| 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 | 56.5 | Low | 53.4 | Low | 234 Ų | 234 | 149.8 Ų | 149.8 | 100% | 1.153 | 85% | 0.852 | S | S | * | * | 0 | 95.6 | 0 | -60.2 | -162 | -148.2 | 0 | 0 | 106.8 | |||||
| 2 | L | 48.8 | Very low | 52.8 | Low | 164 Ų | 164 | 146.7 Ų | 146.7 | 86% | 0.859 | 85% | 0.846 | S | S | * | * | trans | -82 | 126.1 | 173.3 | -90.3 | 77.4 | 0 | 0 | 0 | 107 | ||||
| 3 | V | 63.3 | Low | 52 | Low | 138 Ų | 138 | 140.8 Ų | 140.8 | 84% | 0.836 | 84% | 0.838 | S | S | * | * | trans | -108.9 | 103 | 177.8 | -132.8 | 0 | 0 | 0 | 0 | 106.7 | N5 | V3-N5 PolarHBondContact O-N 3.15Š| ||
| 4 | D | 52.9 | Low | 51.7 | Low | 149 Ų | 149 | 143.3 Ų | 143.3 | 80% | 0.797 | 84% | 0.843 | S | S | * | * | trans | -71.9 | 113.8 | 174.2 | -63.8 | -46.6 | 0 | 0 | 0 | 109 | ||||
| 5 | N | 52.7 | Low | 51.3 | Low | 161 Ų | 161 | 142.7 Ų | 142.7 | 86% | 0.861 | 85% | 0.849 | S | S | * | * | trans | -105 | 89.6 | 175.8 | -166.7 | 46 | 0 | 0 | 0 | 108.9 | V3 | V3-N5 PolarHBondContact O-N 3.15Š| ||
| 6 | A | 50.8 | Low | 51.4 | Low | 84 Ų | 84 | 137 Ų | 137 | 69% | 0.694 | 83% | 0.83 | S | S | * | * | trans | -128.6 | 94.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 7 | L | 52.7 | Low | 51.5 | Low | 168 Ų | 168 | 139.2 Ų | 139.2 | 88% | 0.88 | 84% | 0.836 | S | S | * | * | trans | -149.2 | 93 | 160.1 | -86.6 | 121.1 | 0 | 0 | 0 | 108.4 | ||||
| 8 | S | 54 | Low | 51.7 | Low | 114 Ų | 114 | 139.2 Ų | 139.2 | 80% | 0.797 | 84% | 0.836 | S | S | * | * | trans | -95.8 | 133.4 | 161.6 | -18.3 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 9 | P | 56.1 | Low | 52.7 | Low | 123 Ų | 123 | 141.1 Ų | 141.1 | 80% | 0.799 | 84% | 0.835 | S | S | * | * | trans | -75.3 | 131.5 | -178.3 | 29.9 | -31 | 0 | 0 | 0 | 110.6 | M11 | P9-M11 PolarHBondContact O-N 2.92Š| ||
| 10 | T | 47.3 | Very low | 53.6 | Low | 129 Ų | 129 | 142.9 Ų | 142.9 | 79% | 0.791 | 84% | 0.835 | S | S | * | * | trans | -72.6 | 114.7 | 171.4 | 44 | 0 | 0 | 0 | 0 | 109.7 | S12 | T10-S12 PolarHBondContact O-N 2.66Š| ||
| 11 | M | 52.2 | Low | 54.4 | Low | 184 Ų | 184 | 143.4 Ų | 143.4 | 91% | 0.906 | 83% | 0.833 | S | S | * | * | trans | -83.4 | 90.6 | 167.4 | -74.4 | -68.2 | -67.4 | 0 | 0 | 108.7 | P9 | P9-M11 PolarHBondContact O-N 2.92Š| ||
| 12 | S | 46 | Very low | 55.4 | Low | 112 Ų | 112 | 137.4 Ų | 137.4 | 78% | 0.783 | 81% | 0.811 | S | S | * | * | trans | -80.8 | 134.7 | 165.1 | 40.2 | 0 | 0 | 0 | 0 | 110 | T10 | T10-S12 PolarHBondContact O-N 2.66Š| ||
| 13 | G | 42.6 | Very low | 56.6 | Low | 71 Ų | 71 | 134.4 Ų | 134.4 | 73% | 0.732 | 81% | 0.81 | S | S | * | * | trans | 111.4 | 54.2 | 154.6 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 14 | L | 48.6 | Very low | 57.4 | Low | 175 Ų | 175 | 137.4 Ų | 137.4 | 92% | 0.916 | 81% | 0.812 | S | S | * | * | trans | -135.2 | 82.8 | 152.1 | -71 | 175.7 | 0 | 0 | 0 | 108.6 | G16 | L14-G16 VanDerWaalsContact C-N 3.3Å; L14-G16 PolarHBondContact O-N 3.06Å; L14-G16 VanDerWaalsContact O-N 3.15Å | ||
| 15 | S | 44.4 | Very low | 58.7 | Low | 134 Ų | 134 | 138.3 Ų | 138.3 | 94% | 0.937 | 81% | 0.811 | S | S | * | * | trans | -80.2 | 82.1 | 167.8 | -169.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 16 | G | 52.9 | Low | 59.7 | Low | 52 Ų | 52 | 135.8 Ų | 135.8 | 54% | 0.536 | 80% | 0.804 | S | S | . | * | trans | -111.5 | 136.7 | 158.9 | 0 | 0 | 0 | 0 | 0 | 107.3 | L14 V18 | L14-G16 VanDerWaalsContact C-N 3.3Å; L14-G16 PolarHBondContact O-N 3.06Å; L14-G16 VanDerWaalsContact O-N 3.15Å; G16-V18 PolarHBondContact O-N 2.75Å | ||
| 17 | D | 54.4 | Low | 61 | Low | 174 Ų | 174 | 136.6 Ų | 136.6 | 93% | 0.93 | 80% | 0.796 | S | S | * | * | trans | -53.3 | 104.9 | 175.2 | -72.9 | -57.2 | 0 | 0 | 0 | 109.8 | E19 | D17-E19 PolarHBondContact O-N 2.71Š| ||
| 18 | V | 55.4 | Low | 61.9 | Low | 139 Ų | 139 | 135.3 Ų | 135.3 | 84% | 0.842 | 79% | 0.789 | S | S | * | * | trans | -87.1 | 92.5 | 173.3 | 179 | 0 | 0 | 0 | 0 | 106.8 | G16 E20 | G16-V18 PolarHBondContact O-N 2.75Å; V18-E20 PolarHBondContact O-N 3.28Å | ||
| 19 | E | 69.9 | Low | 63.2 | Low | 176 Ų | 176 | 133.9 Ų | 133.9 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | trans | -78 | 111.8 | 165.8 | -162.9 | 172.9 | -168.8 | 0 | 0 | 108.2 | D17 I21 | D17-E19 PolarHBondContact O-N 2.71Å; E19-I21 PolarHBondContact O-N 3.01Å; E19-I21 VanDerWaalsContact O-N 3.1Å | ||
| 20 | E | 70.4 | Confident | 64.4 | Low | 176 Ų | 176 | 130 Ų | 130 | 82% | 0.822 | 76% | 0.758 | S | S | * | * | trans | -70.5 | 103.4 | 178.4 | -172.7 | 174 | -176.5 | 0 | 0 | 109.4 | V18 P22 | V18-E20 PolarHBondContact O-N 3.28Å; E20-P22 VanDerWaalsContact O-CD 3.27Å; E20-P22 WeakPolarHBondContact O-CD 3.42Å | ||
| 21 | I | 71 | Confident | 65.8 | Low | 154 Ų | 154 | 131.4 Ų | 131.4 | 79% | 0.79 | 76% | 0.755 | S | S | * | * | trans | -73.5 | 115 | 176.6 | -54.2 | 173.8 | 0 | 0 | 0 | 108.1 | E19 A23 | E19-I21 PolarHBondContact O-N 3.01Å; E19-I21 VanDerWaalsContact O-N 3.1Å; I21-A23 PolarHBondContact O-N 2.77Å | ||
| 22 | P | 76.9 | Confident | 66.9 | Low | 108 Ų | 108 | 126.4 Ų | 126.4 | 70% | 0.701 | 74% | 0.737 | S | S | * | * | trans | -63.6 | 135.3 | 179.2 | 25.5 | -33.1 | 0 | 0 | 0 | 110.1 | E20 K24 | E20-P22 VanDerWaalsContact O-CD 3.27Å; E20-P22 WeakPolarHBondContact O-CD 3.42Å; P22-K24 PolarHBondContact O-N 3.46Å | ||
| 23 | A | 73.8 | Confident | 68.4 | Low | 101 Ų | 101 | 127.9 Ų | 127.9 | 84% | 0.835 | 74% | 0.741 | S | S | * | * | trans | -58.7 | 108.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | I21 E25 | I21-A23 PolarHBondContact O-N 2.77Å; A23-E25 PolarHBondContact O-N 2.77Å | ||
| 24 | K | 79.7 | Confident | 70.1 | Confident | 201 Ų | 201 | 133 Ų | 133 | 87% | 0.874 | 74% | 0.743 | S | S | * | * | trans | -74.8 | 112.7 | 174.8 | -172.5 | 66.5 | 176.5 | -179.2 | 0 | 109 | P22 | P22-K24 PolarHBondContact O-N 3.46Š| ||
| 25 | E | 80.3 | Confident | 71.4 | Confident | 169 Ų | 169 | 130.5 Ų | 130.5 | 79% | 0.79 | 74% | 0.74 | S | S | * | * | trans | -58.1 | 137 | 176.2 | -65.5 | -174.6 | 171.3 | 0 | 0 | 111.2 | A23 D27 | A23-E25 PolarHBondContact O-N 2.77Å; E25-D27 PolarHBondContact O-N 3.3Å | ||
| 26 | P | 74.9 | Confident | 72.5 | Confident | 107 Ų | 107 | 128.6 Ų | 128.6 | 70% | 0.695 | 73% | 0.733 | S | S | * | * | trans | -70.1 | 124.2 | 179.7 | 28 | -32.9 | 0 | 0 | 0 | 110.5 | L28 | P26-L28 PolarHBondContact O-N 2.9Š| ||
| 27 | D | 76.9 | Confident | 72.9 | Confident | 101 Ų | 101 | 134.5 Ų | 134.5 | 54% | 0.54 | 75% | 0.751 | S | S | . | * | trans | -65.4 | 108.6 | 172.2 | 178.7 | 8.6 | 0 | 0 | 0 | 110.1 | E25 S29 A30 | E25-D27 PolarHBondContact O-N 3.3Å; D27-S29 PolarHBondContact O-N 3.48Å; D27-S29 WeakPolarHBondContact OD1-CB 3.27Å; D27-S29 PolarHBondContact OD1-N 3.42Å; D27-S29 PolarHBondContact OD1-OG 3.33Å; D27-S29 PolarHBondContact OD2-OG 3.22Å; D27-A30 HydrophobicContact CB-CB 4.36Å | ||
| 28 | L | 71.7 | Confident | 73.2 | Confident | 141 Ų | 141 | 137.1 Ų | 137.1 | 74% | 0.738 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.1 | -20.1 | -178.8 | -61.1 | -179.8 | 0 | 0 | 0 | 112.5 | P26 R186 | P26-L28 PolarHBondContact O-N 2.9Å; L28-R186 PolarHBondContact O-NH2 3.49Å; L28-R186 VanDerWaalsContact O-NH2 3.16Å |
