.77Å; D379-R383 IonicContact OD1-NE 3.93Å; D379-R383 PolarHBondContact OD1-NE 2.97Å; D379-R383 IonicContact OD1-NH2 3.27Å; D379-R383 PolarHBondContact OD1-NH2 2.88Å; D379-R383 WeakPolarHBondContact OD2-CD 3.32Å; D379-R383 IonicContact OD2-CZ 2.71Å; D379-R383 IonicContact OD2-NE 3.74Å; D379-R383 PolarHBondContact OD2-NE 3.35Å; D379-R383 IonicContact OD2-NH2 3.7Å; L380-R383 PolarHBondContact O-N 3.39Å; R383-M386 PolarHBondContact O-N 3.46Å; R383-V387 WeakPolarHBondContact O-CG2 3.46Å; R383-V387 PolarHBondContact O-N 3.13Å; R383-V387 VanDerWaalsContact O-N 3.09Å |
| 384 | L | 94.1 | Very high | 93.2 | Very high | 80 Ų | 80 | 50.4 Ų | 50.4 | 42% | 0.419 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60.8 | -46.4 | 178.4 | -178.4 | 60.8 | 0 | 0 | 0 | 111.5 | V210 L380 S381 I382 M386 V387 C388 | V210-L384 HydrophobicContact CB-CD1 4.5Å; V210-L384 HydrophobicContact CG1-CD1 3.91Å; V210-L384 HydrophobicContact CG2-CD1 3.67Å; L380-L384 WeakPolarHBondContact O-CB 3.47Å; L380-L384 PolarHBondContact O-N 3.29Å; S381-L384 PolarHBondContact O-N 2.89Å; I382-L384 PolarHBondContact O-N 3.09Å; L384-M386 VanDerWaalsContact C-N 3.35Å; L384-M386 PolarHBondContact O-N 3.39Å; L384-V387 PolarHBondContact O-N 2.94Å; L384-C388 WeakPolarHBondContact O-CB 3.46Å; L384-C388 PolarHBondContact O-N 3.23Å; L384-C388 PolarHBondContact O-SG 3.49Å |
| 385 | A | 95 | Very high | 93.2 | Very high | 59 Ų | 59 | 43.6 Ų | 43.6 | 49% | 0.488 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -59.2 | -42.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | S381 I382 C388 L389 | S381-A385 VanDerWaalsContact O-CB 3.27Å; S381-A385 WeakPolarHBondContact O-CB 3.26Å; S381-A385 PolarHBondContact O-N 3.44Å; I382-A385 PolarHBondContact O-N 2.9Å; A385-C388 PolarHBondContact O-N 3.08Å; A385-L389 VanDerWaalsContact O-CB 3.3Å; A385-L389 WeakPolarHBondContact O-CB 3.49Å; A385-L389 PolarHBondContact O-N 3.43Å |
| 386 | M | 95.3 | Very high | 93.2 | Very high | 13 Ų | 13 | 48.1 Ų | 48.1 | 6% | 0.064 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -66.9 | -40.9 | 177.1 | -69.7 | -175.3 | -59.1 | 0 | 0 | 112.5 | F355 A359 I362 I382 R383 L384 L389 T390 | F355-M386 HydrophobicContact CE1-CE 3.88Å; F355-M386 HydrophobicContact CE2-CB 3.63Å; F355-M386 HydrophobicContact CE2-CE 4.37Å; F355-M386 HydrophobicContact CZ-CB 3.68Å; F355-M386 HydrophobicContact CZ-CE 3.54Å; A359-M386 HydrophobicContact CB-CE 4.07Å; I362-M386 HydrophobicContact CD1-SD 3.52Å; I362-M386 VanDerWaalsContact CD1-SD 3.52Å; I382-M386 HydrophobicContact CG2-CE 3.75Å; I382-M386 HydrophobicContact CG2-SD 4.23Å; I382-M386 WeakPolarHBondContact O-CG 3.4Å; I382-M386 PolarHBondContact O-N 3.45Å; R383-M386 PolarHBondContact O-N 3.46Å; L384-M386 VanDerWaalsContact C-N 3.35Å; L384-M386 PolarHBondContact O-N 3.39Å; M386-L389 PolarHBondContact O-N 3.23Å; M386-T390 WeakPolarHBondContact O-CG2 3.32Å; M386-T390 PolarHBondContact O-N 2.95Å; M386-T390 PolarHBondContact O-OG1 2.85Å |
| 387 | V | 95.5 | Very high | 93.1 | Very high | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -66.7 | -40.9 | 176.3 | 176.5 | 0 | 0 | 0 | 0 | 111.5 | L206 L209 V210 V213 F355 R383 L384 L389 T390 C391 | L206-V387 HydrophobicContact CD1-CG1 3.77Å; L209-V387 HydrophobicContact CB-CG1 4.15Å; V210-V387 HydrophobicContact CG2-CB 4.37Å; V210-V387 HydrophobicContact CG2-CG1 3.83Å; V213-V387 HydrophobicContact CB-CG2 4Å; V213-V387 HydrophobicContact CG1-CG2 3.89Å; V213-V387 HydrophobicContact CG2-CG2 3.78Å; F355-V387 HydrophobicContact CD2-CG2 4.06Å; F355-V387 HydrophobicContact CE2-CB 4.45Å; F355-V387 HydrophobicContact CE2-CG2 3.4Å; F355-V387 VanDerWaalsContact CE2-CG2 3.4Å; F355-V387 HydrophobicContact CZ-CG2 3.71Å; R383-V387 WeakPolarHBondContact O-CG2 3.46Å; R383-V387 PolarHBondContact O-N 3.13Å; R383-V387 VanDerWaalsContact O-N 3.09Å; L384-V387 PolarHBondContact O-N 2.94Å; V387-L389 VanDerWaalsContact C-N 3.35Å; V387-T390 PolarHBondContact O-N 3Å; V387-T390 PolarHBondContact O-OG1 3.39Å; V387-C391 WeakPolarHBondContact O-CB 3.35Å; V387-C391 PolarHBondContact O-N 3.39Å |
| 388 | C | 94.7 | Very high | 92.9 | Very high | 54 Ų | 54 | 44 Ų | 44 | 37% | 0.365 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -64.1 | -39.6 | 174.4 | -69.8 | 0 | 0 | 0 | 0 | 111.7 | L384 A385 C391 L392 | L384-C388 WeakPolarHBondContact O-CB 3.46Å; L384-C388 PolarHBondContact O-N 3.23Å; L384-C388 PolarHBondContact O-SG 3.49Å; A385-C388 PolarHBondContact O-N 3.08Å; C388-C391 PolarHBondContact O-N 3Å; C388-L392 WeakPolarHBondContact O-CB 3.35Å; C388-L392 PolarHBondContact O-N 3.4Å |
| 389 | L | 95.1 | Very high | 92.7 | Very high | 79 Ų | 79 | 46.9 Ų | 46.9 | 41% | 0.414 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -61.9 | -48.1 | 175.2 | 178.5 | 63.5 | 0 | 0 | 0 | 111.7 | L156 A385 M386 V387 C391 L392 L393 | L156-L389 HydrophobicContact CD1-CD2 4.36Å; A385-L389 VanDerWaalsContact O-CB 3.3Å; A385-L389 WeakPolarHBondContact O-CB 3.49Å; A385-L389 PolarHBondContact O-N 3.43Å; M386-L389 PolarHBondContact O-N 3.23Å; V387-L389 VanDerWaalsContact C-N 3.35Å; L389-C391 VanDerWaalsContact C-N 3.32Å; L389-C391 PolarHBondContact O-N 3.46Å; L389-L392 PolarHBondContact O-N 2.88Å; L389-L393 HydrophobicContact CD1-CD1 4.32Å; L389-L393 HydrophobicContact CD1-CG 4.43Å; L389-L393 HydrophobicContact CG-CD1 4.26Å; L389-L393 WeakPolarHBondContact O-CG 3.15Å; L389-L393 PolarHBondContact O-N 3.16Å |
| 390 | T | 95.3 | Very high | 92.6 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -66.5 | -34.7 | 179.1 | 52.5 | 0 | 0 | 0 | 0 | 112.3 | L156 C159 C160 Y351 M386 V387 A394 | L156-T390 HydrophobicContact CB-CG2 3.94Å; L156-T390 HydrophobicContact CG-CG2 3.79Å; L156-T390 WeakPolarHBondContact O-CG2 3.49Å; C159-T390 HydrophobicContact CB-CG2 3.88Å; C160-T390 PolarHBondContact SG-O 3.07Å; Y351-T390 PolarHBondContact OH-OG1 3.42Å; M386-T390 WeakPolarHBondContact O-CG2 3.32Å; M386-T390 PolarHBondContact O-N 2.95Å; M386-T390 PolarHBondContact O-OG1 2.85Å; V387-T390 PolarHBondContact O-N 3Å; V387-T390 PolarHBondContact O-OG1 3.39Å; T390-A394 WeakPolarHBondContact O-CB 3.35Å; T390-A394 PolarHBondContact O-N 2.79Å |
| 391 | C | 94.4 | Very high | 92.6 | Very high | 4 Ų | 4 | 44.7 Ų | 44.7 | 3% | 0.027 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -67.5 | -43.3 | 173.6 | -172.8 | 0 | 0 | 0 | 0 | 112 | I163 L206 V387 C388 L389 L393 A394 V395 | I163-C391 HydrophobicContact CD1-CB 4.25Å; L206-C391 HydrophobicContact CD1-CB 3.91Å; V387-C391 WeakPolarHBondContact O-CB 3.35Å; V387-C391 PolarHBondContact O-N 3.39Å; C388-C391 PolarHBondContact O-N 3Å; L389-C391 VanDerWaalsContact C-N 3.32Å; L389-C391 PolarHBondContact O-N 3.46Å; C391-L393 PolarHBondContact O-N 3.34Å; C391-A394 PolarHBondContact O-N 3.09Å; C391-V395 WeakPolarHBondContact O-CG2 3.41Å; C391-V395 PolarHBondContact O-N 2.87Å |
| 392 | L | 94.1 | Very high | 92.6 | Very high | 114 Ų | 114 | 41.6 Ų | 41.6 | 60% | 0.597 | 23% | 0.225 | S | C | * | . | H | α-helix | trans | -59.8 | -44.8 | 176.1 | 178 | 62.9 | 0 | 0 | 0 | 111.8 | C388 L389 V395 L396 | C388-L392 WeakPolarHBondContact O-CB 3.35Å; C388-L392 PolarHBondContact O-N 3.4Å; L389-L392 PolarHBondContact O-N 2.88Å; L392-V395 PolarHBondContact O-N 2.96Å; L392-L396 WeakPolarHBondContact O-CB 3.46Å; L392-L396 PolarHBondContact O-N 2.88Å |
| 393 | L | 92.3 | Very high | 92.6 | Very high | 74 Ų | 74 | 40.9 Ų | 40.9 | 39% | 0.387 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -64 | -41.4 | 177 | -69 | 172.4 | 0 | 0 | 0 | 112.1 | L389 C391 L396 I397 | L389-L393 HydrophobicContact CD1-CD1 4.32Å; L389-L393 HydrophobicContact CD1-CG 4.43Å; L389-L393 HydrophobicContact CG-CD1 4.26Å; L389-L393 WeakPolarHBondContact O-CG 3.15Å; L389-L393 PolarHBondContact O-N 3.16Å; C391-L393 PolarHBondContact O-N 3.34Å; L393-L396 PolarHBondContact O-N 2.97Å; L393-I397 PolarHBondContact O-N 2.77Å |
| 394 | A | 92.1 | Very high | 92.6 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -64.4 | -39.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | I163 V164 M202 T390 C391 I397 | I163-A394 HydrophobicContact CB-CB 3.91Å; I163-A394 HydrophobicContact CG2-CB 3.61Å; V164-A394 HydrophobicContact CG2-CB 3.75Å; M202-A394 WeakPolarHBondContact CE-O 3.49Å; M202-A394 VanDerWaalsContact SD-C 3.51Å; M202-A394 HydrophobicContact SD-CB 3.68Å; M202-A394 VanDerWaalsContact SD-O 3.39Å; T390-A394 WeakPolarHBondContact O-CB 3.35Å; T390-A394 PolarHBondContact O-N 2.79Å; C391-A394 PolarHBondContact O-N 3.09Å; A394-I397 CarbonylContact O-C 3.2Å; A394-I397 PolarHBondContact O-N 3.35Å |
| 395 | V | 90.8 | Very high | 92.6 | Very high | 30 Ų | 30 | 36.2 Ų | 36.2 | 18% | 0.182 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -69 | -36.7 | 175.9 | 169.2 | 0 | 0 | 0 | 0 | 111.8 | R199 M202 L203 C391 L392 | R199-V395 HydrophobicContact CB-CG1 4.31Å; R199-V395 HydrophobicContact CG-CG1 4.08Å; R199-V395 PolarHBondContact NE-O 3.41Å; R199-V395 PolarHBondContact NH2-O 2.94Å; M202-V395 HydrophobicContact CB-CG2 4.04Å; M202-V395 HydrophobicContact SD-CG2 4.34Å; L203-V395 HydrophobicContact CG-CG2 4.47Å; C391-V395 WeakPolarHBondContact O-CG2 3.41Å; C391-V395 PolarHBondContact O-N 2.87Å; L392-V395 PolarHBondContact O-N 2.96Å |
| 396 | L | 89.6 | Confident | 92.6 | Very high | 114 Ų | 114 | 35.4 Ų | 35.4 | 60% | 0.597 | 19% | 0.186 | S | C | * | . | H | α-helix | trans | -64.8 | -42.8 | 175.6 | -176.3 | 63.9 | 0 | 0 | 0 | 111.4 | L392 L393 P398 | L392-L396 WeakPolarHBondContact O-CB 3.46Å; L392-L396 PolarHBondContact O-N 2.88Å; L393-L396 PolarHBondContact O-N 2.97Å; L396-P398 VanDerWaalsContact C-CD 3.49Å; L396-P398 VanDerWaalsContact O-CD 3.26Å; L396-P398 WeakPolarHBondContact O-CD 3.27Å |
| 397 | I | 88.3 | Confident | 92.6 | Very high | 24 Ų | 24 | 35.6 Ų | 35.6 | 12% | 0.123 | 19% | 0.188 | C | C | . | . | trans | -118.7 | 78.3 | -178.4 | -48 | 178 | 0 | 0 | 0 | 110.2 | L393 A394 R399 V403 L463 | L393-I397 PolarHBondContact O-N 2.77Å; A394-I397 CarbonylContact O-C 3.2Å; A394-I397 PolarHBondContact O-N 3.35Å; I397-R399 HydrophobicContact CG2-CB 4.29Å; I397-R399 PolarHBondContact O-N 2.84Å; I397-V403 HydrophobicContact CB-CG2 3.91Å; I397-V403 HydrophobicContact CG2-CG2 3.6Å; I397-V403 WeakPolarHBondContact O-CG2 3.45Å; I397-L463 HydrophobicContact CB-CD1 4.44Å; I397-L463 HydrophobicContact CD1-CD1 4.42Å; I397-L463 HydrophobicContact CD1-CD2 3.74Å; I397-L463 HydrophobicContact CG1-CD1 4.07Å; I397-L463 HydrophobicContact CG1-CD2 4.13Å; I397-L463 HydrophobicContact CG2-CD1 3.79Å | ||
| 398 | P | 86.7 | Confident | 92.6 | Very high | 40 Ų | 40 | 35.6 Ų | 35.6 | 26% | 0.26 | 19% | 0.188 | S | C | . | . | trans | -77.3 | 44.5 | 179.6 | 35.8 | -38.7 | 0 | 0 | 0 | 111.9 | M202 L396 | M202-P398 HydrophobicContact CE-CB 3.71Å; L396-P398 VanDerWaalsContact C-CD 3.49Å; L396-P398 VanDerWaalsContact O-CD 3.26Å; L396-P398 WeakPolarHBondContact O-CD 3.27Å | ||
| 399 | R | 89 | Confident | 92.7 | Very high | 108 Ų | 108 | 33 Ų | 33 | 41% | 0.408 | 17% | 0.171 | S | C | . | . | trans | -132 | 91.7 | -176.1 | -80.2 | -67.5 | -62.6 | -100.7 | -2.4 | 109.5 | I397 D401 L402 V403 | I397-R399 HydrophobicContact CG2-CB 4.29Å; I397-R399 PolarHBondContact O-N 2.84Å; R399-D401 IonicContact CZ-OD1 3.85Å; R399-D401 IonicContact CZ-OD2 3.78Å; R399-D401 IonicContact NE-OD1 3.35Å; R399-D401 PolarHBondContact NE-OD1 2.95Å; R399-D401 IonicContact NE-OD2 2.77Å; R399-D401 IonicContact NH2-OD1 3.12Å; R399-D401 IonicContact NH2-OD2 2.88Å; R399-D401 PolarHBondContact NH2-OD2 2.94Å; R399-D401 PolarHBondContact O-N 3.15Å; R399-L402 HydrophobicContact CB-CB 4.02Å; R399-L402 HydrophobicContact CB-CD1 3.94Å; R399-L402 HydrophobicContact CB-CG 4.05Å; R399-L402 HydrophobicContact CG-CD1 4.2Å; R399-L402 PolarHBondContact O-N 3.26Å; R399-L402 VanDerWaalsContact O-N 3.12Å; R399-V403 WeakPolarHBondContact O-CG2 3.31Å; R399-V403 PolarHBondContact O-N 3.26Å | ||
| 400 | L | 89.6 | Confident | 92.6 | Very high | 3 Ų | 3 | 30.9 Ų | 30.9 | 2% | 0.016 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -51.5 | -41.6 | -175 | 178.1 | 66.1 | 0 | 0 | 0 | 112.6 | V161 V164 F165 A324 I404 | V161-L400 HydrophobicContact CG1-CD1 3.8Å; V161-L400 WeakPolarHBondContact O-CD1 3.26Å; V164-L400 HydrophobicContact CB-CD1 4.3Å; V164-L400 HydrophobicContact CG1-CB 3.87Å; V164-L400 HydrophobicContact CG1-CD1 4.43Å; F165-L400 HydrophobicContact CB-CD1 3.97Å; F165-L400 HydrophobicContact CB-CD2 4.48Å; F165-L400 HydrophobicContact CD2-CD2 4.04Å; A324-L400 HydrophobicContact CB-CB 3.82Å; A324-L400 HydrophobicContact CB-CD2 4.07Å; A324-L400 HydrophobicContact CB-CG 4.21Å; L400-I404 HydrophobicContact CD1-CD1 3.9Å; L400-I404 HydrophobicContact CD1-CG1 4.38Å; L400-I404 HydrophobicContact CG-CD1 3.86Å; L400-I404 WeakPolarHBondContact O-CB 3.37Å; L400-I404 WeakPolarHBondContact O-CD1 3.49Å; L400-I404 WeakPolarHBondContact O-CG1 3.15Å; L400-I404 PolarHBondContact O-N 3.35Å |
| 401 | D | 91.9 | Very high | 92.6 | Very high | 25 Ų | 25 | 30.9 Ų | 30.9 | 13% | 0.134 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63.6 | -47 | 178.4 | 57.2 | -38.8 | 0 | 0 | 0 | 113.1 | L74 A324 R399 S405 | L74-D401 HydrophobicContact CD2-CB 3.53Å; A324-D401 HydrophobicContact CB-CB 3.82Å; R399-D401 IonicContact CZ-OD1 3.85Å; R399-D401 IonicContact CZ-OD2 3.78Å; R399-D401 IonicContact NE-OD1 3.35Å; R399-D401 PolarHBondContact NE-OD1 2.95Å; R399-D401 IonicContact NE-OD2 2.77Å; R399-D401 IonicContact NH2-OD1 3.12Å; R399-D401 IonicContact NH2-OD2 2.88Å; R399-D401 PolarHBondContact NH2-OD2 2.94Å; R399-D401 PolarHBondContact O-N 3.15Å; D401-S405 WeakPolarHBondContact O-CB 3.41Å; D401-S405 PolarHBondContact O-N 2.92Å |
| 402 | L | 93 | Very high | 92.6 | Very high | 5 Ų | 5 | 30.7 Ų | 30.7 | 3% | 0.026 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -67.9 | -40.5 | 178.1 | -64.9 | -178.9 | 0 | 0 | 0 | 111.8 | L264 R399 S405 L406 E462 | L264-L402 HydrophobicContact CD2-CD2 4.26Å; R399-L402 HydrophobicContact CB-CB 4.02Å; R399-L402 HydrophobicContact CB-CD1 3.94Å; R399-L402 HydrophobicContact CB-CG 4.05Å; R399-L402 HydrophobicContact CG-CD1 4.2Å; R399-L402 PolarHBondContact O-N 3.26Å; R399-L402 VanDerWaalsContact O-N 3.12Å; L402-S405 PolarHBondContact O-N 3.47Å; L402-L406 VanDerWaalsContact O-CB 3.24Å; L402-L406 WeakPolarHBondContact O-CB 3.45Å; L402-L406 PolarHBondContact O-N 2.95Å; L402-E462 HydrophobicContact CD1-CB 4.49Å; L402-E462 HydrophobicContact CD2-CB 3.96Å |
| 403 | V | 93.4 | Very high | 92.7 | Very high | 12 Ų | 12 | 25.3 Ų | 25.3 | 7% | 0.073 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -66.2 | -43.2 | 178.1 | -177 | 0 | 0 | 0 | 0 | 111 | C160 V161 I397 R399 L406 V407 | C160-V403 HydrophobicContact CB-CG1 4.11Å; V161-V403 HydrophobicContact CG2-CB 4.26Å; V161-V403 HydrophobicContact CG2-CG1 3.65Å; I397-V403 HydrophobicContact CB-CG2 3.91Å; I397-V403 HydrophobicContact CG2-CG2 3.6Å; I397-V403 WeakPolarHBondContact O-CG2 3.45Å; R399-V403 WeakPolarHBondContact O-CG2 3.31Å; R399-V403 PolarHBondContact O-N 3.26Å; V403-L406 PolarHBondContact O-N 3.38Å; V403-V407 HydrophobicContact CG1-CG2 4.37Å; V403-V407 VanDerWaalsContact O-CG2 3.28Å; V403-V407 WeakPolarHBondContact O-CG2 3.47Å; V403-V407 PolarHBondContact O-N 3.26Å |