| 29 | S | 81.5 | Confident | 73.7 | Confident | 85 Ų | 85 | 140.8 Ų | 140.8 | 59% | 0.594 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.9 | -11.7 | -175.3 | 75.4 | 0 | 0 | 0 | 0 | 114.6 | D27 Q31 | D27-S29 PolarHBondContact O-N 3.48Å; D27-S29 WeakPolarHBondContact OD1-CB 3.27Å; D27-S29 PolarHBondContact OD1-N 3.42Å; D27-S29 PolarHBondContact OD1-OG 3.33Å; D27-S29 PolarHBondContact OD2-OG 3.22Å; S29-Q31 PolarHBondContact O-N 2.9Å |
| 30 | A | 81.4 | Confident | 72.9 | Confident | 41 Ų | 41 | 143.4 Ų | 143.4 | 34% | 0.339 | 75% | 0.749 | S | S | . | * | P | Polyproline II helix | trans | -60.9 | 126.6 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113 | D27 | D27-A30 HydrophobicContact CB-CB 4.36Š|
| 31 | Q | 77.7 | Confident | 71.9 | Confident | 158 Ų | 158 | 139.3 Ų | 139.3 | 74% | 0.738 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -97.7 | 147.7 | 174.7 | -63.6 | -63.5 | -33.5 | 0 | 0 | 110.7 | S29 T33 | S29-Q31 PolarHBondContact O-N 2.9Å; Q31-T33 PolarHBondContact O-N 3.03Å |
| 32 | P | 74.2 | Confident | 71 | Confident | 80 Ų | 80 | 136.4 Ų | 136.4 | 52% | 0.519 | 74% | 0.735 | S | S | . | * | P | Polyproline II helix | trans | -65 | 128.7 | -179.9 | 25.9 | -32.9 | 0 | 0 | 0 | 111.4 | K34 | P32-K34 VanDerWaalsContact C-N 3.29Å; P32-K34 PolarHBondContact O-N 3.16Å |
| 33 | T | 78.3 | Confident | 69.6 | Low | 143 Ų | 143 | 139.4 Ų | 139.4 | 88% | 0.877 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -74.3 | -17.7 | 179.9 | 54.6 | 0 | 0 | 0 | 0 | 113.7 | Q31 | Q31-T33 PolarHBondContact O-N 3.03Š|
| 34 | K | 77.7 | Confident | 68.3 | Low | 178 Ų | 178 | 139 Ų | 139 | 77% | 0.774 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -115.7 | 126.3 | 176.4 | -64.5 | -178.5 | -178.8 | 176.5 | 0 | 109.5 | P32 A36 | P32-K34 VanDerWaalsContact C-N 3.29Å; P32-K34 PolarHBondContact O-N 3.16Å; K34-A36 PolarHBondContact O-N 3.43Å |
| 35 | S | 76.4 | Confident | 66.6 | Low | 122 Ų | 122 | 136.8 Ų | 136.8 | 85% | 0.853 | 73% | 0.732 | S | S | * | * | trans | -59.8 | 123.1 | 174.7 | -53 | 0 | 0 | 0 | 0 | 109.9 | L37 | S35-L37 PolarHBondContact O-N 3.11Š| ||
| 36 | A | 67.4 | Low | 64.9 | Low | 95 Ų | 95 | 135.5 Ų | 135.5 | 79% | 0.785 | 73% | 0.73 | S | S | * | * | trans | -66.4 | 121 | 168.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | K34 R38 | K34-A36 PolarHBondContact O-N 3.43Å; A36-R38 PolarHBondContact O-N 3.13Å | ||
| 37 | L | 60.8 | Low | 63.5 | Low | 175 Ų | 175 | 136.5 Ų | 136.5 | 92% | 0.916 | 73% | 0.734 | S | S | * | * | trans | -64.1 | 98.4 | 179.9 | -149.9 | 78.1 | 0 | 0 | 0 | 109.4 | S35 R39 | S35-L37 PolarHBondContact O-N 3.11Å; L37-R39 PolarHBondContact O-N 3.17Å | ||
| 38 | R | 60.9 | Low | 62.2 | Low | 229 Ų | 229 | 137.5 Ų | 137.5 | 86% | 0.864 | 74% | 0.744 | S | S | * | * | trans | -84.9 | 93.1 | 177.7 | -167.4 | 174.2 | 168.5 | -173.7 | -4.2 | 108.4 | A36 R40 | A36-R38 PolarHBondContact O-N 3.13Å; R38-R40 PolarHBondContact O-N 3.34Å; R38-R40 VanDerWaalsContact O-N 3.16Å | ||
| 39 | R | 65.1 | Low | 60.6 | Low | 216 Ų | 216 | 138.2 Ų | 138.2 | 82% | 0.815 | 75% | 0.748 | S | S | * | * | trans | -66.7 | 112.1 | 167.6 | -169.9 | -178.6 | -66.2 | 174.3 | -0.5 | 107.9 | L37 V41 | L37-R39 PolarHBondContact O-N 3.17Å; R39-V41 HydrophobicContact CG-CG2 4.42Å; R39-V41 PolarHBondContact O-N 2.94Å; R39-V41 VanDerWaalsContact O-N 3.13Å | ||
| 40 | R | 54.6 | Low | 59 | Low | 232 Ų | 232 | 138.8 Ų | 138.8 | 88% | 0.875 | 76% | 0.758 | S | S | * | * | trans | -68.9 | 104 | 164 | -66 | 175.7 | 76.1 | 143.5 | 0 | 106 | R38 A42 | R38-R40 PolarHBondContact O-N 3.34Å; R38-R40 VanDerWaalsContact O-N 3.16Å; R40-A42 PolarHBondContact O-N 3.08Å | ||
| 41 | V | 49.7 | Very low | 57 | Low | 90 Ų | 90 | 140.2 Ų | 140.2 | 55% | 0.545 | 78% | 0.777 | S | S | . | * | trans | -80.5 | 99.1 | 165.7 | -172.4 | 0 | 0 | 0 | 0 | 105.2 | R39 F43 | R39-V41 HydrophobicContact CG-CG2 4.42Å; R39-V41 PolarHBondContact O-N 2.94Å; R39-V41 VanDerWaalsContact O-N 3.13Å; V41-F43 HydrophobicContact CB-CE2 4.18Å; V41-F43 HydrophobicContact CB-CZ 4.44Å; V41-F43 HydrophobicContact CG1-CD1 4.27Å; V41-F43 HydrophobicContact CG1-CD2 4.12Å; V41-F43 HydrophobicContact CG1-CE1 3.95Å; V41-F43 HydrophobicContact CG1-CE2 3.79Å; V41-F43 HydrophobicContact CG1-CG 4.35Å; V41-F43 HydrophobicContact CG1-CZ 3.7Å; V41-F43 PolarHBondContact O-N 3.38Å | ||
| 42 | A | 51.3 | Low | 55.3 | Low | 93 Ų | 93 | 140.1 Ų | 140.1 | 77% | 0.769 | 78% | 0.782 | S | S | * | * | trans | -73 | 106 | 161.4 | 0 | 0 | 0 | 0 | 0 | 105.7 | R40 A44 | R40-A42 PolarHBondContact O-N 3.08Å; A42-A44 PolarHBondContact O-N 3Å | ||
| 43 | F | 46.6 | Very low | 53.9 | Low | 170 Ų | 170 | 143.2 Ų | 143.2 | 75% | 0.746 | 79% | 0.789 | S | S | * | * | trans | -72.3 | 108.4 | 161.9 | -67.2 | -79.6 | 0 | 0 | 0 | 105.4 | V41 D45 | V41-F43 HydrophobicContact CB-CE2 4.18Å; V41-F43 HydrophobicContact CB-CZ 4.44Å; V41-F43 HydrophobicContact CG1-CD1 4.27Å; V41-F43 HydrophobicContact CG1-CD2 4.12Å; V41-F43 HydrophobicContact CG1-CE1 3.95Å; V41-F43 HydrophobicContact CG1-CE2 3.79Å; V41-F43 HydrophobicContact CG1-CG 4.35Å; V41-F43 HydrophobicContact CG1-CZ 3.7Å; V41-F43 PolarHBondContact O-N 3.38Å; F43-D45 PolarHBondContact O-N 3.39Å | ||
| 44 | A | 47.8 | Very low | 52.2 | Low | 94 Ų | 94 | 143.5 Ų | 143.5 | 78% | 0.777 | 78% | 0.781 | S | S | * | * | trans | -69.7 | 112.7 | 163.1 | 0 | 0 | 0 | 0 | 0 | 106.4 | A42 D46 | A42-A44 PolarHBondContact O-N 3Å; A44-D46 PolarHBondContact O-N 3.3Å | ||
| 45 | D | 43.9 | Very low | 50.7 | Low | 154 Ų | 154 | 140.1 Ų | 140.1 | 82% | 0.824 | 78% | 0.779 | S | S | * | * | trans | -64.4 | 103.7 | 157.7 | -85 | -36.8 | 0 | 0 | 0 | 106.5 | F43 | F43-D45 PolarHBondContact O-N 3.39Š| ||
| 46 | D | 44.2 | Very low | 49.2 | Very low | 141 Ų | 141 | 145.8 Ų | 145.8 | 75% | 0.754 | 78% | 0.782 | S | S | * | * | trans | -102.7 | 94.9 | 165.3 | -146.2 | 10.9 | 0 | 0 | 0 | 106.7 | A44 V48 | A44-D46 PolarHBondContact O-N 3.3Å; D46-V48 PolarHBondContact O-N 2.64Å | ||
| 47 | V | 44.7 | Very low | 48.1 | Very low | 128 Ų | 128 | 146.4 Ų | 146.4 | 78% | 0.776 | 78% | 0.78 | S | S | * | * | trans | -78.7 | 101 | 170.3 | 174.7 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 48 | V | 49.8 | Very low | 47.2 | Very low | 123 Ų | 123 | 143.2 Ų | 143.2 | 75% | 0.745 | 77% | 0.773 | S | S | * | * | trans | -103.7 | 104.1 | 166.2 | -81.1 | 0 | 0 | 0 | 0 | 109.2 | D46 | D46-V48 PolarHBondContact O-N 2.64Š| ||
| 49 | D | 39.4 | Very low | 46.5 | Very low | 155 Ų | 155 | 139.1 Ų | 139.1 | 83% | 0.829 | 77% | 0.773 | S | S | * | * | trans | -72.3 | 120.6 | 165.1 | -179.9 | 36.6 | 0 | 0 | 0 | 109.1 | ||||
| 50 | A | 48.1 | Very low | 45.3 | Very low | 97 Ų | 97 | 132.4 Ų | 132.4 | 80% | 0.802 | 77% | 0.771 | S | S | * | * | trans | -152.2 | 111.3 | 166.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 51 | G | 38.8 | Very low | 44.8 | Very low | 71 Ų | 71 | 126.2 Ų | 126.2 | 73% | 0.732 | 77% | 0.77 | S | S | * | * | trans | -79 | 179.3 | -171.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 52 | D | 42.5 | Very low | 44.7 | Very low | 157 Ų | 157 | 130.2 Ų | 130.2 | 84% | 0.84 | 78% | 0.782 | S | S | * | * | trans | 66 | 107.3 | 151.4 | -94.3 | -6 | 0 | 0 | 0 | 119.6 | ||||
| 53 | E | 43.5 | Very low | 44.3 | Very low | 145 Ų | 145 | 131.4 Ų | 131.4 | 68% | 0.678 | 78% | 0.775 | S | S | * | * | 163.1 | 121.5 | 99.9 | -81 | -127.3 | 118.6 | 0 | 0 | 112.8 | |||||
| 54 | Q | 44.3 | Very low | 44 | Very low | 149 Ų | 149 | 130.8 Ų | 130.8 | 70% | 0.696 | 78% | 0.777 | S | S | * | * | trans | 63.3 | 107.5 | 136.9 | -54.7 | -170.8 | 26 | 0 | 0 | 121.7 | ||||
| 55 | S | 44.7 | Very low | 43.7 | Very low | 107 Ų | 107 | 130.8 Ų | 130.8 | 75% | 0.748 | 77% | 0.772 | S | S | * | * | 69.1 | 101.2 | 122.5 | -55.8 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 56 | R | 45.4 | Very low | 43.8 | Very low | 241 Ų | 241 | 131.4 Ų | 131.4 | 91% | 0.909 | 77% | 0.77 | S | S | * | * | -175.7 | 97.9 | 125.4 | -102.2 | 166.6 | 159.8 | -171.4 | -5.9 | 114.4 | |||||
| 57 | S | 44.4 | Very low | 43.7 | Very low | 107 Ų | 107 | 131.9 Ų | 131.9 | 75% | 0.748 | 77% | 0.77 | S | S | * | * | trans | 28.2 | 124.1 | 134.1 | 71.6 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 58 | S | 42.8 | Very low | 43.5 | Very low | 108 Ų | 108 | 130.8 Ų | 130.8 | 76% | 0.755 | 77% | 0.769 | S | S | * | * | 112.5 | 121.7 | 115.1 | -137.2 | 0 | 0 | 0 | 0 | 118.7 | |||||
| 59 | V | 46 | Very low | 43.2 | Very low | 143 Ų | 143 | 132 Ų | 132 | 87% | 0.867 | 77% | 0.769 | S | S | * | * | trans | 83.4 | 101.3 | 153.2 | -148.5 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 60 | G | 38.6 | Very low | 43.5 | Very low | 75 Ų | 75 | 128.7 Ų | 128.7 | 77% | 0.773 | 76% | 0.764 | S | S | * | * | trans | 126.1 | 78.8 | 132.7 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 61 | A | 45.2 | Very low | 43.2 | Very low | 103 Ų | 103 | 133.4 Ų | 133.4 | 85% | 0.851 | 77% | 0.769 | S | S | * | * | trans | -168.5 | 86.8 | 148.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 62 | Q | 47.8 | Very low | 43.6 | Very low | 174 Ų | 174 | 134.6 Ų | 134.6 | 81% | 0.813 | 77% | 0.767 | S | S | * | * | trans | -83.4 | 111.7 | 173.1 | -150.1 | 81.9 | 7.8 | 0 | 0 | 108.6 | ||||
| 63 | I | 41 | Very low | 43.8 | Very low | 118 Ų | 118 | 136 Ų | 136 | 61% | 0.605 | 77% | 0.768 | S | S | * | * | trans | 60.3 | 105.1 | 136.3 | -51.9 | 174.1 | 0 | 0 | 0 | 118.1 | ||||
| 64 | I | 42.3 | Very low | 44.2 | Very low | 157 Ų | 157 | 139.5 Ų | 139.5 | 81% | 0.805 | 78% | 0.775 | S | S | * | * | trans | -123.1 | 91.5 | 138 | -62.9 | 177.3 | 0 | 0 | 0 | 106 | Q66 | I64-Q66 PolarHBondContact O-N 3.21Å; I64-Q66 PolarHBondContact O-NE2 2.99Å | ||
| 65 | S | 41.4 | Very low | 44.5 | Very low | 94 Ų | 94 | 139.8 Ų | 139.8 | 66% | 0.657 | 78% | 0.781 | S | S | * | * | trans | -74.5 | 122.4 | 171.8 | -70.4 | 0 | 0 | 0 | 0 | 109.3 | I67 | S65-I67 PolarHBondContact O-N 3.37Š| ||
| 66 | Q | 45 | Very low | 45.2 | Very low | 166 Ų | 166 | 142.7 Ų | 142.7 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | trans | -58.9 | 121.1 | 164.4 | -15 | -91 | -61.4 | 0 | 0 | 107.5 | I64 | I64-Q66 PolarHBondContact O-N 3.21Å; I64-Q66 PolarHBondContact O-NE2 2.99Å | ||
| 67 | I | 41.9 | Very low | 45.7 | Very low | 151 Ų | 151 | 139 Ų | 139 | 77% | 0.774 | 78% | 0.781 | S | S | * | * | trans | -93.6 | 101 | 158.8 | -129.4 | 81.5 | 0 | 0 | 0 | 105.3 | S65 I69 | S65-I67 PolarHBondContact O-N 3.37Å; I67-I69 HydrophobicContact CG1-CG1 4.48Å; I67-I69 HydrophobicContact CG2-CG1 4.43Å | ||
| 68 | S | 41 | Very low | 46.6 | Very low | 106 Ų | 106 | 141.2 Ų | 141.2 | 74% | 0.741 | 79% | 0.785 | S | S | * | * | trans | -109.4 | 100.1 | 161.9 | 38.6 | 0 | 0 | 0 | 0 | 105 | A70 | S68-A70 PolarHBondContact O-N 3.49Š| ||
| 69 | I | 43.4 | Very low | 47.6 | Very low | 147 Ų | 147 | 145.4 Ų | 145.4 | 75% | 0.754 | 79% | 0.792 | S | S | * | * | trans | -74.2 | 103 | 175.3 | -63.1 | 171.6 | 0 | 0 | 0 | 105.5 | I67 | I67-I69 HydrophobicContact CG1-CG1 4.48Å; I67-I69 HydrophobicContact CG2-CG1 4.43Å | ||
| 70 | A | 44.6 | Very low | 48.4 | Very low | 87 Ų | 87 | 146.6 Ų | 146.6 | 72% | 0.719 | 79% | 0.794 | S | S | * | * | trans | -76.8 | 124.9 | 167.7 | 0 | 0 | 0 | 0 | 0 | 107.9 | S68 S72 | S68-A70 PolarHBondContact O-N 3.49Å; A70-S72 PolarHBondContact O-N 3.3Å | ||
| 71 | E | 42.3 | Very low | 49.9 | Very low | 196 Ų | 196 | 145.4 Ų | 145.4 | 92% | 0.916 | 78% | 0.782 | S | S | * | * | trans | -62.5 | 116.3 | 172.2 | -62.6 | 171.5 | 142.1 | 0 | 0 | 108.4 | ||||
| 72 | S | 48.3 | Very low | 51 | Low | 96 Ų | 96 | 146.4 Ų | 146.4 | 67% | 0.671 | 78% | 0.78 | S | S | * | * | trans | -131.7 | 110.7 | 164.2 | 67.1 | 0 | 0 | 0 | 0 | 108.1 | A70 | A70-S72 PolarHBondContact O-N 3.3Š| ||
| 73 | E | 45.2 | Very low | 51.4 | Low | 187 Ų | 187 | 144.7 Ų | 144.7 | 87% | 0.874 | 78% | 0.781 | S | S | * | * | trans | -49.1 | 130.4 | 173.2 | -57.4 | 174.6 | 162.3 | 0 | 0 | 111 | ||||
| 74 | R | 52.9 | Low | 52.4 | Low | 217 Ų | 217 | 144.4 Ų | 144.4 | 82% | 0.819 | 79% | 0.785 | S | S | * | * | trans | -155.4 | 100.4 | 159.5 | -115.8 | -177.2 | -80.4 | -157.4 | -1.3 | 108.1 | ||||
| 75 | D | 49.9 | Very low | 53 | Low | 155 Ų | 155 | 148.2 Ų | 148.2 | 83% | 0.829 | 79% | 0.79 | S | S | * | * | trans | -69.9 | 117.8 | 169.5 | -57.9 | -59.9 | 0 | 0 | 0 | 109.2 | ||||
| 76 | E | 59.3 | Low | 53.7 | Low | 169 Ų | 169 | 154.8 Ų | 154.8 | 79% | 0.79 | 80% | 0.801 | S | S | * | * | trans | -135.7 | 105.2 | 157.5 | -70.1 | -171.3 | -179.5 | 0 | 0 | 107.3 | D78 | E76-D78 PolarHBondContact O-N 3.44Š| ||
| 77 | D | 56.2 | Low | 53.7 | Low | 163 Ų | 163 | 152.7 Ų | 152.7 | 87% | 0.872 | 81% | 0.805 | S | S | * | * | trans | -60.4 | 119.6 | 170.3 | -82.6 | -51.9 | 0 | 0 | 0 | 110.2 | ||||
| 78 | D | 63.4 | Low | 54.1 | Low | 153 Ų | 153 | 150.7 Ų | 150.7 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -136.8 | 104.6 | 159.7 | -82.3 | -49.5 | 0 | 0 | 0 | 109.8 | E76 D80 | E76-D78 PolarHBondContact O-N 3.44Å; D78-D80 PolarHBondContact O-N 3.31Å | ||
| 79 | E | 63.1 | Low | 54.7 | Low | 196 Ų | 196 | 150.5 Ų | 150.5 | 92% | 0.916 | 80% | 0.803 | S | S | * | * | trans | -82.5 | 89.9 | -176.4 | -175.5 | 168.6 | 172.1 | 0 | 0 | 110.9 | G81 | E79-G81 PolarHBondContact O-N 3.04Š| ||
| 80 | D | 64.6 | Low | 55.1 | Low | 169 Ų | 169 | 150.9 Ų | 150.9 | 90% | 0.904 | 81% | 0.807 | S | S | * | * | trans | -90.2 | 94.3 | 172.6 | -109.3 | -22.5 | 0 | 0 | 0 | 110.7 | D78 | D78-D80 PolarHBondContact O-N 3.31Š| ||
| 81 | G | 69.6 | Low | 55.5 | Low | 50 Ų | 50 | 155.3 Ų | 155.3 | 52% | 0.515 | 81% | 0.812 | S | S | . | * | trans | -71.9 | 154.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | E79 V83 | E79-G81 PolarHBondContact O-N 3.04Å; G81-V83 PolarHBondContact O-N 3.46Å | ||
| 82 | P | 68.3 | Low | 56.1 | Low | 124 Ų | 124 | 154.3 Ų | 154.3 | 81% | 0.805 | 81% | 0.808 | S | S | * | * | trans | -66.8 | 123.2 | -172.3 | 25.5 | -33.4 | 0 | 0 | 0 | 112.8 | T84 | P82-T84 PolarHBondContact O-N 3.35Š| ||