| 404 | I | 94.3 | Very high | 92.8 | Very high | 2 Ų | 2 | 22 Ų | 22 | 1% | 0.01 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -58.5 | -49.7 | 174.2 | -74.7 | 169.2 | 0 | 0 | 0 | 110.6 | V161 T268 F271 L400 L406 G408 | V161-I404 HydrophobicContact CB-CG1 4.29Å; V161-I404 HydrophobicContact CG1-CD1 3.95Å; V161-I404 HydrophobicContact CG1-CG1 3.54Å; V161-I404 HydrophobicContact CG2-CG1 3.68Å; T268-I404 HydrophobicContact CG2-CG2 3.73Å; F271-I404 HydrophobicContact CB-CG2 4.09Å; F271-I404 HydrophobicContact CD1-CG2 3.78Å; F271-I404 HydrophobicContact CD2-CG2 4.3Å; F271-I404 HydrophobicContact CE1-CG1 4.3Å; F271-I404 HydrophobicContact CE1-CG2 4.3Å; F271-I404 HydrophobicContact CG-CG2 3.81Å; F271-I404 HydrophobicContact CZ-CG1 4.29Å; L400-I404 HydrophobicContact CD1-CD1 3.9Å; L400-I404 HydrophobicContact CD1-CG1 4.38Å; L400-I404 HydrophobicContact CG-CD1 3.86Å; L400-I404 WeakPolarHBondContact O-CB 3.37Å; L400-I404 WeakPolarHBondContact O-CD1 3.49Å; L400-I404 WeakPolarHBondContact O-CG1 3.15Å; L400-I404 PolarHBondContact O-N 3.35Å; I404-L406 PolarHBondContact O-N 3Å; I404-G408 PolarHBondContact O-N 3.17Å |
| 405 | S | 95.3 | Very high | 93 | Very high | 1 Ų | 1 | 22 Ų | 22 | 1% | 0.007 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -60.6 | -46.2 | 179.2 | -179.9 | 0 | 0 | 0 | 0 | 112.3 | L264 G267 D401 L402 G408 S409 | L264-S405 WeakPolarHBondContact CA-OG 3.26Å; G267-S405 WeakPolarHBondContact CA-O 3.3Å; D401-S405 WeakPolarHBondContact O-CB 3.41Å; D401-S405 PolarHBondContact O-N 2.92Å; L402-S405 PolarHBondContact O-N 3.47Å; S405-G408 PolarHBondContact O-N 2.83Å; S405-S409 WeakPolarHBondContact O-CB 3.42Å; S405-S409 PolarHBondContact O-N 3.44Å; S405-S409 PolarHBondContact O-OG 3.4Å; S405-S409 VanDerWaalsContact O-OG 3.11Å |
| 406 | L | 95.1 | Very high | 93.2 | Very high | 42 Ų | 42 | 20.7 Ų | 20.7 | 22% | 0.22 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -65.2 | -43.8 | -177.1 | -177.6 | 65.9 | 0 | 0 | 0 | 112.1 | L402 V403 I404 S409 V410 T456 A459 | L402-L406 VanDerWaalsContact O-CB 3.24Å; L402-L406 WeakPolarHBondContact O-CB 3.45Å; L402-L406 PolarHBondContact O-N 2.95Å; V403-L406 PolarHBondContact O-N 3.38Å; I404-L406 PolarHBondContact O-N 3Å; L406-S409 PolarHBondContact O-OG 3.18Å; L406-V410 HydrophobicContact CD1-CG2 3.87Å; L406-V410 HydrophobicContact CG-CG2 4.4Å; L406-V410 VanDerWaalsContact O-CB 3.31Å; L406-V410 WeakPolarHBondContact O-CB 3.37Å; L406-V410 VanDerWaalsContact O-CG2 3.26Å; L406-V410 WeakPolarHBondContact O-CG2 3.37Å; L406-V410 PolarHBondContact O-N 3.39Å; L406-T456 HydrophobicContact CD1-CG2 4.04Å; L406-A459 HydrophobicContact CB-CB 4.16Å; L406-A459 HydrophobicContact CD1-CB 4.11Å |
| 407 | V | 95.2 | Very high | 93.5 | Very high | 17 Ų | 17 | 15.2 Ų | 15.2 | 10% | 0.103 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -64.8 | -43.7 | 177 | 175.3 | 0 | 0 | 0 | 0 | 110.3 | G157 F158 F271 V403 S411 S412 | G157-V407 VanDerWaalsContact CA-CG2 3.49Å; F158-V407 HydrophobicContact CD1-CG1 3.95Å; F158-V407 HydrophobicContact CE1-CG1 4.03Å; F271-V407 HydrophobicContact CD2-CB 4.04Å; F271-V407 HydrophobicContact CD2-CG1 3.98Å; F271-V407 HydrophobicContact CE2-CB 4.24Å; F271-V407 HydrophobicContact CE2-CG1 4.07Å; V403-V407 HydrophobicContact CG1-CG2 4.37Å; V403-V407 VanDerWaalsContact O-CG2 3.28Å; V403-V407 WeakPolarHBondContact O-CG2 3.47Å; V403-V407 PolarHBondContact O-N 3.26Å; V407-S411 PolarHBondContact O-N 2.04Å; V407-S411 PolarHBondContact O-OG 3.26Å; V407-S412 PolarHBondContact O-N 3.49Å |
| 408 | G | 95 | Very high | 93.9 | Very high | 0 Ų | 0 | 15.3 Ų | 15.3 | 0% | 0 | 8% | 0.079 | C | C | . | . | I | π-helix | trans | -63.1 | -44.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | G267 I270 I404 S405 S412 S413 | G267-G408 WeakPolarHBondContact O-CA 3.37Å; I270-G408 WeakPolarHBondContact CG2-O 3.32Å; I404-G408 PolarHBondContact O-N 3.17Å; S405-G408 PolarHBondContact O-N 2.83Å; G408-S412 WeakPolarHBondContact O-CB 3.27Å; G408-S413 PolarHBondContact O-N 3.35Å |
| 409 | S | 95.9 | Very high | 94.3 | Very high | 0 Ų | 0 | 14.4 Ų | 14.4 | 0% | 0 | 7% | 0.071 | C | C | . | . | I | π-helix | trans | -71.2 | -39 | 178.8 | 65.6 | 0 | 0 | 0 | 0 | 112.3 | S405 L406 S413 F452 T456 | S405-S409 WeakPolarHBondContact O-CB 3.42Å; S405-S409 PolarHBondContact O-N 3.44Å; S405-S409 PolarHBondContact O-OG 3.4Å; S405-S409 VanDerWaalsContact O-OG 3.11Å; L406-S409 PolarHBondContact O-OG 3.18Å; S409-S413 WeakPolarHBondContact O-CB 3.42Å; S409-S413 PolarHBondContact O-OG 3.38Å; S409-F452 VanDerWaalsContact O-CA 3.28Å; S409-F452 WeakPolarHBondContact O-CA 3.48Å; S409-F452 WeakPolarHBondContact O-CD2 3.31Å; S409-T456 PolarHBondContact OG-N 3.3Å |
| 410 | V | 94.5 | Very high | 94.7 | Very high | 34 Ų | 34 | 9.2 Ų | 9.2 | 21% | 0.206 | 5% | 0.052 | C | C | . | . | I | π-helix | trans | -79.9 | -63.1 | -177.7 | 176.1 | 0 | 0 | 0 | 0 | 112.2 | L406 F452 T456 | L406-V410 HydrophobicContact CD1-CG2 3.87Å; L406-V410 HydrophobicContact CG-CG2 4.4Å; L406-V410 VanDerWaalsContact O-CB 3.31Å; L406-V410 WeakPolarHBondContact O-CB 3.37Å; L406-V410 VanDerWaalsContact O-CG2 3.26Å; L406-V410 WeakPolarHBondContact O-CG2 3.37Å; L406-V410 PolarHBondContact O-N 3.39Å; V410-F452 HydrophobicContact CB-CE2 4.33Å; V410-F452 HydrophobicContact CG1-CE2 3.94Å; V410-F452 WeakPolarHBondContact O-CD2 3.41Å; V410-F452 WeakPolarHBondContact O-CE2 3.11Å; V410-T456 HydrophobicContact CG2-CG2 3.8Å; V410-T456 WeakPolarHBondContact CG2-OG1 3.47Å |
| 411 | S | 94.3 | Very high | 95 | Very high | 0 Ų | 0 | 9.1 Ų | 9.1 | 0% | 0 | 5% | 0.051 | C | C | . | . | I | π-helix | trans | -100.1 | -37.7 | -163.8 | 64.2 | 0 | 0 | 0 | 0 | 113.3 | T154 V407 A414 L415 | T154-S411 VanDerWaalsContact CA-OG 3.3Å; T154-S411 WeakPolarHBondContact CA-OG 3.27Å; T154-S411 PolarHBondContact N-OG 2.97Å; T154-S411 WeakPolarHBondContact OG1-CB 3.34Å; T154-S411 PolarHBondContact OG1-OG 3.05Å; V407-S411 PolarHBondContact O-N 2.04Å; V407-S411 PolarHBondContact O-OG 3.26Å; S411-A414 PolarHBondContact O-N 2.85Å; S411-L415 WeakPolarHBondContact O-CG 3.31Å; S411-L415 PolarHBondContact O-N 2.82Å |
| 412 | S | 94.1 | Very high | 95.1 | Very high | 0 Ų | 0 | 12.6 Ų | 12.6 | 0% | 0 | 7% | 0.069 | C | C | . | . | I | π-helix | trans | -69.3 | -37.6 | 176 | -54.3 | 0 | 0 | 0 | 0 | 112.3 | E274 V407 G408 A414 L415 A416 | E274-S412 WeakPolarHBondContact CG-OG 3.18Å; E274-S412 WeakPolarHBondContact OE2-CB 3.41Å; V407-S412 PolarHBondContact O-N 3.49Å; G408-S412 WeakPolarHBondContact O-CB 3.27Å; S412-A414 VanDerWaalsContact C-N 3.32Å; S412-A414 PolarHBondContact O-N 2.91Å; S412-L415 PolarHBondContact O-N 3.5Å; S412-A416 VanDerWaalsContact O-CB 3.24Å; S412-A416 WeakPolarHBondContact O-CB 3.4Å; S412-A416 PolarHBondContact O-N 3.48Å |
| 413 | S | 95.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 12.6 Ų | 12.6 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -61.1 | -40.8 | 175 | 73.7 | 0 | 0 | 0 | 0 | 112.2 | G408 S409 L417 I418 | G408-S413 PolarHBondContact O-N 3.35Å; S409-S413 WeakPolarHBondContact O-CB 3.42Å; S409-S413 PolarHBondContact O-OG 3.38Å; S413-L417 WeakPolarHBondContact O-CA 3.33Å; S413-L417 WeakPolarHBondContact O-CB 3.1Å; S413-L417 PolarHBondContact O-N 3.48Å; S413-I418 PolarHBondContact O-N 3Å; S413-I418 VanDerWaalsContact O-N 3.11Å |
| 414 | A | 95.9 | Very high | 95.3 | Very high | 5 Ų | 5 | 12.4 Ų | 12.4 | 4% | 0.041 | 7% | 0.067 | C | C | . | . | I | π-helix | trans | -62.6 | -47.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | F150 S411 S412 I418 I419 | F150-A414 HydrophobicContact CD1-CB 3.93Å; F150-A414 HydrophobicContact CD2-CB 3.91Å; F150-A414 HydrophobicContact CE1-CB 3.82Å; F150-A414 HydrophobicContact CE2-CB 3.81Å; F150-A414 HydrophobicContact CG-CB 3.98Å; F150-A414 HydrophobicContact CZ-CB 3.76Å; S411-A414 PolarHBondContact O-N 2.85Å; S412-A414 VanDerWaalsContact C-N 3.32Å; S412-A414 PolarHBondContact O-N 2.91Å; A414-I418 PolarHBondContact O-N 2.82Å; A414-I419 WeakPolarHBondContact O-CB 3.43Å; A414-I419 WeakPolarHBondContact O-CD1 3.28Å; A414-I419 VanDerWaalsContact O-CG1 3.25Å; A414-I419 WeakPolarHBondContact O-CG1 3.46Å; A414-I419 PolarHBondContact O-N 3.26Å |
| 415 | L | 95.6 | Very high | 95.2 | Very high | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 8% | 0.078 | C | C | . | . | I | π-helix | trans | -72.3 | -46.7 | 179.8 | -67.2 | 169.7 | 0 | 0 | 0 | 113.1 | Y120 V147 F150 L151 T154 I276 S411 S412 I419 P420 | Y120-L415 HydrophobicContact CD1-CD2 4.46Å; Y120-L415 HydrophobicContact CE1-CB 4.39Å; Y120-L415 HydrophobicContact CE1-CD2 3.86Å; Y120-L415 PolarHBondContact OH-O 3.43Å; V147-L415 HydrophobicContact CG1-CD2 4.31Å; F150-L415 HydrophobicContact CB-CD1 4.1Å; F150-L415 HydrophobicContact CB-CD2 3.83Å; F150-L415 HydrophobicContact CB-CG 3.79Å; L151-L415 HydrophobicContact CD2-CD1 3.88Å; L151-L415 HydrophobicContact CD2-CD2 4.39Å; L151-L415 HydrophobicContact CG-CD1 4.19Å; L151-L415 HydrophobicContact CG-CD2 4.12Å; T154-L415 WeakPolarHBondContact OG1-CD1 3.45Å; I276-L415 HydrophobicContact CG2-CB 3.98Å; S411-L415 WeakPolarHBondContact O-CG 3.31Å; S411-L415 PolarHBondContact O-N 2.82Å; S412-L415 PolarHBondContact O-N 3.5Å; L415-I419 HydrophobicContact CD2-CD1 4.36Å; L415-P420 WeakPolarHBondContact O-CD 3.38Å; L415-P420 VanDerWaalsContact O-CG 3.24Å; L415-P420 WeakPolarHBondContact O-CG 3.49Å |
| 416 | A | 94.4 | Very high | 95 | Very high | 2 Ų | 2 | 14.6 Ų | 14.6 | 2% | 0.017 | 8% | 0.082 | C | C | . | . | I | π-helix | trans | -83.8 | -31.7 | -173.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | C98 S412 | C98-A416 WeakPolarHBondContact CB-O 3.5Å; C98-A416 PolarHBondContact SG-O 3.08Å; S412-A416 VanDerWaalsContact O-CB 3.24Å; S412-A416 WeakPolarHBondContact O-CB 3.4Å; S412-A416 PolarHBondContact O-N 3.48Å |
| 417 | L | 95.9 | Very high | 94.8 | Very high | 0 Ų | 0 | 12.6 Ų | 12.6 | 0% | 0 | 7% | 0.071 | C | C | . | . | I | π-helix | trans | -117.7 | -37.4 | -170.4 | -57.9 | -178.9 | 0 | 0 | 0 | 114.5 | M91 I94 F266 I270 S413 P421 I444 | M91-L417 HydrophobicContact CE-CD1 3.92Å; I94-L417 HydrophobicContact CG2-CD2 3.54Å; F266-L417 HydrophobicContact CE2-CD1 4.12Å; F266-L417 HydrophobicContact CZ-CD1 3.67Å; I270-L417 HydrophobicContact CD1-CD1 3.84Å; I270-L417 HydrophobicContact CD1-CD2 4.17Å; I270-L417 HydrophobicContact CD1-CG 4.08Å; I270-L417 HydrophobicContact CG1-CD1 4.07Å; S413-L417 WeakPolarHBondContact O-CA 3.33Å; S413-L417 WeakPolarHBondContact O-CB 3.1Å; S413-L417 PolarHBondContact O-N 3.48Å; L417-P421 WeakPolarHBondContact O-CD 3.4Å; L417-P421 WeakPolarHBondContact O-CG 3.28Å; L417-I444 HydrophobicContact CD2-CG2 4.43Å |
| 418 | I | 96.7 | Very high | 94.6 | Very high | 26 Ų | 26 | 13.7 Ų | 13.7 | 13% | 0.133 | 8% | 0.075 | C | C | . | . | I | π-helix | trans | -85.5 | -52.5 | -173.1 | -57.3 | 178.7 | 0 | 0 | 0 | 110.8 | S413 A414 L422 S445 F449 F452 | S413-I418 PolarHBondContact O-N 3Å; S413-I418 VanDerWaalsContact O-N 3.11Å; A414-I418 PolarHBondContact O-N 2.82Å; I418-L422 HydrophobicContact CG2-CD1 3.94Å; I418-L422 WeakPolarHBondContact O-CD1 3.43Å; I418-L422 VanDerWaalsContact O-CG 3.28Å; I418-L422 WeakPolarHBondContact O-CG 3.22Å; I418-S445 PolarHBondContact O-OG 3.39Å; I418-F449 HydrophobicContact CD1-CB 4.12Å; I418-F449 HydrophobicContact CD1-CD2 4.4Å; I418-F452 HydrophobicContact CD1-CB 4.49Å |
| 419 | I | 96.5 | Very high | 94.1 | Very high | 20 Ų | 20 | 19.8 Ų | 19.8 | 10% | 0.103 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -69.7 | -43.7 | -172.5 | -67.9 | 167.4 | 0 | 0 | 0 | 113.3 | Y120 V124 I146 V147 A414 L415 L422 L423 | Y120-I419 HydrophobicContact CE2-CG2 3.87Å; Y120-I419 WeakPolarHBondContact OH-CB 3.47Å; Y120-I419 VanDerWaalsContact OH-CG2 3.28Å; Y120-I419 WeakPolarHBondContact OH-CG2 3.41Å; V124-I419 HydrophobicContact CG2-CG2 3.6Å; I146-I419 HydrophobicContact CG2-CD1 4.2Å; V147-I419 HydrophobicContact CG2-CD1 4.17Å; V147-I419 HydrophobicContact CG2-CG2 4.32Å; A414-I419 WeakPolarHBondContact O-CB 3.43Å; A414-I419 WeakPolarHBondContact O-CD1 3.28Å; A414-I419 VanDerWaalsContact O-CG1 3.25Å; A414-I419 WeakPolarHBondContact O-CG1 3.46Å; A414-I419 PolarHBondContact O-N 3.26Å; L415-I419 HydrophobicContact CD2-CD1 4.36Å; I419-L422 PolarHBondContact O-N 3.49Å; I419-L423 WeakPolarHBondContact O-CB 3.38Å; I419-L423 PolarHBondContact O-N 3.09Å |
| 420 | P | 96.6 | Very high | 93.4 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -63 | -47 | -175.9 | -20.5 | 32.5 | 0 | 0 | 0 | 113.6 | C98 I101 I276 L415 L422 L423 E424 | C98-P420 HydrophobicContact CB-CB 3.99Å; C98-P420 HydrophobicContact CB-CG 4.1Å; I101-P420 HydrophobicContact CB-CB 4.36Å; I101-P420 HydrophobicContact CG2-CB 4.12Å; I101-P420 WeakPolarHBondContact CG2-O 3.48Å; I276-P420 HydrophobicContact CD1-CG 3.6Å; L415-P420 WeakPolarHBondContact O-CD 3.38Å; L415-P420 VanDerWaalsContact O-CG 3.24Å; L415-P420 WeakPolarHBondContact O-CG 3.49Å; P420-L422 PolarHBondContact O-N 3.24Å; P420-L423 CarbonylContact O-C 3.53Å; P420-L423 WeakPolarHBondContact O-CA 3.41Å; P420-L423 WeakPolarHBondContact O-CB 3.3Å; P420-L423 PolarHBondContact O-N 3.31Å; P420-E424 PolarHBondContact O-N 3.18Å |
| 421 | P | 96.2 | Very high | 92.8 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -59.8 | -40.7 | 175 | -27.6 | 38.5 | 0 | 0 | 0 | 113.8 | I101 L417 L423 E424 V425 D441 I444 | I101-P421 HydrophobicContact CD1-CG 4.49Å; L417-P421 WeakPolarHBondContact O-CD 3.4Å; L417-P421 WeakPolarHBondContact O-CG 3.28Å; P421-L423 PolarHBondContact O-N 3.42Å; P421-E424 PolarHBondContact O-N 3.49Å; P421-V425 WeakPolarHBondContact O-CG2 3.08Å; P421-V425 PolarHBondContact O-N 3.01Å; P421-D441 HydrophobicContact CB-CB 3.67Å; P421-D441 WeakPolarHBondContact CB-O 2.97Å; P421-D441 WeakPolarHBondContact CB-OD1 3.48Å; P421-I444 HydrophobicContact CG-CB 3.98Å; P421-I444 HydrophobicContact CG-CG2 3.7Å |
| 422 | L | 94.6 | Very high | 92 | Very high | 98 Ų | 98 | 29.8 Ų | 29.8 | 51% | 0.513 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -62.5 | -33.1 | 175 | -66.3 | 174.3 | 0 | 0 | 0 | 111.9 | I418 I419 P420 S426 | I418-L422 HydrophobicContact CG2-CD1 3.94Å; I418-L422 WeakPolarHBondContact O-CD1 3.43Å; I418-L422 VanDerWaalsContact O-CG 3.28Å; I418-L422 WeakPolarHBondContact O-CG 3.22Å; I419-L422 PolarHBondContact O-N 3.49Å; P420-L422 PolarHBondContact O-N 3.24Å; L422-S426 WeakPolarHBondContact O-CB 3.46Å; L422-S426 PolarHBondContact O-N 3Å |
| 423 | L | 94.9 | Very high | 91.5 | Very high | 5 Ų | 5 | 31.4 Ų | 31.4 | 3% | 0.026 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -73.6 | -36.8 | 174.1 | 177 | 64.6 | 0 | 0 | 0 | 113.1 | L102 C105 T123 V124 I419 P420 P421 V425 S426 T427 | L102-L423 HydrophobicContact CD1-CD2 3.71Å; C105-L423 HydrophobicContact CB-CD1 4.48Å; C105-L423 HydrophobicContact CB-CD2 3.93Å; C105-L423 HydrophobicContact CB-CG 3.94Å; T123-L423 HydrophobicContact CG2-CD2 3.88Å; V124-L423 HydrophobicContact CG2-CD2 4.1Å; I419-L423 WeakPolarHBondContact O-CB 3.38Å; I419-L423 PolarHBondContact O-N 3.09Å; P420-L423 CarbonylContact O-C 3.53Å; P420-L423 WeakPolarHBondContact O-CA 3.41Å; P420-L423 WeakPolarHBondContact O-CB 3.3Å; P420-L423 PolarHBondContact O-N 3.31Å; P421-L423 PolarHBondContact O-N 3.42Å; L423-V425 VanDerWaalsContact C-N 3.3Å; L423-S426 PolarHBondContact O-N 3.05Å; L423-T427 WeakPolarHBondContact CD1-OG1 3.27Å; L423-T427 WeakPolarHBondContact O-CB 3.33Å; L423-T427 PolarHBondContact O-N 3.39Å; L423-T427 PolarHBondContact O-OG1 2.86Å |