| 83 | V | 55.6 | Low | 56.2 | Low | 137 Ų | 137 | 157.8 Ų | 157.8 | 83% | 0.83 | 82% | 0.818 | S | S | * | * | trans | -63.8 | 106.3 | 174.7 | 179.7 | 0 | 0 | 0 | 0 | 109.9 | G81 Y85 | G81-V83 PolarHBondContact O-N 3.46Å; V83-Y85 PolarHBondContact O-N 2.81Å | ||
| 84 | T | 62.8 | Low | 56.7 | Low | 113 Ų | 113 | 156.4 Ų | 156.4 | 69% | 0.693 | 81% | 0.812 | S | S | * | * | trans | -74.4 | 120.2 | 173.2 | 60.4 | 0 | 0 | 0 | 0 | 110.2 | P82 R86 | P82-T84 PolarHBondContact O-N 3.35Å; T84-R86 PolarHBondContact O-N 2.84Å | ||
| 85 | Y | 55 | Low | 56.7 | Low | 236 Ų | 236 | 151.5 Ų | 151.5 | 93% | 0.925 | 81% | 0.808 | S | S | * | * | trans | -68 | 96 | 171.7 | -104.6 | -98.6 | 0 | 0 | 0 | 109.1 | V83 S87 | V83-Y85 PolarHBondContact O-N 2.81Å; Y85-S87 PolarHBondContact O-N 3.18Å | ||
| 86 | R | 56.1 | Low | 57.1 | Low | 232 Ų | 232 | 154.6 Ų | 154.6 | 88% | 0.875 | 81% | 0.809 | S | S | * | * | trans | -78.5 | 105.9 | 167.4 | -82.4 | -169.8 | 167.3 | -177.3 | -2.7 | 109.7 | T84 S88 | T84-R86 PolarHBondContact O-N 2.84Å; R86-S88 PolarHBondContact O-N 3.14Å | ||
| 87 | S | 44.9 | Very low | 56.9 | Low | 123 Ų | 123 | 153.8 Ų | 153.8 | 86% | 0.86 | 82% | 0.815 | S | S | * | * | trans | -69 | 109.8 | 160.4 | 177.5 | 0 | 0 | 0 | 0 | 109.1 | Y85 | Y85-S87 PolarHBondContact O-N 3.18Š| ||
| 88 | S | 50.6 | Low | 57 | Low | 109 Ų | 109 | 149.5 Ų | 149.5 | 76% | 0.762 | 79% | 0.791 | S | S | * | * | trans | -126.6 | 95.6 | 164 | -168.3 | 0 | 0 | 0 | 0 | 105.1 | R86 | R86-S88 PolarHBondContact O-N 3.14Š| ||
| 89 | S | 52.3 | Low | 57.2 | Low | 102 Ų | 102 | 146.8 Ų | 146.8 | 71% | 0.713 | 78% | 0.784 | S | S | * | * | 39.1 | 91.7 | 93.9 | -112.7 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 90 | D | 51.5 | Low | 57.4 | Low | 155 Ų | 155 | 140.1 Ų | 140.1 | 83% | 0.829 | 77% | 0.768 | S | S | * | * | 50.4 | 79.6 | 117.3 | -154.1 | 32.6 | 0 | 0 | 0 | 116.8 | |||||
| 91 | E | 54.5 | Low | 57.5 | Low | 180 Ų | 180 | 138.3 Ų | 138.3 | 84% | 0.841 | 76% | 0.757 | S | S | * | * | trans | -151.3 | 110.2 | 151.4 | -68.9 | -163.2 | 170.6 | 0 | 0 | 109.8 | ||||
| 92 | E | 53.4 | Low | 57.4 | Low | 175 Ų | 175 | 137.7 Ų | 137.7 | 82% | 0.818 | 75% | 0.748 | S | S | * | * | trans | 52 | 114.4 | 136.3 | -54.1 | -170.8 | 170.5 | 0 | 0 | 120.5 | E94 | E92-E94 PolarHBondContact O-N 3.3Š| ||
| 93 | D | 50.5 | Low | 57.2 | Low | 168 Ų | 168 | 134.3 Ų | 134.3 | 90% | 0.898 | 73% | 0.727 | S | S | * | * | trans | 0.8 | 72.5 | 144.8 | -64.5 | -49.6 | 0 | 0 | 0 | 118.6 | ||||
| 94 | E | 55.3 | Low | 57.6 | Low | 159 Ų | 159 | 135.4 Ų | 135.4 | 74% | 0.743 | 72% | 0.716 | S | S | * | * | trans | -135.5 | 129.7 | 158 | -87.8 | -66.3 | 150.7 | 0 | 0 | 109.2 | E92 R96 | E92-E94 PolarHBondContact O-N 3.3Å; E94-R96 VanDerWaalsContact C-N 3.29Å; E94-R96 PolarHBondContact O-N 2.72Å | ||
| 95 | P | 54.1 | Low | 57.7 | Low | 114 Ų | 114 | 135.4 Ų | 135.4 | 74% | 0.74 | 72% | 0.716 | S | S | * | * | trans | -68.3 | 89.3 | -179.9 | 29.2 | -34.1 | 0 | 0 | 0 | 109.2 | V97 | P95-V97 PolarHBondContact O-N 3.45Å; P95-V97 VanDerWaalsContact O-N 3.15Å | ||
| 96 | R | 57.2 | Low | 58 | Low | 220 Ų | 220 | 132.8 Ų | 132.8 | 83% | 0.83 | 71% | 0.706 | S | S | * | * | trans | -47.9 | 125.7 | 169.7 | -78 | -176.7 | 176.6 | -158.5 | -0 | 108.1 | E94 L98 | E94-R96 VanDerWaalsContact C-N 3.29Å; E94-R96 PolarHBondContact O-N 2.72Å; R96-L98 WeakPolarHBondContact O-CG 3.47Å; R96-L98 PolarHBondContact O-N 3.45Å | ||
| 97 | V | 56.8 | Low | 58.3 | Low | 151 Ų | 151 | 127.6 Ų | 127.6 | 92% | 0.915 | 69% | 0.686 | S | S | * | * | trans | -65.7 | 80 | 178.1 | -158.6 | 0 | 0 | 0 | 0 | 108.1 | P95 S99 | P95-V97 PolarHBondContact O-N 3.45Å; P95-V97 VanDerWaalsContact O-N 3.15Å; V97-S99 PolarHBondContact O-N 3.19Å | ||
| 98 | L | 58.4 | Low | 59.2 | Low | 74 Ų | 74 | 131.4 Ų | 131.4 | 39% | 0.387 | 69% | 0.687 | S | S | . | * | trans | -67.4 | 107.3 | -177.6 | -73.7 | 173.2 | 0 | 0 | 0 | 107.9 | R96 A102 S103 Y106 | R96-L98 WeakPolarHBondContact O-CG 3.47Å; R96-L98 PolarHBondContact O-N 3.45Å; L98-A102 HydrophobicContact CB-CB 4.2Å; L98-A102 HydrophobicContact CD2-CB 4.34Å; L98-S103 VanDerWaalsContact CB-OG 3.27Å; L98-S103 WeakPolarHBondContact CB-OG 3.5Å; L98-S103 WeakPolarHBondContact O-CB 3.26Å; L98-S103 PolarHBondContact O-OG 3.35Å; L98-Y106 HydrophobicContact CD1-CD2 3.91Å; L98-Y106 HydrophobicContact CD1-CE2 4.2Å | ||
| 99 | S | 67 | Low | 60 | Low | 96 Ų | 96 | 130.1 Ų | 130.1 | 67% | 0.671 | 67% | 0.672 | S | S | * | * | trans | -41.5 | 141.9 | 177 | -179.4 | 0 | 0 | 0 | 0 | 111.7 | V97 L101 A102 S103 | V97-S99 PolarHBondContact O-N 3.19Å; S99-L101 CarbonylContact O-C 3.48Å; S99-L101 PolarHBondContact O-N 2.87Å; S99-A102 WeakPolarHBondContact O-CB 3.4Å; S99-A102 PolarHBondContact O-N 2.98Å; S99-S103 PolarHBondContact O-N 3.34Å | ||
| 100 | G | 67.2 | Low | 60.8 | Low | 55 Ų | 55 | 129.1 Ų | 129.1 | 57% | 0.567 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.4 | -15.8 | -156.5 | 0 | 0 | 0 | 0 | 0 | 117.7 | R104 | G100-R104 VanDerWaalsContact O-CD 3.26Å; G100-R104 WeakPolarHBondContact O-CD 3.23Å; G100-R104 VanDerWaalsContact O-CG 3.28Å; G100-R104 WeakPolarHBondContact O-CG 3.46Å |
| 101 | L | 67.4 | Low | 61.4 | Low | 131 Ų | 131 | 128 Ų | 128 | 69% | 0.686 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | -43.5 | 170.3 | -159.6 | 70.7 | 0 | 0 | 0 | 112.7 | S99 S103 R104 V105 | S99-L101 CarbonylContact O-C 3.48Å; S99-L101 PolarHBondContact O-N 2.87Å; L101-S103 PolarHBondContact O-N 3.05Å; L101-R104 WeakPolarHBondContact O-CA 3.48Å; L101-R104 WeakPolarHBondContact O-CB 3.43Å; L101-R104 PolarHBondContact O-N 3.46Å; L101-V105 WeakPolarHBondContact O-CG2 3.28Å; L101-V105 PolarHBondContact O-N 3.39Å |
| 102 | A | 66.8 | Low | 61.9 | Low | 38 Ų | 38 | 122.7 Ų | 122.7 | 31% | 0.314 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -63 | -39.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | L98 S99 R104 V105 Y106 | L98-A102 HydrophobicContact CB-CB 4.2Å; L98-A102 HydrophobicContact CD2-CB 4.34Å; S99-A102 WeakPolarHBondContact O-CB 3.4Å; S99-A102 PolarHBondContact O-N 2.98Å; A102-R104 PolarHBondContact O-N 3.47Å; A102-V105 PolarHBondContact O-N 3.42Å; A102-V105 VanDerWaalsContact O-N 3.13Å; A102-Y106 WeakPolarHBondContact O-CD2 3.34Å; A102-Y106 PolarHBondContact O-N 3.1Å |
| 103 | S | 64.4 | Low | 62.4 | Low | 53 Ų | 53 | 118.8 Ų | 118.8 | 37% | 0.371 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -65.5 | -20.1 | 171.5 | -77.6 | 0 | 0 | 0 | 0 | 114.2 | L98 S99 L101 | L98-S103 VanDerWaalsContact CB-OG 3.27Å; L98-S103 WeakPolarHBondContact CB-OG 3.5Å; L98-S103 WeakPolarHBondContact O-CB 3.26Å; L98-S103 PolarHBondContact O-OG 3.35Å; S99-S103 PolarHBondContact O-N 3.34Å; L101-S103 PolarHBondContact O-N 3.05Å |
| 104 | R | 63.4 | Low | 63 | Low | 159 Ų | 159 | 117.1 Ų | 117.1 | 60% | 0.6 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -82.8 | -25.6 | 173.1 | -76.6 | 169.5 | 73.4 | 155.8 | 1.1 | 112.2 | G100 L101 A102 | G100-R104 VanDerWaalsContact O-CD 3.26Å; G100-R104 WeakPolarHBondContact O-CD 3.23Å; G100-R104 VanDerWaalsContact O-CG 3.28Å; G100-R104 WeakPolarHBondContact O-CG 3.46Å; L101-R104 WeakPolarHBondContact O-CA 3.48Å; L101-R104 WeakPolarHBondContact O-CB 3.43Å; L101-R104 PolarHBondContact O-N 3.46Å; A102-R104 PolarHBondContact O-N 3.47Å |