| 424 | E | 94.9 | Very high | 91.3 | Very high | 8 Ų | 8 | 34 Ų | 34 | 4% | 0.037 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58 | -48.4 | 169.9 | -173.7 | 150.8 | -121.2 | 0 | 0 | 109.1 | H97 I101 R104 P420 P421 T427 F428 I437 K440 | H97-E424 IonicContact NE2-OE2 2.87Å; I101-E424 HydrophobicContact CD1-CB 4.32Å; I101-E424 WeakPolarHBondContact CD1-OE2 3.04Å; I101-E424 HydrophobicContact CG1-CB 4.34Å; I101-E424 WeakPolarHBondContact CG1-OE2 3.18Å; I101-E424 HydrophobicContact CG2-CB 3.67Å; R104-E424 IonicContact CZ-OE1 3.17Å; R104-E424 IonicContact NH1-OE1 3.06Å; R104-E424 PolarHBondContact NH1-OE1 2.81Å; R104-E424 IonicContact NH2-OE1 3.42Å; R104-E424 PolarHBondContact NH2-OE1 3.18Å; R104-E424 IonicContact NH2-OE2 3.57Å; P420-E424 PolarHBondContact O-N 3.18Å; P421-E424 PolarHBondContact O-N 3.49Å; E424-T427 PolarHBondContact O-N 3.08Å; E424-F428 HydrophobicContact CG-CD2 4.34Å; E424-F428 WeakPolarHBondContact O-CD2 3.43Å; E424-F428 PolarHBondContact O-N 3.46Å; E424-I437 HydrophobicContact CG-CG2 4.27Å; E424-K440 IonicContact OE2-NZ 3.79Å; E424-K440 PolarHBondContact OE2-NZ 3.34Å |
| 425 | V | 93 | Very high | 91 | Very high | 39 Ų | 39 | 38.6 Ų | 38.6 | 24% | 0.236 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.7 | -51.8 | 178 | 178 | 0 | 0 | 0 | 0 | 111.9 | P421 L423 T427 Y429 M433 D441 | P421-V425 WeakPolarHBondContact O-CG2 3.08Å; P421-V425 PolarHBondContact O-N 3.01Å; L423-V425 VanDerWaalsContact C-N 3.3Å; V425-T427 VanDerWaalsContact C-N 3.33Å; V425-T427 PolarHBondContact O-N 3.17Å; V425-Y429 VanDerWaalsContact O-CB 3.32Å; V425-Y429 WeakPolarHBondContact O-CB 3.27Å; V425-Y429 PolarHBondContact O-N 3.36Å; V425-Y429 VanDerWaalsContact O-N 3.1Å; V425-M433 HydrophobicContact CB-CE 4.15Å; V425-M433 HydrophobicContact CG1-CE 4.23Å; V425-M433 HydrophobicContact CG2-CE 4.04Å; V425-D441 HydrophobicContact CG2-CB 3.8Å |
| 426 | S | 91.1 | Very high | 90.8 | Very high | 11 Ų | 11 | 45.2 Ų | 45.2 | 8% | 0.077 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -68 | -31.7 | -176 | 81.8 | 0 | 0 | 0 | 0 | 113.4 | G127 L422 L423 | G127-S426 VanDerWaalsContact O-CB 3.22Å; G127-S426 WeakPolarHBondContact O-CB 3.31Å; G127-S426 PolarHBondContact O-OG 3.36Å; L422-S426 WeakPolarHBondContact O-CB 3.46Å; L422-S426 PolarHBondContact O-N 3Å; L423-S426 PolarHBondContact O-N 3.05Å |
| 427 | T | 90.7 | Very high | 90.6 | Very high | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -76.8 | -37.4 | -177 | -58.8 | 0 | 0 | 0 | 0 | 113.1 | C105 R108 F109 L423 E424 V425 | C105-T427 HydrophobicContact CB-CG2 4.45Å; R108-T427 HydrophobicContact CG-CG2 4.27Å; F109-T427 HydrophobicContact CD2-CG2 4.5Å; F109-T427 HydrophobicContact CE2-CG2 3.61Å; F109-T427 WeakPolarHBondContact CE2-OG1 3.4Å; F109-T427 HydrophobicContact CZ-CG2 3.77Å; L423-T427 WeakPolarHBondContact CD1-OG1 3.27Å; L423-T427 WeakPolarHBondContact O-CB 3.33Å; L423-T427 PolarHBondContact O-N 3.39Å; L423-T427 PolarHBondContact O-OG1 2.86Å; E424-T427 PolarHBondContact O-N 3.08Å; V425-T427 VanDerWaalsContact C-N 3.33Å; V425-T427 PolarHBondContact O-N 3.17Å |
| 428 | F | 89.9 | Confident | 90.5 | Very high | 40 Ų | 40 | 51 Ų | 51 | 18% | 0.175 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -110.6 | -2.6 | -170.7 | -65.7 | -74.9 | 0 | 0 | 0 | 114.5 | R108 E424 S430 E431 M433 | R108-F428 HydrophobicContact CB-CZ 4.35Å; R108-F428 HydrophobicContact CG-CE1 4.18Å; R108-F428 HydrophobicContact CG-CZ 4.31Å; E424-F428 HydrophobicContact CG-CD2 4.34Å; E424-F428 WeakPolarHBondContact O-CD2 3.43Å; E424-F428 PolarHBondContact O-N 3.46Å; F428-S430 VanDerWaalsContact C-N 3.28Å; F428-S430 PolarHBondContact O-N 2.99Å; F428-E431 WeakPolarHBondContact O-CB 3.38Å; F428-E431 PolarHBondContact O-N 3.4Å; F428-M433 HydrophobicContact CB-CG 3.83Å; F428-M433 HydrophobicContact CB-SD 3.68Å; F428-M433 WeakPolarHBondContact O-CG 3.29Å |
| 429 | Y | 85.5 | Confident | 90.3 | Very high | 128 Ų | 128 | 56.7 Ų | 56.7 | 50% | 0.502 | 31% | 0.314 | S | S | . | . | G | 310 helix | trans | -48.3 | -46.4 | -180 | -173.4 | -88.6 | 0 | 0 | 0 | 113.7 | P132 V425 E431 G432 | P132-Y429 HydrophobicContact CB-CD1 3.99Å; P132-Y429 HydrophobicContact CB-CE1 3.98Å; P132-Y429 HydrophobicContact CG-CD1 3.52Å; P132-Y429 HydrophobicContact CG-CE1 3.66Å; P132-Y429 HydrophobicContact CG-CG 4Å; V425-Y429 VanDerWaalsContact O-CB 3.32Å; V425-Y429 WeakPolarHBondContact O-CB 3.27Å; V425-Y429 PolarHBondContact O-N 3.36Å; V425-Y429 VanDerWaalsContact O-N 3.1Å; Y429-E431 PolarHBondContact O-N 3.47Å; Y429-G432 PolarHBondContact O-N 3.41Å |
| 430 | S | 79.8 | Confident | 90.3 | Very high | 87 Ų | 87 | 58.4 Ų | 58.4 | 61% | 0.608 | 32% | 0.321 | S | S | * | . | G | 310 helix | trans | -68.8 | -10.5 | -177.7 | 51.8 | 0 | 0 | 0 | 0 | 114.5 | F428 | F428-S430 VanDerWaalsContact C-N 3.28Å; F428-S430 PolarHBondContact O-N 2.99Å |
| 431 | E | 82.8 | Confident | 90.2 | Very high | 90 Ų | 90 | 58.5 Ų | 58.5 | 42% | 0.421 | 32% | 0.321 | S | S | . | . | G | 310 helix | trans | -95.9 | 5.5 | 179.9 | -59.9 | 179.2 | -151.3 | 0 | 0 | 112.4 | R108 R112 F428 Y429 | R108-E431 IonicContact CZ-OE1 2.7Å; R108-E431 IonicContact CZ-OE2 2.64Å; R108-E431 IonicContact NE-OE1 3.54Å; R108-E431 PolarHBondContact NE-OE1 2.88Å; R108-E431 IonicContact NH2-OE1 3.55Å; R108-E431 PolarHBondContact NH2-OE1 2.97Å; R108-E431 IonicContact NH2-OE2 2.84Å; R108-E431 PolarHBondContact NH2-OE2 2.85Å; R112-E431 IonicContact CZ-OE1 3.66Å; R112-E431 IonicContact NH1-OE1 2.83Å; R112-E431 IonicContact NH2-OE1 3.75Å; R112-E431 PolarHBondContact NH2-OE1 3.47Å; F428-E431 WeakPolarHBondContact O-CB 3.38Å; F428-E431 PolarHBondContact O-N 3.4Å; Y429-E431 PolarHBondContact O-N 3.47Å |
| 432 | G | 77.4 | Confident | 90.2 | Very high | 67 Ų | 67 | 60.6 Ų | 60.6 | 69% | 0.691 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.5 | 54.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y429 | Y429-G432 PolarHBondContact O-N 3.41Š|
| 433 | M | 84.1 | Confident | 90.3 | Very high | 34 Ų | 34 | 60.9 Ų | 60.9 | 17% | 0.167 | 34% | 0.34 | C | S | . | . | trans | -58.1 | 144.6 | -178.8 | -70.9 | -150 | -59.5 | 0 | 0 | 113.6 | V425 F428 I437 I438 | V425-M433 HydrophobicContact CB-CE 4.15Å; V425-M433 HydrophobicContact CG1-CE 4.23Å; V425-M433 HydrophobicContact CG2-CE 4.04Å; F428-M433 HydrophobicContact CB-CG 3.83Å; F428-M433 HydrophobicContact CB-SD 3.68Å; F428-M433 WeakPolarHBondContact O-CG 3.29Å; M433-I437 HydrophobicContact CE-CG2 4.45Å; M433-I437 HydrophobicContact SD-CG2 3.82Å; M433-I438 HydrophobicContact CB-CD1 4.4Å; M433-I438 HydrophobicContact CB-CG1 4.39Å; M433-I438 HydrophobicContact CE-CD1 4.3Å; M433-I438 HydrophobicContact CE-CG1 3.62Å | ||
| 434 | S | 89.9 | Confident | 90.4 | Very high | 53 Ų | 53 | 61.4 Ų | 61.4 | 37% | 0.371 | 34% | 0.343 | S | S | . | . | trans | -67.7 | 143.2 | 173.7 | 72.4 | 0 | 0 | 0 | 0 | 111.2 | L436 I437 I438 | S434-L436 PolarHBondContact O-N 3.17Å; S434-L436 VanDerWaalsContact O-N 3.09Å; S434-I437 PolarHBondContact O-N 3.39Å; S434-I437 WeakPolarHBondContact OG-CG1 3.47Å; S434-I438 PolarHBondContact O-N 3.2Å | ||
| 435 | P | 90.1 | Very high | 90.5 | Very high | 103 Ų | 103 | 61.7 Ų | 61.7 | 67% | 0.669 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -56.3 | -28 | 177.4 | -28 | 35.6 | 0 | 0 | 0 | 114 | I438 F439 | P435-I438 PolarHBondContact O-N 3.5Å; P435-F439 WeakPolarHBondContact O-CB 3.46Å; P435-F439 PolarHBondContact O-N 2.68Å |