| 105 | V | 64.8 | Low | 63.6 | Low | 113 Ų | 113 | 115.8 Ų | 115.8 | 69% | 0.685 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -82.1 | -28 | 179.7 | 176.2 | 0 | 0 | 0 | 0 | 112.2 | L101 A102 R107 | L101-V105 WeakPolarHBondContact O-CG2 3.28Å; L101-V105 PolarHBondContact O-N 3.39Å; A102-V105 PolarHBondContact O-N 3.42Å; A102-V105 VanDerWaalsContact O-N 3.13Å; V105-R107 VanDerWaalsContact C-N 3.3Å; V105-R107 PolarHBondContact O-N 3.12Å |
| 106 | Y | 61.4 | Low | 63.9 | Low | 181 Ų | 181 | 117.4 Ų | 117.4 | 71% | 0.71 | 60% | 0.604 | S | S | * | * | S | Bend | trans | -79.9 | 2.3 | 176.1 | -86.9 | -83.1 | 0 | 0 | 0 | 115.8 | L98 A102 K108 | L98-Y106 HydrophobicContact CD1-CD2 3.91Å; L98-Y106 HydrophobicContact CD1-CE2 4.2Å; A102-Y106 WeakPolarHBondContact O-CD2 3.34Å; A102-Y106 PolarHBondContact O-N 3.1Å; Y106-K108 PolarHBondContact O-N 3.25Å; Y106-K108 VanDerWaalsContact O-N 3.08Å |
| 107 | R | 61.8 | Low | 64.3 | Low | 124 Ų | 124 | 111.8 Ų | 111.8 | 47% | 0.468 | 59% | 0.59 | S | S | . | * | trans | -73.1 | 101.5 | 175 | -64.2 | -176.6 | -164.7 | -179.1 | -0.3 | 109.7 | V105 D109 T110 | V105-R107 VanDerWaalsContact C-N 3.3Å; V105-R107 PolarHBondContact O-N 3.12Å; R107-D109 PolarHBondContact O-N 3.31Å; R107-T110 HydrophobicContact CB-CG2 4.35Å; R107-T110 PolarHBondContact O-N 2.91Å; R107-T110 VanDerWaalsContact O-N 3.16Å; R107-T110 PolarHBondContact O-OG1 2.91Å | ||
| 108 | K | 65.2 | Low | 64.9 | Low | 203 Ų | 203 | 112.7 Ų | 112.7 | 88% | 0.883 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.2 | -10.1 | 170.8 | -81.4 | -86.8 | -179.2 | 175.1 | 0 | 113.4 | Y106 | Y106-K108 PolarHBondContact O-N 3.25Å; Y106-K108 VanDerWaalsContact O-N 3.08Å |
| 109 | D | 67.2 | Low | 65.5 | Low | 81 Ų | 81 | 112.6 Ų | 112.6 | 43% | 0.433 | 59% | 0.589 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -97.8 | 2.1 | -173.6 | 26.6 | -55.4 | 0 | 0 | 0 | 113.1 | R107 L111 S112 L113 | R107-D109 PolarHBondContact O-N 3.31Å; D109-L111 VanDerWaalsContact C-N 3.31Å; D109-L111 PolarHBondContact O-N 3.48Å; D109-S112 PolarHBondContact O-N 3.23Å; D109-S112 VanDerWaalsContact O-N 3.11Å; D109-L113 PolarHBondContact O-N 3.41Å |
| 110 | T | 68.3 | Low | 65.7 | Low | 81 Ų | 81 | 112.7 Ų | 112.7 | 50% | 0.497 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -63.2 | -33.8 | 171 | 52 | 0 | 0 | 0 | 0 | 113.1 | R107 K114 | R107-T110 HydrophobicContact CB-CG2 4.35Å; R107-T110 PolarHBondContact O-N 2.91Å; R107-T110 VanDerWaalsContact O-N 3.16Å; R107-T110 PolarHBondContact O-OG1 2.91Å; T110-K114 PolarHBondContact O-N 3.39Å |
| 111 | L | 65 | Low | 65.9 | Low | 133 Ų | 133 | 115.1 Ų | 115.1 | 70% | 0.696 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -69.4 | -40.3 | 169 | -107.5 | 95.8 | 0 | 0 | 0 | 111.4 | D109 L113 K114 D115 | D109-L111 VanDerWaalsContact C-N 3.31Å; D109-L111 PolarHBondContact O-N 3.48Å; L111-L113 VanDerWaalsContact C-N 3.26Å; L111-L113 PolarHBondContact O-N 3.49Å; L111-K114 WeakPolarHBondContact O-CA 3.24Å; L111-K114 WeakPolarHBondContact O-CB 3.48Å; L111-K114 PolarHBondContact O-N 2.94Å; L111-D115 PolarHBondContact O-N 2.91Å |
| 112 | S | 64.1 | Low | 66 | Low | 68 Ų | 68 | 115.2 Ų | 115.2 | 48% | 0.476 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -66.8 | -29 | -179.4 | -157.3 | 0 | 0 | 0 | 0 | 112.5 | D109 M116 | D109-S112 PolarHBondContact O-N 3.23Å; D109-S112 VanDerWaalsContact O-N 3.11Å; S112-M116 WeakPolarHBondContact O-CB 3.4Å; S112-M116 VanDerWaalsContact O-CG 3.24Å; S112-M116 WeakPolarHBondContact O-CG 3.2Å; S112-M116 PolarHBondContact O-N 3.18Å |
| 113 | L | 63.8 | Low | 66.2 | Low | 92 Ų | 92 | 118.7 Ų | 118.7 | 48% | 0.482 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -70 | -32.6 | 169.8 | -79.1 | 158.8 | 0 | 0 | 0 | 112.5 | D109 L111 D115 M116 L117 | D109-L113 PolarHBondContact O-N 3.41Å; L111-L113 VanDerWaalsContact C-N 3.26Å; L111-L113 PolarHBondContact O-N 3.49Å; L113-D115 VanDerWaalsContact C-N 3.27Å; L113-D115 PolarHBondContact O-N 3.41Å; L113-M116 PolarHBondContact O-N 2.88Å; L113-L117 HydrophobicContact CD2-CD1 4.16Å; L113-L117 WeakPolarHBondContact O-CB 3.47Å; L113-L117 VanDerWaalsContact O-CD1 3.23Å; L113-L117 WeakPolarHBondContact O-CD1 3.29Å; L113-L117 PolarHBondContact O-N 3.43Å |
| 114 | K | 64.3 | Low | 66.4 | Low | 133 Ų | 133 | 120 Ų | 120 | 58% | 0.578 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -65.1 | -33.8 | 174.8 | -165.4 | 95.1 | 171.5 | 177.7 | 0 | 111.5 | T110 L111 L119 | T110-K114 PolarHBondContact O-N 3.39Å; L111-K114 WeakPolarHBondContact O-CA 3.24Å; L111-K114 WeakPolarHBondContact O-CB 3.48Å; L111-K114 PolarHBondContact O-N 2.94Å; K114-L119 HydrophobicContact CD-CD2 3.57Å; K114-L119 HydrophobicContact CG-CD2 4Å |
| 115 | D | 66.3 | Low | 66.8 | Low | 131 Ų | 131 | 120 Ų | 120 | 70% | 0.701 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -85.5 | -24.8 | 177.9 | -63.5 | -20.8 | 0 | 0 | 0 | 113.1 | L111 L113 | L111-D115 PolarHBondContact O-N 2.91Å; L113-D115 VanDerWaalsContact C-N 3.27Å; L113-D115 PolarHBondContact O-N 3.41Å |
| 116 | M | 61.2 | Low | 67.1 | Low | 148 Ų | 148 | 118.2 Ų | 118.2 | 73% | 0.729 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -88.2 | -29.1 | 177.9 | -78.7 | -96.5 | 83.4 | 0 | 0 | 114 | S112 L113 | S112-M116 WeakPolarHBondContact O-CB 3.4Å; S112-M116 VanDerWaalsContact O-CG 3.24Å; S112-M116 WeakPolarHBondContact O-CG 3.2Å; S112-M116 PolarHBondContact O-N 3.18Å; L113-M116 PolarHBondContact O-N 2.88Å |
| 117 | L | 66.6 | Low | 67.7 | Low | 102 Ų | 102 | 113.7 Ų | 113.7 | 53% | 0.534 | 61% | 0.612 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -75.8 | 128.1 | 165.6 | -86.6 | 64.4 | 0 | 0 | 0 | 106.2 | L113 L119 | L113-L117 HydrophobicContact CD2-CD1 4.16Å; L113-L117 WeakPolarHBondContact O-CB 3.47Å; L113-L117 VanDerWaalsContact O-CD1 3.23Å; L113-L117 WeakPolarHBondContact O-CD1 3.29Å; L113-L117 PolarHBondContact O-N 3.43Å; L117-L119 HydrophobicContact CB-CD1 3.27Å; L117-L119 HydrophobicContact CD2-CD1 4.08Å; L117-L119 HydrophobicContact CG-CD1 4.33Å; L117-L119 WeakPolarHBondContact O-CD1 3.46Å; L117-L119 PolarHBondContact O-N 3.26Å |
| 118 | D | 67.8 | Low | 68.3 | Low | 170 Ų | 170 | 115.4 Ų | 115.4 | 91% | 0.909 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | 63.9 | 171 | -71.3 | -45.8 | 0 | 0 | 0 | 110.9 | ||
| 119 | L | 71.4 | Confident | 69 | Low | 73 Ų | 73 | 108 Ų | 108 | 38% | 0.382 | 60% | 0.599 | S | S | . | * | P | Polyproline II helix | trans | -65.8 | 134.3 | 173 | -92.6 | 72.4 | 0 | 0 | 0 | 106.8 | K114 L117 | K114-L119 HydrophobicContact CD-CD2 3.57Å; K114-L119 HydrophobicContact CG-CD2 4Å; L117-L119 HydrophobicContact CB-CD1 3.27Å; L117-L119 HydrophobicContact CD2-CD1 4.08Å; L117-L119 HydrophobicContact CG-CD1 4.33Å; L117-L119 WeakPolarHBondContact O-CD1 3.46Å; L117-L119 PolarHBondContact O-N 3.26Å |
| 120 | P | 70.9 | Confident | 69.9 | Low | 98 Ų | 98 | 108.3 Ų | 108.3 | 64% | 0.636 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 146 | 171.5 | 24.1 | -32.6 | 0 | 0 | 0 | 108.8 | ||
| 121 | P | 71.2 | Confident | 70.7 | Confident | 106 Ų | 106 | 110.2 Ų | 110.2 | 69% | 0.688 | 61% | 0.607 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 149.4 | 178.3 | 24.2 | -34.6 | 0 | 0 | 0 | 109.2 | V123 | P121-V123 PolarHBondContact O-N 3.33Š|
| 122 | P | 71 | Confident | 71.8 | Confident | 133 Ų | 133 | 111 Ų | 111 | 86% | 0.864 | 61% | 0.607 | S | S | * | * | trans | -45.7 | 108.8 | 179.2 | -25.8 | 31.9 | 0 | 0 | 0 | 109.7 | D124 | P122-D124 PolarHBondContact O-N 2.89Š| ||
| 123 | V | 71 | Confident | 73.1 | Confident | 110 Ų | 110 | 112.1 Ų | 112.1 | 67% | 0.667 | 61% | 0.605 | S | S | * | * | trans | -71 | 125.5 | 179.6 | 178.7 | 0 | 0 | 0 | 0 | 105.6 | P121 D125 | P121-V123 PolarHBondContact O-N 3.33Å; V123-D125 PolarHBondContact O-N 2.82Å; V123-D125 VanDerWaalsContact O-N 3.14Å | ||
| 124 | D | 68.4 | Low | 74.3 | Confident | 82 Ų | 82 | 111.5 Ų | 111.5 | 44% | 0.439 | 60% | 0.596 | S | S | . | * | trans | -56.9 | 120.3 | 169.5 | -120.7 | -25.4 | 0 | 0 | 0 | 107.6 | P122 I126 R134 | P122-D124 PolarHBondContact O-N 2.89Å; D124-I126 CarbonylContact O-C 3.52Å; D124-I126 PolarHBondContact O-N 3.13Å; D124-R134 VanDerWaalsContact CG-NH2 3.25Å; D124-R134 IonicContact OD1-CZ 3.45Å; D124-R134 IonicContact OD1-NH1 2.72Å; D124-R134 IonicContact OD1-NH2 3.72Å; D124-R134 PolarHBondContact OD1-NH2 3.14Å; D124-R134 IonicContact OD2-NH2 2.79Å; D124-R134 PolarHBondContact OD2-NH2 2.92Å | ||
| 125 | D | 70.4 | Confident | 75.7 | Confident | 158 Ų | 158 | 113 Ų | 113 | 85% | 0.845 | 60% | 0.598 | S | S | * | * | S | Bend | trans | -54.1 | -17.6 | -178.7 | -65 | -37.2 | 0 | 0 | 0 | 112.8 | V123 | V123-D125 PolarHBondContact O-N 2.82Å; V123-D125 VanDerWaalsContact O-N 3.14Å |
| 126 | I | 72 | Confident | 77 | Confident | 75 Ų | 75 | 112.1 Ų | 112.1 | 39% | 0.385 | 59% | 0.59 | S | S | . | * | S | Bend | trans | -124.4 | 94.2 | 175.2 | -52.1 | 174.1 | 0 | 0 | 0 | 108.3 | D124 Q129 | D124-I126 CarbonylContact O-C 3.52Å; D124-I126 PolarHBondContact O-N 3.13Å; I126-Q129 HydrophobicContact CG2-CG 4.37Å |
| 127 | P | 74 | Confident | 78.6 | Confident | 86 Ų | 86 | 109.5 Ų | 109.5 | 56% | 0.558 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.1 | 150.7 | -179.5 | 25.2 | -32.8 | 0 | 0 | 0 | 111.6 | ||
| 128 | N | 74.8 | Confident | 79.9 | Confident | 161 Ų | 161 | 110.8 Ų | 110.8 | 86% | 0.861 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 71.6 | 29.9 | 177 | -46.5 | -54.8 | 0 | 0 | 0 | 116.5 | ||
| 129 | Q | 79.3 | Confident | 81.3 | Confident | 48 Ų | 48 | 108.8 Ų | 108.8 | 22% | 0.224 | 56% | 0.564 | C | S | . | * | trans | -137.1 | 129.3 | 174 | -62.7 | -177.4 | 16.7 | 0 | 0 | 112.6 | I126 E133 | I126-Q129 HydrophobicContact CG2-CG 4.37Å; Q129-E133 VanDerWaalsContact CA-OE2 3.29Å; Q129-E133 WeakPolarHBondContact CA-OE2 3.3Å | ||
| 130 | T | 86 | Confident | 82.6 | Confident | 86 Ų | 86 | 110.6 Ų | 110.6 | 53% | 0.528 | 57% | 0.572 | S | S | . | * | trans | -69 | 151 | 169.8 | -54.3 | 0 | 0 | 0 | 0 | 109.7 | Q132 E133 R134 | T130-Q132 HydrophobicContact CG2-CB 4.46Å; T130-Q132 PolarHBondContact O-N 3.15Å; T130-Q132 VanDerWaalsContact O-N 3.1Å; T130-E133 PolarHBondContact N-OE2 3.38Å; T130-E133 WeakPolarHBondContact O-CB 3.46Å; T130-E133 PolarHBondContact O-N 3.33Å; T130-R134 PolarHBondContact O-N 2.82Å | ||
| 131 | Q | 85.3 | Confident | 83.8 | Confident | 121 Ų | 121 | 110.2 Ų | 110.2 | 57% | 0.565 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -50.9 | -37.4 | 175.6 | -168.2 | -165.6 | 49 | 0 | 0 | 112.8 | R134 R135 | Q131-R134 WeakPolarHBondContact O-CB 3.27Å; Q131-R134 PolarHBondContact O-N 3.05Å; Q131-R135 WeakPolarHBondContact O-CG 3.45Å; Q131-R135 PolarHBondContact O-N 3.33Å; Q131-R135 VanDerWaalsContact O-N 3.12Å |
| 132 | Q | 88.8 | Confident | 85.1 | Confident | 149 Ų | 149 | 108.5 Ų | 108.5 | 70% | 0.696 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66.1 | -43.4 | 176.6 | -65.9 | -177.7 | 5.4 | 0 | 0 | 112.5 | T130 R134 R135 H136 | T130-Q132 HydrophobicContact CG2-CB 4.46Å; T130-Q132 PolarHBondContact O-N 3.15Å; T130-Q132 VanDerWaalsContact O-N 3.1Å; Q132-R134 VanDerWaalsContact C-N 3.27Å; Q132-R134 PolarHBondContact O-N 2.91Å; Q132-R135 WeakPolarHBondContact O-CB 3.44Å; Q132-R135 PolarHBondContact O-N 3.42Å; Q132-H136 PolarHBondContact O-N 3.46Å |
| 133 | E | 90.6 | Very high | 86.4 | Confident | 92 Ų | 92 | 106.4 Ų | 106.4 | 43% | 0.43 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63.1 | -36.5 | 176.6 | -63.4 | 176.3 | 146.1 | 0 | 0 | 111.3 | Q129 T130 H136 K137 | Q129-E133 VanDerWaalsContact CA-OE2 3.29Å; Q129-E133 WeakPolarHBondContact CA-OE2 3.3Å; T130-E133 PolarHBondContact N-OE2 3.38Å; T130-E133 WeakPolarHBondContact O-CB 3.46Å; T130-E133 PolarHBondContact O-N 3.33Å; E133-H136 PolarHBondContact O-N 3.2Å; E133-K137 WeakPolarHBondContact O-CB 3.38Å; E133-K137 VanDerWaalsContact O-CG 3.3Å; E133-K137 WeakPolarHBondContact O-CG 3.32Å; E133-K137 PolarHBondContact O-N 2.63Å |
| 134 | R | 90 | Very high | 87.7 | Confident | 80 Ų | 80 | 107.7 Ų | 107.7 | 30% | 0.302 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.8 | -45.5 | 174.1 | -168.4 | -176.6 | -56.9 | 176.1 | 6.7 | 111.3 | D124 T130 Q131 Q132 K137 M138 | D124-R134 VanDerWaalsContact CG-NH2 3.25Å; D124-R134 IonicContact OD1-CZ 3.45Å; D124-R134 IonicContact OD1-NH1 2.72Å; D124-R134 IonicContact OD1-NH2 3.72Å; D124-R134 PolarHBondContact OD1-NH2 3.14Å; D124-R134 IonicContact OD2-NH2 2.79Å; D124-R134 PolarHBondContact OD2-NH2 2.92Å; T130-R134 PolarHBondContact O-N 2.82Å; Q131-R134 WeakPolarHBondContact O-CB 3.27Å; Q131-R134 PolarHBondContact O-N 3.05Å; Q132-R134 VanDerWaalsContact C-N 3.27Å; Q132-R134 PolarHBondContact O-N 2.91Å; R134-K137 PolarHBondContact O-N 3.15Å; R134-M138 WeakPolarHBondContact O-CB 3.45Å; R134-M138 PolarHBondContact O-N 3.45Å |
| 135 | R | 92.4 | Very high | 89.1 | Confident | 164 Ų | 164 | 108.3 Ų | 108.3 | 62% | 0.619 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -61.3 | -45.7 | 175.9 | -70.7 | 179 | -176.7 | -171.3 | 3.2 | 111.4 | Q131 Q132 K137 M138 E139 | Q131-R135 WeakPolarHBondContact O-CG 3.45Å; Q131-R135 PolarHBondContact O-N 3.33Å; Q131-R135 VanDerWaalsContact O-N 3.12Å; Q132-R135 WeakPolarHBondContact O-CB 3.44Å; Q132-R135 PolarHBondContact O-N 3.42Å; R135-K137 PolarHBondContact O-N 3.22Å; R135-M138 WeakPolarHBondContact O-CB 3.4Å; R135-M138 PolarHBondContact O-N 2.81Å; R135-E139 PolarHBondContact O-N 2.72Å |
| 136 | H | 94.3 | Very high | 90.4 | Very high | 112 Ų | 112 | 107.2 Ų | 107.2 | 52% | 0.519 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.7 | -42.3 | 178.1 | -173.7 | -96.1 | 0 | 0 | 0 | 112.3 | Q132 E133 M138 E139 M140 | Q132-H136 PolarHBondContact O-N 3.46Å; E133-H136 PolarHBondContact O-N 3.2Å; H136-M138 VanDerWaalsContact C-N 3.34Å; H136-M138 PolarHBondContact O-N 3.25Å; H136-E139 PolarHBondContact O-N 2.83Å; H136-M140 PolarHBondContact CE1-SD 3.36Å; H136-M140 WeakPolarHBondContact O-CB 3.33Å; H136-M140 VanDerWaalsContact O-CG 3.32Å; H136-M140 WeakPolarHBondContact O-CG 3.3Å; H136-M140 PolarHBondContact O-N 3.15Å |