| 436 | L | 90.9 | Very high | 90.7 | Very high | 139 Ų | 139 | 64.7 Ų | 64.7 | 73% | 0.728 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -66.3 | -36 | 177.4 | -64.4 | 176.8 | 0 | 0 | 0 | 113 | S434 K440 | S434-L436 PolarHBondContact O-N 3.17Å; S434-L436 VanDerWaalsContact O-N 3.09Å; L436-K440 WeakPolarHBondContact O-CB 3.49Å; L436-K440 PolarHBondContact O-N 3.41Å |
| 437 | I | 91.6 | Very high | 90.9 | Very high | 57 Ų | 57 | 67.5 Ų | 67.5 | 29% | 0.292 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -68.4 | -47.3 | 176.3 | -67.3 | 167.5 | 0 | 0 | 0 | 109.4 | E424 M433 S434 F439 K440 D441 | E424-I437 HydrophobicContact CG-CG2 4.27Å; M433-I437 HydrophobicContact CE-CG2 4.45Å; M433-I437 HydrophobicContact SD-CG2 3.82Å; S434-I437 PolarHBondContact O-N 3.39Å; S434-I437 WeakPolarHBondContact OG-CG1 3.47Å; I437-F439 VanDerWaalsContact C-N 3.33Å; I437-F439 PolarHBondContact O-N 3.05Å; I437-K440 WeakPolarHBondContact O-CB 3.2Å; I437-K440 PolarHBondContact O-N 3.46Å; I437-D441 WeakPolarHBondContact CG2-OD2 3.4Å; I437-D441 PolarHBondContact O-N 3.24Å; I437-D441 VanDerWaalsContact O-OD2 3.06Å |
| 438 | I | 92.4 | Very high | 91.2 | Very high | 67 Ų | 67 | 67.5 Ų | 67.5 | 34% | 0.344 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -59.1 | -43.8 | 177.2 | -60.6 | 170.6 | 0 | 0 | 0 | 111 | M433 S434 P435 D441 A442 | M433-I438 HydrophobicContact CB-CD1 4.4Å; M433-I438 HydrophobicContact CB-CG1 4.39Å; M433-I438 HydrophobicContact CE-CD1 4.3Å; M433-I438 HydrophobicContact CE-CG1 3.62Å; S434-I438 PolarHBondContact O-N 3.2Å; P435-I438 PolarHBondContact O-N 3.5Å; I438-D441 PolarHBondContact O-N 3.41Å; I438-A442 WeakPolarHBondContact O-CB 3.49Å; I438-A442 PolarHBondContact O-N 3.24Å |
| 439 | F | 94.1 | Very high | 91.5 | Very high | 144 Ų | 144 | 71.2 Ų | 71.2 | 63% | 0.632 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -64.3 | -44.2 | 177.2 | -179.8 | -100.1 | 0 | 0 | 0 | 112.5 | P435 I437 D441 L443 | P435-F439 WeakPolarHBondContact O-CB 3.46Å; P435-F439 PolarHBondContact O-N 2.68Å; I437-F439 VanDerWaalsContact C-N 3.33Å; I437-F439 PolarHBondContact O-N 3.05Å; F439-D441 VanDerWaalsContact C-N 3.33Å; F439-D441 PolarHBondContact O-N 2.94Å; F439-L443 WeakPolarHBondContact O-CB 3.35Å; F439-L443 PolarHBondContact O-N 3.31Å |
| 440 | K | 95.8 | Very high | 92 | Very high | 56 Ų | 56 | 68.7 Ų | 68.7 | 24% | 0.243 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -55.4 | -48.5 | 171.7 | 168.9 | -167.3 | 61.1 | 59.4 | 0 | 111 | H97 E424 L436 I437 L443 I444 | H97-K440 PolarHBondContact NE2-NZ 2.9Å; E424-K440 IonicContact OE2-NZ 3.79Å; E424-K440 PolarHBondContact OE2-NZ 3.34Å; L436-K440 WeakPolarHBondContact O-CB 3.49Å; L436-K440 PolarHBondContact O-N 3.41Å; I437-K440 WeakPolarHBondContact O-CB 3.2Å; I437-K440 PolarHBondContact O-N 3.46Å; K440-L443 PolarHBondContact O-N 3.35Å; K440-I444 HydrophobicContact CD-CD1 4.48Å; K440-I444 HydrophobicContact CG-CD1 3.85Å; K440-I444 WeakPolarHBondContact O-CG1 3.41Å; K440-I444 PolarHBondContact O-N 2.84Å |
| 441 | D | 95.4 | Very high | 92.8 | Very high | 2 Ų | 2 | 65 Ų | 65 | 1% | 0.011 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -67.9 | -41.9 | -175.9 | -74.8 | -38 | 0 | 0 | 0 | 112.5 | P421 V425 I437 I438 F439 L443 I444 S445 | P421-D441 HydrophobicContact CB-CB 3.67Å; P421-D441 WeakPolarHBondContact CB-O 2.97Å; P421-D441 WeakPolarHBondContact CB-OD1 3.48Å; V425-D441 HydrophobicContact CG2-CB 3.8Å; I437-D441 WeakPolarHBondContact CG2-OD2 3.4Å; I437-D441 PolarHBondContact O-N 3.24Å; I437-D441 VanDerWaalsContact O-OD2 3.06Å; I438-D441 PolarHBondContact O-N 3.41Å; F439-D441 VanDerWaalsContact C-N 3.33Å; F439-D441 PolarHBondContact O-N 2.94Å; D441-L443 VanDerWaalsContact C-N 3.34Å; D441-L443 PolarHBondContact O-N 3.47Å; D441-I444 PolarHBondContact O-N 3.21Å; D441-S445 VanDerWaalsContact O-CB 3.23Å; D441-S445 WeakPolarHBondContact O-CB 3.42Å; D441-S445 PolarHBondContact O-N 3.19Å |
| 442 | A | 95.2 | Very high | 93.4 | Very high | 45 Ų | 45 | 63.4 Ų | 63.4 | 37% | 0.372 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -58.8 | -45.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | I438 S445 I446 | I438-A442 WeakPolarHBondContact O-CB 3.49Å; I438-A442 PolarHBondContact O-N 3.24Å; A442-S445 PolarHBondContact O-N 3.34Å; A442-I446 VanDerWaalsContact O-CB 3.27Å; A442-I446 WeakPolarHBondContact O-CB 3.36Å; A442-I446 WeakPolarHBondContact O-CD1 3.23Å; A442-I446 WeakPolarHBondContact O-CG1 3.31Å; A442-I446 PolarHBondContact O-N 2.91Å |
| 443 | L | 96.5 | Very high | 94.3 | Very high | 103 Ų | 103 | 63.6 Ų | 63.6 | 54% | 0.539 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62.4 | -45.5 | 179.6 | -178 | 63.2 | 0 | 0 | 0 | 112.6 | F439 K440 D441 L447 | F439-L443 WeakPolarHBondContact O-CB 3.35Å; F439-L443 PolarHBondContact O-N 3.31Å; K440-L443 PolarHBondContact O-N 3.35Å; D441-L443 VanDerWaalsContact C-N 3.34Å; D441-L443 PolarHBondContact O-N 3.47Å; L443-L447 WeakPolarHBondContact O-CB 3.48Å; L443-L447 PolarHBondContact O-N 3.15Å |
| 444 | I | 96.9 | Very high | 94.8 | Very high | 16 Ų | 16 | 64.9 Ų | 64.9 | 8% | 0.082 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -65.8 | -43.9 | 178.1 | -64.2 | 167.8 | 0 | 0 | 0 | 110.8 | I94 L417 P421 K440 D441 L447 G448 | I94-I444 HydrophobicContact CG2-CD1 4.48Å; I94-I444 HydrophobicContact CG2-CG1 4.29Å; I94-I444 HydrophobicContact CG2-CG2 3.65Å; L417-I444 HydrophobicContact CD2-CG2 4.43Å; P421-I444 HydrophobicContact CG-CB 3.98Å; P421-I444 HydrophobicContact CG-CG2 3.7Å; K440-I444 HydrophobicContact CD-CD1 4.48Å; K440-I444 HydrophobicContact CG-CD1 3.85Å; K440-I444 WeakPolarHBondContact O-CG1 3.41Å; K440-I444 PolarHBondContact O-N 2.84Å; D441-I444 PolarHBondContact O-N 3.21Å; I444-L447 PolarHBondContact O-N 3.02Å; I444-G448 PolarHBondContact O-N 3.45Å |
| 445 | S | 97.1 | Very high | 95 | Very high | 14 Ų | 14 | 62.4 Ų | 62.4 | 10% | 0.098 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -66.3 | -40.8 | 179.9 | -167.1 | 0 | 0 | 0 | 0 | 111.9 | I418 D441 A442 G448 F449 | I418-S445 PolarHBondContact O-OG 3.39Å; D441-S445 VanDerWaalsContact O-CB 3.23Å; D441-S445 WeakPolarHBondContact O-CB 3.42Å; D441-S445 PolarHBondContact O-N 3.19Å; A442-S445 PolarHBondContact O-N 3.34Å; S445-G448 PolarHBondContact O-N 3.4Å; S445-F449 WeakPolarHBondContact O-CB 3.37Å; S445-F449 PolarHBondContact O-N 3.3Å |
| 446 | I | 96.9 | Very high | 95.2 | Very high | 103 Ų | 103 | 58.7 Ų | 58.7 | 53% | 0.528 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 173.4 | -70.2 | 164.9 | 0 | 0 | 0 | 111 | A442 G448 F449 V450 | A442-I446 VanDerWaalsContact O-CB 3.27Å; A442-I446 WeakPolarHBondContact O-CB 3.36Å; A442-I446 WeakPolarHBondContact O-CD1 3.23Å; A442-I446 WeakPolarHBondContact O-CG1 3.31Å; A442-I446 PolarHBondContact O-N 2.91Å; I446-G448 VanDerWaalsContact C-N 3.3Å; I446-G448 PolarHBondContact O-N 2.89Å; I446-F449 PolarHBondContact O-N 2.89Å; I446-V450 HydrophobicContact CG2-CG2 4.2Å; I446-V450 WeakPolarHBondContact O-CG2 3.3Å; I446-V450 PolarHBondContact O-N 3.44Å |
| 447 | L | 95.9 | Very high | 95.4 | Very high | 70 Ų | 70 | 59.2 Ų | 59.2 | 37% | 0.366 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -59 | -43.6 | 175 | 179.4 | 66.4 | 0 | 0 | 0 | 111.2 | I94 L443 I444 G451 | I94-L447 HydrophobicContact CD1-CD2 3.87Å; L443-L447 WeakPolarHBondContact O-CB 3.48Å; L443-L447 PolarHBondContact O-N 3.15Å; I444-L447 PolarHBondContact O-N 3.02Å; L447-G451 PolarHBondContact O-N 3.26Å |
| 448 | G | 96.5 | Very high | 95.5 | Very high | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -59.8 | -44.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | I444 S445 I446 G451 F452 | I444-G448 PolarHBondContact O-N 3.45Å; S445-G448 PolarHBondContact O-N 3.4Å; I446-G448 VanDerWaalsContact C-N 3.3Å; I446-G448 PolarHBondContact O-N 2.89Å; G448-G451 PolarHBondContact O-N 3.23Å; G448-F452 WeakPolarHBondContact O-CB 3.39Å; G448-F452 PolarHBondContact O-N 2.99Å |