| 137 | K | 94 | Very high | 91.6 | Very high | 94 Ų | 94 | 112 Ų | 112 | 41% | 0.409 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.1 | -40.3 | 174.1 | -73.1 | 177.3 | -168.5 | -175.1 | 0 | 111.9 | E133 R134 R135 M140 V141 | E133-K137 WeakPolarHBondContact O-CB 3.38Å; E133-K137 VanDerWaalsContact O-CG 3.3Å; E133-K137 WeakPolarHBondContact O-CG 3.32Å; E133-K137 PolarHBondContact O-N 2.63Å; R134-K137 PolarHBondContact O-N 3.15Å; R135-K137 PolarHBondContact O-N 3.22Å; K137-M140 PolarHBondContact O-N 2.96Å; K137-V141 WeakPolarHBondContact O-CB 3.48Å; K137-V141 VanDerWaalsContact O-CG2 3.27Å; K137-V141 WeakPolarHBondContact O-CG2 3.49Å; K137-V141 PolarHBondContact O-N 2.91Å |
| 138 | M | 94.7 | Very high | 92.8 | Very high | 129 Ų | 129 | 114.4 Ų | 114.4 | 64% | 0.635 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -61 | -46.3 | 175.4 | -171.6 | 65.1 | 70.6 | 0 | 0 | 111.1 | R134 R135 H136 V141 S142 | R134-M138 WeakPolarHBondContact O-CB 3.45Å; R134-M138 PolarHBondContact O-N 3.45Å; R135-M138 WeakPolarHBondContact O-CB 3.4Å; R135-M138 PolarHBondContact O-N 2.81Å; H136-M138 VanDerWaalsContact C-N 3.34Å; H136-M138 PolarHBondContact O-N 3.25Å; M138-V141 PolarHBondContact O-N 3.46Å; M138-S142 VanDerWaalsContact O-CB 3.31Å; M138-S142 WeakPolarHBondContact O-CB 3.41Å; M138-S142 PolarHBondContact O-N 3.16Å |
| 139 | E | 97.1 | Very high | 93.9 | Very high | 127 Ų | 127 | 111.5 Ų | 111.5 | 59% | 0.593 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.5 | -46.8 | 176.3 | -175.3 | 176.2 | -171.2 | 0 | 0 | 111.7 | R135 H136 V141 S142 V143 | R135-E139 PolarHBondContact O-N 2.72Å; H136-E139 PolarHBondContact O-N 2.83Å; E139-V141 VanDerWaalsContact C-N 3.34Å; E139-V141 PolarHBondContact O-N 2.97Å; E139-S142 WeakPolarHBondContact O-CB 3.16Å; E139-S142 PolarHBondContact O-N 3.24Å; E139-S142 VanDerWaalsContact O-N 3.15Å; E139-V143 WeakPolarHBondContact O-CG2 3.31Å; E139-V143 PolarHBondContact O-N 3.5Å |
| 140 | M | 97.7 | Very high | 94.7 | Very high | 111 Ų | 111 | 113.8 Ų | 113.8 | 55% | 0.547 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -58.2 | -43.8 | 175.3 | -75 | 178.2 | 51.7 | 0 | 0 | 112.8 | H136 K137 S142 K144 | H136-M140 PolarHBondContact CE1-SD 3.36Å; H136-M140 WeakPolarHBondContact O-CB 3.33Å; H136-M140 VanDerWaalsContact O-CG 3.32Å; H136-M140 WeakPolarHBondContact O-CG 3.3Å; H136-M140 PolarHBondContact O-N 3.15Å; K137-M140 PolarHBondContact O-N 2.96Å; M140-S142 VanDerWaalsContact C-N 3.35Å; M140-K144 VanDerWaalsContact O-CB 3.3Å; M140-K144 WeakPolarHBondContact O-CB 3.25Å; M140-K144 PolarHBondContact O-N 3.03Å |
| 141 | V | 97.8 | Very high | 95.2 | Very high | 90 Ų | 90 | 116.1 Ų | 116.1 | 55% | 0.545 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -66.4 | -40.6 | 176.9 | 170.6 | 0 | 0 | 0 | 0 | 110.3 | K137 M138 E139 K144 L145 | K137-V141 WeakPolarHBondContact O-CB 3.48Å; K137-V141 VanDerWaalsContact O-CG2 3.27Å; K137-V141 WeakPolarHBondContact O-CG2 3.49Å; K137-V141 PolarHBondContact O-N 2.91Å; M138-V141 PolarHBondContact O-N 3.46Å; E139-V141 VanDerWaalsContact C-N 3.34Å; E139-V141 PolarHBondContact O-N 2.97Å; V141-K144 PolarHBondContact O-N 3.49Å; V141-L145 VanDerWaalsContact O-CB 3.25Å; V141-L145 WeakPolarHBondContact O-CB 3.41Å; V141-L145 PolarHBondContact O-N 2.77Å |
| 142 | S | 97.8 | Very high | 95.7 | Very high | 70 Ų | 70 | 119.4 Ų | 119.4 | 49% | 0.49 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -57.8 | -53.7 | 176.9 | -172.3 | 0 | 0 | 0 | 0 | 111.3 | M138 E139 M140 K144 L145 E146 | M138-S142 VanDerWaalsContact O-CB 3.31Å; M138-S142 WeakPolarHBondContact O-CB 3.41Å; M138-S142 PolarHBondContact O-N 3.16Å; E139-S142 WeakPolarHBondContact O-CB 3.16Å; E139-S142 PolarHBondContact O-N 3.24Å; E139-S142 VanDerWaalsContact O-N 3.15Å; M140-S142 VanDerWaalsContact C-N 3.35Å; S142-K144 VanDerWaalsContact C-N 3.32Å; S142-K144 PolarHBondContact O-N 3.35Å; S142-L145 PolarHBondContact O-N 3.09Å; S142-L145 VanDerWaalsContact O-N 3.14Å; S142-E146 PolarHBondContact O-N 3.14Å |
| 143 | V | 97.8 | Very high | 96.1 | Very high | 89 Ų | 89 | 115 Ų | 115 | 54% | 0.539 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -60.5 | -41.8 | 178.1 | 174.8 | 0 | 0 | 0 | 0 | 111.4 | E139 L145 R147 | E139-V143 WeakPolarHBondContact O-CG2 3.31Å; E139-V143 PolarHBondContact O-N 3.5Å; V143-L145 VanDerWaalsContact C-N 3.34Å; V143-L145 PolarHBondContact O-N 3.32Å; V143-R147 PolarHBondContact O-N 3.19Å; V143-R147 VanDerWaalsContact O-N 3.13Å |
| 144 | K | 98.3 | Very high | 96.3 | Very high | 138 Ų | 138 | 114 Ų | 114 | 60% | 0.6 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65.7 | -38 | 177.7 | -175.2 | 175.9 | -176.8 | 175.8 | 0 | 112.2 | M140 V141 S142 K148 | M140-K144 VanDerWaalsContact O-CB 3.3Å; M140-K144 WeakPolarHBondContact O-CB 3.25Å; M140-K144 PolarHBondContact O-N 3.03Å; V141-K144 PolarHBondContact O-N 3.49Å; S142-K144 VanDerWaalsContact C-N 3.32Å; S142-K144 PolarHBondContact O-N 3.35Å; K144-K148 WeakPolarHBondContact O-CG 2.96Å; K144-K148 PolarHBondContact O-N 3.13Å |
| 145 | L | 98.4 | Very high | 96.5 | Very high | 94 Ų | 94 | 112.9 Ų | 112.9 | 49% | 0.492 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -68.8 | -46.5 | 178.7 | 179 | 59.7 | 0 | 0 | 0 | 110.6 | V141 S142 V143 R147 K148 L149 | V141-L145 VanDerWaalsContact O-CB 3.25Å; V141-L145 WeakPolarHBondContact O-CB 3.41Å; V141-L145 PolarHBondContact O-N 2.77Å; S142-L145 PolarHBondContact O-N 3.09Å; S142-L145 VanDerWaalsContact O-N 3.14Å; V143-L145 VanDerWaalsContact C-N 3.34Å; V143-L145 PolarHBondContact O-N 3.32Å; L145-R147 VanDerWaalsContact C-N 3.3Å; L145-R147 PolarHBondContact O-N 3.29Å; L145-K148 PolarHBondContact O-N 3.27Å; L145-L149 HydrophobicContact CD1-CD1 4.14Å; L145-L149 HydrophobicContact CD1-CG 4.07Å; L145-L149 HydrophobicContact CG-CD1 3.94Å; L145-L149 HydrophobicContact CG-CG 4.31Å; L145-L149 WeakPolarHBondContact O-CG 3.41Å; L145-L149 PolarHBondContact O-N 3.35Å |
| 146 | E | 98 | Very high | 96.5 | Very high | 136 Ų | 136 | 110.9 Ų | 110.9 | 64% | 0.636 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -54.9 | -46.2 | 176 | -172.6 | 179.6 | 178.7 | 0 | 0 | 111.5 | S142 K148 L149 S150 | S142-E146 PolarHBondContact O-N 3.14Å; E146-K148 VanDerWaalsContact C-N 3.32Å; E146-K148 PolarHBondContact O-N 2.88Å; E146-L149 PolarHBondContact O-N 3.48Å; E146-S150 PolarHBondContact O-N 2.83Å; E146-S150 PolarHBondContact O-OG 3.18Å |
| 147 | R | 97.7 | Very high | 96.6 | Very high | 174 Ų | 174 | 109.1 Ų | 109.1 | 66% | 0.657 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -60.5 | -36.6 | 174.6 | -177.5 | 176.3 | 179 | 144.6 | 0.9 | 113.5 | V143 L145 S150 | V143-R147 PolarHBondContact O-N 3.19Å; V143-R147 VanDerWaalsContact O-N 3.13Å; L145-R147 VanDerWaalsContact C-N 3.3Å; L145-R147 PolarHBondContact O-N 3.29Å; R147-S150 PolarHBondContact O-OG 3.02Å |