| 449 | F | 97.1 | Very high | 95.5 | Very high | 118 Ų | 118 | 54.4 Ų | 54.4 | 52% | 0.518 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -69.7 | -40.2 | 179.6 | -175.5 | -99.5 | 0 | 0 | 0 | 113.5 | I418 S445 I446 F452 V453 | I418-F449 HydrophobicContact CD1-CB 4.12Å; I418-F449 HydrophobicContact CD1-CD2 4.4Å; S445-F449 WeakPolarHBondContact O-CB 3.37Å; S445-F449 PolarHBondContact O-N 3.3Å; I446-F449 PolarHBondContact O-N 2.89Å; F449-F452 WeakPolarHBondContact O-CB 3.35Å; F449-F452 PolarHBondContact O-N 2.95Å; F449-V453 HydrophobicContact CD1-CG2 4.39Å; F449-V453 HydrophobicContact CE1-CG2 3.93Å; F449-V453 HydrophobicContact CE2-CG2 4.32Å; F449-V453 HydrophobicContact CZ-CG2 3.89Å; F449-V453 WeakPolarHBondContact O-CG2 3.4Å; F449-V453 PolarHBondContact O-N 3.36Å |
| 450 | V | 96.3 | Very high | 95.4 | Very high | 75 Ų | 75 | 51.4 Ų | 51.4 | 46% | 0.455 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -63.8 | -45.4 | 173.4 | 172.4 | 0 | 0 | 0 | 0 | 109.9 | I446 F452 V453 V454 | I446-V450 HydrophobicContact CG2-CG2 4.2Å; I446-V450 WeakPolarHBondContact O-CG2 3.3Å; I446-V450 PolarHBondContact O-N 3.44Å; V450-F452 VanDerWaalsContact C-N 3.3Å; V450-F452 PolarHBondContact O-N 2.92Å; V450-V453 PolarHBondContact O-N 3.03Å; V450-V454 HydrophobicContact CG1-CG2 4.07Å; V450-V454 WeakPolarHBondContact O-CB 3.24Å; V450-V454 VanDerWaalsContact O-CG2 3.31Å; V450-V454 WeakPolarHBondContact O-CG2 3.34Å; V450-V454 PolarHBondContact O-N 3.49Å |
| 451 | G | 94.8 | Very high | 95.2 | Very high | 9 Ų | 9 | 50.2 Ų | 50.2 | 9% | 0.093 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.2 | -34.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | L447 G448 G455 | L447-G451 PolarHBondContact O-N 3.26Å; G448-G451 PolarHBondContact O-N 3.23Å; G451-G455 WeakPolarHBondContact O-CA 3.41Å; G451-G455 PolarHBondContact O-N 3.02Å |
| 452 | F | 95.9 | Very high | 95 | Very high | 57 Ų | 57 | 52.3 Ų | 52.3 | 25% | 0.25 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.4 | -57.6 | 170.8 | 174.9 | -84.2 | 0 | 0 | 0 | 111.6 | S409 V410 I418 G448 F449 V450 T456 | S409-F452 VanDerWaalsContact O-CA 3.28Å; S409-F452 WeakPolarHBondContact O-CA 3.48Å; S409-F452 WeakPolarHBondContact O-CD2 3.31Å; V410-F452 HydrophobicContact CB-CE2 4.33Å; V410-F452 HydrophobicContact CG1-CE2 3.94Å; V410-F452 WeakPolarHBondContact O-CD2 3.41Å; V410-F452 WeakPolarHBondContact O-CE2 3.11Å; I418-F452 HydrophobicContact CD1-CB 4.49Å; G448-F452 WeakPolarHBondContact O-CB 3.39Å; G448-F452 PolarHBondContact O-N 2.99Å; F449-F452 WeakPolarHBondContact O-CB 3.35Å; F449-F452 PolarHBondContact O-N 2.95Å; V450-F452 VanDerWaalsContact C-N 3.3Å; V450-F452 PolarHBondContact O-N 2.92Å; F452-T456 WeakPolarHBondContact O-CB 3.32Å; F452-T456 PolarHBondContact O-N 3.48Å; F452-T456 PolarHBondContact O-OG1 3.4Å |
| 453 | V | 96.6 | Very high | 94.6 | Very high | 70 Ų | 70 | 52.3 Ų | 52.3 | 42% | 0.424 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -65.1 | -50.8 | -175.2 | 175.7 | 0 | 0 | 0 | 0 | 110.9 | F449 V450 Y457 | F449-V453 HydrophobicContact CD1-CG2 4.39Å; F449-V453 HydrophobicContact CE1-CG2 3.93Å; F449-V453 HydrophobicContact CE2-CG2 4.32Å; F449-V453 HydrophobicContact CZ-CG2 3.89Å; F449-V453 WeakPolarHBondContact O-CG2 3.4Å; F449-V453 PolarHBondContact O-N 3.36Å; V450-V453 PolarHBondContact O-N 3.03Å; V453-Y457 WeakPolarHBondContact O-CB 3.41Å; V453-Y457 PolarHBondContact O-N 3.31Å |
| 454 | V | 95.3 | Very high | 94.2 | Very high | 62 Ų | 62 | 53.3 Ų | 53.3 | 38% | 0.376 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -74.2 | -38.8 | -173.7 | -175.2 | 0 | 0 | 0 | 0 | 111.6 | P263 V450 Y457 Q458 | P263-V454 HydrophobicContact CB-CG1 4.04Å; P263-V454 HydrophobicContact CG-CG1 3.59Å; V450-V454 HydrophobicContact CG1-CG2 4.07Å; V450-V454 WeakPolarHBondContact O-CB 3.24Å; V450-V454 VanDerWaalsContact O-CG2 3.31Å; V450-V454 WeakPolarHBondContact O-CG2 3.34Å; V450-V454 PolarHBondContact O-N 3.49Å; V454-Y457 PolarHBondContact O-N 3.13Å; V454-Q458 WeakPolarHBondContact O-CB 3.38Å; V454-Q458 PolarHBondContact O-N 3.48Å |
| 455 | G | 94.2 | Very high | 93.7 | Very high | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65.3 | -42.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | G451 A459 | G451-G455 WeakPolarHBondContact O-CA 3.41Å; G451-G455 PolarHBondContact O-N 3.02Å; G455-A459 WeakPolarHBondContact O-CB 3.26Å; G455-A459 PolarHBondContact O-N 3.03Å |
| 456 | T | 94.3 | Very high | 92.3 | Very high | 26 Ų | 26 | 60.2 Ų | 60.2 | 16% | 0.16 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -65.2 | -44.4 | 175.3 | -54.1 | 0 | 0 | 0 | 0 | 111.2 | L406 S409 V410 F452 L460 | L406-T456 HydrophobicContact CD1-CG2 4.04Å; S409-T456 PolarHBondContact OG-N 3.3Å; V410-T456 HydrophobicContact CG2-CG2 3.8Å; V410-T456 WeakPolarHBondContact CG2-OG1 3.47Å; F452-T456 WeakPolarHBondContact O-CB 3.32Å; F452-T456 PolarHBondContact O-N 3.48Å; F452-T456 PolarHBondContact O-OG1 3.4Å; T456-L460 HydrophobicContact CG2-CD1 3.99Å; T456-L460 WeakPolarHBondContact O-CB 3.23Å; T456-L460 VanDerWaalsContact O-CG 3.28Å; T456-L460 WeakPolarHBondContact O-CG 3.35Å; T456-L460 PolarHBondContact O-N 2.73Å; T456-L460 VanDerWaalsContact O-N 3.08Å |
| 457 | Y | 94.9 | Very high | 90.5 | Very high | 149 Ų | 149 | 57.7 Ų | 57.7 | 58% | 0.584 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -59.1 | -49.8 | 176.1 | 174.3 | -99.8 | 0 | 0 | 0 | 112 | V453 V454 A459 L460 D461 | V453-Y457 WeakPolarHBondContact O-CB 3.41Å; V453-Y457 PolarHBondContact O-N 3.31Å; V454-Y457 PolarHBondContact O-N 3.13Å; Y457-A459 PolarHBondContact O-N 2.95Å; Y457-L460 PolarHBondContact O-N 3.21Å; Y457-D461 WeakPolarHBondContact O-CB 3.41Å; Y457-D461 PolarHBondContact O-N 2.94Å |
| 458 | Q | 94.4 | Very high | 88.2 | Confident | 20 Ų | 20 | 60.9 Ų | 60.9 | 9% | 0.093 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.9 | -42.1 | -178.6 | -171.7 | 62 | 31.3 | 0 | 0 | 112.1 | K260 P263 L264 V454 L460 D461 E462 | K260-Q458 WeakPolarHBondContact O-CG 3.48Å; K260-Q458 PolarHBondContact O-NE2 3.08Å; P263-Q458 HydrophobicContact CB-CB 3.89Å; P263-Q458 HydrophobicContact CB-CG 4.28Å; P263-Q458 HydrophobicContact CG-CB 4.31Å; P263-Q458 HydrophobicContact CG-CG 4.46Å; L264-Q458 HydrophobicContact CD2-CG 4.02Å; L264-Q458 HydrophobicContact CG-CG 4.16Å; V454-Q458 WeakPolarHBondContact O-CB 3.38Å; V454-Q458 PolarHBondContact O-N 3.48Å; Q458-L460 VanDerWaalsContact C-N 3.31Å; Q458-L460 PolarHBondContact O-N 3.34Å; Q458-D461 PolarHBondContact O-N 2.99Å; Q458-E462 PolarHBondContact NE2-OE1 2.95Å; Q458-E462 PolarHBondContact O-N 2.9Å |
| 459 | A | 91.3 | Very high | 85.5 | Confident | 4 Ų | 4 | 64.7 Ų | 64.7 | 3% | 0.033 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -64.2 | -35.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L406 G455 Y457 L463 | L406-A459 HydrophobicContact CB-CB 4.16Å; L406-A459 HydrophobicContact CD1-CB 4.11Å; G455-A459 WeakPolarHBondContact O-CB 3.26Å; G455-A459 PolarHBondContact O-N 3.03Å; Y457-A459 PolarHBondContact O-N 2.95Å; A459-L463 WeakPolarHBondContact O-CB 3.43Å; A459-L463 PolarHBondContact O-N 3.29Å; A459-L463 VanDerWaalsContact O-N 3.16Å |
| 460 | L | 91.4 | Very high | 82.6 | Confident | 80 Ų | 80 | 64.4 Ų | 64.4 | 42% | 0.419 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -76.4 | -38.9 | 175.7 | -68.7 | 174.3 | 0 | 0 | 0 | 112.8 | T456 Y457 Q458 L463 L464 | T456-L460 HydrophobicContact CG2-CD1 3.99Å; T456-L460 WeakPolarHBondContact O-CB 3.23Å; T456-L460 VanDerWaalsContact O-CG 3.28Å; T456-L460 WeakPolarHBondContact O-CG 3.35Å; T456-L460 PolarHBondContact O-N 2.73Å; T456-L460 VanDerWaalsContact O-N 3.08Å; Y457-L460 PolarHBondContact O-N 3.21Å; Q458-L460 VanDerWaalsContact C-N 3.31Å; Q458-L460 PolarHBondContact O-N 3.34Å; L460-L463 HydrophobicContact CD2-CD2 4.43Å; L460-L463 WeakPolarHBondContact O-CB 3.28Å; L460-L463 PolarHBondContact O-N 2.95Å; L460-L464 WeakPolarHBondContact O-CG 3.43Å; L460-L464 PolarHBondContact O-N 3.2Å |
| 461 | D | 92.8 | Very high | 80 | Confident | 31 Ų | 31 | 67.5 Ų | 67.5 | 17% | 0.166 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -61.4 | -42.6 | 175.6 | 173.1 | 65.8 | 0 | 0 | 0 | 111.7 | Y457 Q458 K465 | Y457-D461 WeakPolarHBondContact O-CB 3.41Å; Y457-D461 PolarHBondContact O-N 2.94Å; Q458-D461 PolarHBondContact O-N 2.99Å; D461-K465 WeakPolarHBondContact O-CB 3.27Å; D461-K465 WeakPolarHBondContact O-CD 3.42Å; D461-K465 WeakPolarHBondContact O-CG 3.49Å; D461-K465 PolarHBondContact O-N 3.01Å; D461-K465 WeakPolarHBondContact OD1-CE 3.42Å; D461-K465 IonicContact OD1-NZ 2.73Å; D461-K465 PolarHBondContact OD1-NZ 3.19Å; D461-K465 IonicContact OD2-NZ 2.74Å; D461-K465 PolarHBondContact OD2-NZ 3.37Å |
| 462 | E | 89.8 | Confident | 77.3 | Confident | 46 Ų | 46 | 75.6 Ų | 75.6 | 22% | 0.215 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -70.4 | -35.6 | 174.3 | -73.6 | -178.4 | -160 | 0 | 0 | 113.1 | L264 L402 Q458 S466 | L264-E462 WeakPolarHBondContact CD1-OE1 3.41Å; L264-E462 WeakPolarHBondContact CD1-OE2 3.39Å; L402-E462 HydrophobicContact CD1-CB 4.49Å; L402-E462 HydrophobicContact CD2-CB 3.96Å; Q458-E462 PolarHBondContact NE2-OE1 2.95Å; Q458-E462 PolarHBondContact O-N 2.9Å; E462-S466 WeakPolarHBondContact O-CB 3.42Å; E462-S466 PolarHBondContact O-N 3.28Å; E462-S466 PolarHBondContact O-OG 3.15Å |
| 463 | L | 87.6 | Confident | 74.2 | Confident | 46 Ų | 46 | 78.1 Ų | 78.1 | 24% | 0.241 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -60.4 | -48 | 173.3 | -176.8 | 64 | 0 | 0 | 0 | 111.2 | I397 A459 L460 S466 G467 | I397-L463 HydrophobicContact CB-CD1 4.44Å; I397-L463 HydrophobicContact CD1-CD1 4.42Å; I397-L463 HydrophobicContact CD1-CD2 3.74Å; I397-L463 HydrophobicContact CG1-CD1 4.07Å; I397-L463 HydrophobicContact CG1-CD2 4.13Å; I397-L463 HydrophobicContact CG2-CD1 3.79Å; A459-L463 WeakPolarHBondContact O-CB 3.43Å; A459-L463 PolarHBondContact O-N 3.29Å; A459-L463 VanDerWaalsContact O-N 3.16Å; L460-L463 HydrophobicContact CD2-CD2 4.43Å; L460-L463 WeakPolarHBondContact O-CB 3.28Å; L460-L463 PolarHBondContact O-N 2.95Å; L463-S466 PolarHBondContact O-N 2.66Å; L463-S466 PolarHBondContact O-OG 3.46Å; L463-G467 PolarHBondContact O-N 3.27Å |
| 464 | L | 88.1 | Confident | 71.1 | Confident | 124 Ų | 124 | 80.7 Ų | 80.7 | 65% | 0.649 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -62.7 | -48.2 | 179 | -70.3 | 170.2 | 0 | 0 | 0 | 111.6 | L460 S466 G467 D468 | L460-L464 WeakPolarHBondContact O-CG 3.43Å; L460-L464 PolarHBondContact O-N 3.2Å; L464-S466 PolarHBondContact O-N 3.23Å; L464-G467 WeakPolarHBondContact O-CA 3.45Å; L464-G467 PolarHBondContact O-N 3.07Å; L464-D468 PolarHBondContact O-N 3.25Å |
| 465 | K | 86.3 | Confident | 68.2 | Low | 124 Ų | 124 | 83.7 Ų | 83.7 | 54% | 0.539 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -59.6 | -31.3 | 176.4 | -74 | 167.1 | -177.7 | 164.5 | 0 | 113.5 | D461 G467 | D461-K465 WeakPolarHBondContact O-CB 3.27Å; D461-K465 WeakPolarHBondContact O-CD 3.42Å; D461-K465 WeakPolarHBondContact O-CG 3.49Å; D461-K465 PolarHBondContact O-N 3.01Å; D461-K465 WeakPolarHBondContact OD1-CE 3.42Å; D461-K465 IonicContact OD1-NZ 2.73Å; D461-K465 PolarHBondContact OD1-NZ 3.19Å; D461-K465 IonicContact OD2-NZ 2.74Å; D461-K465 PolarHBondContact OD2-NZ 3.37Å; K465-G467 VanDerWaalsContact C-N 3.34Å |
| 466 | S | 67.8 | Low | 65.7 | Low | 50 Ų | 50 | 89.2 Ų | 89.2 | 35% | 0.35 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -72.7 | -26.9 | 174.2 | 77.5 | 0 | 0 | 0 | 0 | 113.1 | E462 L463 L464 | E462-S466 WeakPolarHBondContact O-CB 3.42Å; E462-S466 PolarHBondContact O-N 3.28Å; E462-S466 PolarHBondContact O-OG 3.15Å; L463-S466 PolarHBondContact O-N 2.66Å; L463-S466 PolarHBondContact O-OG 3.46Å; L464-S466 PolarHBondContact O-N 3.23Å |
| 467 | G | 58.5 | Low | 62.8 | Low | 50 Ų | 50 | 93.2 Ų | 93.2 | 52% | 0.515 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -75.7 | -28 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | L463 L464 K465 S469 | L463-G467 PolarHBondContact O-N 3.27Å; L464-G467 WeakPolarHBondContact O-CA 3.45Å; L464-G467 PolarHBondContact O-N 3.07Å; K465-G467 VanDerWaalsContact C-N 3.34Å; G467-S469 PolarHBondContact O-N 2.88Å |
| 468 | D | 49.2 | Very low | 59.8 | Low | 138 Ų | 138 | 95.1 Ų | 95.1 | 74% | 0.738 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.8 | -1.4 | 178.2 | -70.5 | -28.2 | 0 | 0 | 0 | 113.8 | L464 | L464-D468 PolarHBondContact O-N 3.25Š|
| 469 | S | 39.4 | Very low | 56.9 | Low | 79 Ų | 79 | 102.6 Ų | 102.6 | 55% | 0.552 | 58% | 0.577 | S | S | * | * | S | Bend | trans | -72.7 | 117 | 165.4 | -64.1 | 0 | 0 | 0 | 0 | 108.7 | G467 L471 | G467-S469 PolarHBondContact O-N 2.88Å; S469-L471 PolarHBondContact O-N 3.36Å |
| 470 | P | 36.7 | Very low | 54.3 | Low | 113 Ų | 113 | 117.1 Ų | 117.1 | 73% | 0.734 | 63% | 0.631 | S | S | * | * | trans | -66 | 110 | -162.3 | 23.6 | -33.9 | 0 | 0 | 0 | 112.7 | ||||
| 471 | L | 40.3 | Very low | 52.4 | Low | 139 Ų | 139 | 119 Ų | 119 | 73% | 0.728 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -54.2 | 137.2 | 146.8 | -83.5 | 103.3 | 0 | 0 | 0 | 107.8 | S469 | S469-L471 PolarHBondContact O-N 3.36Š|
| 472 | F | 39.5 | Very low | 50.3 | Low | 180 Ų | 180 | 123.6 Ų | 123.6 | 79% | 0.789 | 67% | 0.667 | S | S | * | * | trans | 74.1 | 72.5 | -171.3 | -53 | -81.2 | 0 | 0 | 0 | 115.9 | ||||
| 473 | S | 30.1 | Very low | 48.1 | Very low | 110 Ų | 110 | 127.9 Ų | 127.9 | 77% | 0.769 | 69% | 0.692 | S | S | * | * | trans | -88.2 | 123 | 135.1 | -171.5 | 0 | 0 | 0 | 0 | 108.3 | S475 | S473-S475 PolarHBondContact O-N 3.22Š| ||
| 474 | N | 31.3 | Very low | 45.8 | Very low | 123 Ų | 123 | 132.8 Ų | 132.8 | 66% | 0.658 | 72% | 0.718 | S | S | * | * | trans | -69.9 | 107.8 | -176.2 | -77.5 | -36.9 | 0 | 0 | 0 | 111.7 | T476 | N474-T476 PolarHBondContact O-N 2.99Š| ||
| 475 | S | 34.6 | Very low | 43.1 | Very low | 125 Ų | 125 | 133.3 Ų | 133.3 | 87% | 0.874 | 72% | 0.722 | S | S | * | * | trans | -76.6 | 67 | 165.5 | -63.6 | 0 | 0 | 0 | 0 | 111.4 | S473 | S473-S475 PolarHBondContact O-N 3.22Š| ||
| 476 | T | 41.1 | Very low | 40.2 | Very low | 116 Ų | 116 | 133.9 Ų | 133.9 | 71% | 0.712 | 74% | 0.735 | S | S | * | * | trans | -136.6 | 39.7 | 175.2 | 25 | 0 | 0 | 0 | 0 | 113.4 | N474 | N474-T476 PolarHBondContact O-N 2.99Š| ||
| 477 | T | 33 | Very low | 38.3 | Very low | 111 Ų | 111 | 139.9 Ų | 139.9 | 68% | 0.681 | 76% | 0.762 | S | S | * | * | trans | -163.5 | 135.8 | 163.5 | 8.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 478 | F | 31.6 | Very low | 36.7 | Very low | 189 Ų | 189 | 146.8 Ų | 146.8 | 83% | 0.829 | 78% | 0.781 | S | S | * | * | cis | -133.3 | 141.4 | 12.3 | -94.8 | -95.3 | 0 | 0 | 0 | 112.2 | ||||
| 479 | L | 34.9 | Very low | 35.7 | Very low | 176 Ų | 176 | 147.6 Ų | 147.6 | 92% | 0.921 | 79% | 0.785 | S | S | * | * | trans | -93.9 | 112.6 | 144 | -98.5 | 165.4 | 0 | 0 | 0 | 107.3 | ||||
| 480 | R | 35.4 | Very low | 35.3 | Very low | 310 Ų | 310 | 153.8 Ų | 153.8 | 100% | 1.17 | 81% | 0.806 | S | S | * | * | trans | -163.4 | 0 | 140.1 | -146.2 | 173.4 | -169.5 | 164.3 | 4.4 | 112 |
Retrieved 480 of 480 residues in 266.9 ms
(Link to these results)