| 148 | K | 98.1 | Very high | 96.6 | Very high | 138 Ų | 138 | 106.9 Ų | 106.9 | 60% | 0.6 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -74.1 | -37 | 178 | -78.8 | -172.8 | 169.7 | -166 | 0 | 112 | K144 L145 E146 S150 Q151 R152 | K144-K148 WeakPolarHBondContact O-CG 2.96Å; K144-K148 PolarHBondContact O-N 3.13Å; L145-K148 PolarHBondContact O-N 3.27Å; E146-K148 VanDerWaalsContact C-N 3.32Å; E146-K148 PolarHBondContact O-N 2.88Å; K148-S150 VanDerWaalsContact C-N 3.35Å; K148-Q151 CarbonylContact O-C 3.54Å; K148-Q151 PolarHBondContact O-N 3.36Å; K148-R152 PolarHBondContact O-N 3Å |
| 149 | L | 97.1 | Very high | 96.4 | Very high | 99 Ų | 99 | 104.8 Ų | 104.8 | 52% | 0.518 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68.9 | -34.9 | 178.7 | -69.9 | 174.4 | 0 | 0 | 0 | 111.6 | L145 E146 Q151 R152 | L145-L149 HydrophobicContact CD1-CD1 4.14Å; L145-L149 HydrophobicContact CD1-CG 4.07Å; L145-L149 HydrophobicContact CG-CD1 3.94Å; L145-L149 HydrophobicContact CG-CG 4.31Å; L145-L149 WeakPolarHBondContact O-CG 3.41Å; L145-L149 PolarHBondContact O-N 3.35Å; E146-L149 PolarHBondContact O-N 3.48Å; L149-Q151 VanDerWaalsContact C-N 3.25Å; L149-Q151 PolarHBondContact O-N 2.79Å; L149-R152 VanDerWaalsContact O-CB 3.22Å; L149-R152 WeakPolarHBondContact O-CB 3.42Å; L149-R152 PolarHBondContact O-N 2.9Å |
| 150 | S | 96.6 | Very high | 96.2 | Very high | 96 Ų | 96 | 105.1 Ų | 105.1 | 67% | 0.671 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -69.5 | -21.9 | 174.1 | 66.1 | 0 | 0 | 0 | 0 | 113.8 | E146 R147 K148 | E146-S150 PolarHBondContact O-N 2.83Å; E146-S150 PolarHBondContact O-OG 3.18Å; R147-S150 PolarHBondContact O-OG 3.02Å; K148-S150 VanDerWaalsContact C-N 3.35Å |
| 151 | Q | 96.2 | Very high | 96.1 | Very high | 136 Ų | 136 | 107.3 Ų | 107.3 | 64% | 0.636 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.4 | 21.2 | 175.3 | -60.2 | -177.1 | 9.7 | 0 | 0 | 112.5 | K148 L149 P153 | K148-Q151 CarbonylContact O-C 3.54Å; K148-Q151 PolarHBondContact O-N 3.36Å; L149-Q151 VanDerWaalsContact C-N 3.25Å; L149-Q151 PolarHBondContact O-N 2.79Å; Q151-P153 WeakPolarHBondContact O-CD 3.44Å |
| 152 | R | 97.3 | Very high | 95.7 | Very high | 190 Ų | 190 | 109.1 Ų | 109.1 | 72% | 0.717 | 54% | 0.538 | S | S | * | . | P | Polyproline II helix | trans | -68 | 118.6 | -175.2 | -176.2 | 177.6 | -177.4 | -174.4 | 0.5 | 110 | K148 L149 | K148-R152 PolarHBondContact O-N 3Å; L149-R152 VanDerWaalsContact O-CB 3.22Å; L149-R152 WeakPolarHBondContact O-CB 3.42Å; L149-R152 PolarHBondContact O-N 2.9Å |
| 153 | P | 96.4 | Very high | 95.5 | Very high | 55 Ų | 55 | 111.2 Ų | 111.2 | 36% | 0.357 | 54% | 0.542 | S | S | . | . | P | Polyproline II helix | trans | -66.2 | 150.3 | 175.8 | 28.4 | -34.1 | 0 | 0 | 0 | 110.7 | Q151 E157 L158 | Q151-P153 WeakPolarHBondContact O-CD 3.44Å; P153-E157 WeakPolarHBondContact CB-OE2 2.98Å; P153-L158 HydrophobicContact CB-CD2 4.36Å; P153-L158 HydrophobicContact CB-CG 4.46Å; P153-L158 HydrophobicContact CG-CD2 4.07Å; P153-L158 HydrophobicContact CG-CG 4.35Å |
| 154 | T | 95.5 | Very high | 95.1 | Very high | 72 Ų | 72 | 110.6 Ų | 110.6 | 44% | 0.442 | 54% | 0.535 | S | S | . | . | P | Polyproline II helix | trans | -74 | 161.7 | 176.7 | 68.5 | 0 | 0 | 0 | 0 | 111 | E156 E157 L158 | T154-E156 VanDerWaalsContact C-N 3.34Å; T154-E157 PolarHBondContact O-N 3.47Å; T154-E157 WeakPolarHBondContact OG1-CB 3.42Å; T154-E157 VanDerWaalsContact OG1-CG 3.25Å; T154-E157 WeakPolarHBondContact OG1-CG 3.44Å; T154-E157 PolarHBondContact OG1-N 2.79Å; T154-L158 PolarHBondContact O-N 3.36Å |
| 155 | A | 94 | Very high | 94.5 | Very high | 57 Ų | 57 | 111.6 Ų | 111.6 | 47% | 0.471 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.5 | -43.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | E157 L158 E159 L164 | A155-E157 VanDerWaalsContact C-N 3.35Å; A155-E157 PolarHBondContact O-N 3.27Å; A155-L158 WeakPolarHBondContact O-CB 3.37Å; A155-L158 PolarHBondContact O-N 3.31Å; A155-E159 PolarHBondContact O-N 2.79Å; A155-L164 HydrophobicContact CB-CD2 4.04Å |
| 156 | E | 92.7 | Very high | 93.8 | Very high | 122 Ų | 122 | 111.3 Ų | 111.3 | 57% | 0.57 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -60.4 | -40.5 | 177.9 | -167.6 | -170.4 | 160.5 | 0 | 0 | 112.3 | T154 L158 E159 Q160 | T154-E156 VanDerWaalsContact C-N 3.34Å; E156-L158 VanDerWaalsContact C-N 3.27Å; E156-L158 PolarHBondContact O-N 3.45Å; E156-E159 WeakPolarHBondContact O-CB 3.5Å; E156-E159 PolarHBondContact O-N 3.04Å; E156-Q160 VanDerWaalsContact O-CG 3.28Å; E156-Q160 WeakPolarHBondContact O-CG 3.5Å; E156-Q160 PolarHBondContact O-N 3.31Å; E156-Q160 PolarHBondContact OE1-NE2 3.46Å; E156-Q160 VanDerWaalsContact OE1-NE2 3.15Å |
| 157 | E | 95 | Very high | 92.8 | Very high | 75 Ų | 75 | 114 Ų | 114 | 35% | 0.35 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.6 | -35 | 174.8 | -78 | 175.5 | -167.2 | 0 | 0 | 112.5 | P153 T154 A155 R161 | P153-E157 WeakPolarHBondContact CB-OE2 2.98Å; T154-E157 PolarHBondContact O-N 3.47Å; T154-E157 WeakPolarHBondContact OG1-CB 3.42Å; T154-E157 VanDerWaalsContact OG1-CG 3.25Å; T154-E157 WeakPolarHBondContact OG1-CG 3.44Å; T154-E157 PolarHBondContact OG1-N 2.79Å; A155-E157 VanDerWaalsContact C-N 3.35Å; A155-E157 PolarHBondContact O-N 3.27Å; E157-R161 WeakPolarHBondContact O-CB 3.21Å; E157-R161 WeakPolarHBondContact O-CG 3.47Å; E157-R161 PolarHBondContact O-N 3.04Å; E157-R161 VanDerWaalsContact O-N 3.09Å; E157-R161 IonicContact OE2-NH1 3.89Å |
| 158 | L | 95.1 | Very high | 91.8 | Very high | 47 Ų | 47 | 111.8 Ų | 111.8 | 25% | 0.246 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -73.1 | -32.9 | 176.9 | -66.5 | 176.6 | 0 | 0 | 0 | 111.8 | P153 T154 A155 E156 N162 I163 L164 | P153-L158 HydrophobicContact CB-CD2 4.36Å; P153-L158 HydrophobicContact CB-CG 4.46Å; P153-L158 HydrophobicContact CG-CD2 4.07Å; P153-L158 HydrophobicContact CG-CG 4.35Å; T154-L158 PolarHBondContact O-N 3.36Å; A155-L158 WeakPolarHBondContact O-CB 3.37Å; A155-L158 PolarHBondContact O-N 3.31Å; E156-L158 VanDerWaalsContact C-N 3.27Å; E156-L158 PolarHBondContact O-N 3.45Å; L158-N162 PolarHBondContact O-N 3.03Å; L158-I163 HydrophobicContact CB-CB 4.45Å; L158-I163 HydrophobicContact CD2-CB 4.27Å; L158-I163 HydrophobicContact CD2-CD1 3.97Å; L158-I163 HydrophobicContact CD2-CG2 4.32Å; L158-I163 PolarHBondContact O-N 2.85Å; L158-L164 HydrophobicContact CB-CB 3.67Å; L158-L164 PolarHBondContact O-N 3.1Å; L158-L164 VanDerWaalsContact O-N 3.09Å |
| 159 | E | 90.9 | Very high | 90.8 | Very high | 84 Ų | 84 | 106.4 Ų | 106.4 | 39% | 0.393 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.1 | -46.3 | 172 | -70.4 | 166.5 | -157.9 | 0 | 0 | 110.9 | A155 E156 R161 N162 L164 | A155-E159 PolarHBondContact O-N 2.79Å; E156-E159 WeakPolarHBondContact O-CB 3.5Å; E156-E159 PolarHBondContact O-N 3.04Å; E159-R161 VanDerWaalsContact C-N 3.3Å; E159-R161 PolarHBondContact O-N 3.39Å; E159-N162 WeakPolarHBondContact O-CA 3.19Å; E159-N162 PolarHBondContact O-N 3.43Å; E159-L164 HydrophobicContact CG-CB 4.17Å; E159-L164 HydrophobicContact CG-CD2 4.19Å; E159-L164 HydrophobicContact CG-CG 4.3Å |
| 160 | Q | 92.2 | Very high | 90 | Very high | 134 Ų | 134 | 106.2 Ų | 106.2 | 63% | 0.626 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61.5 | -36.4 | 177 | -69.6 | 166.7 | 3.5 | 0 | 0 | 112.6 | E156 N162 | E156-Q160 VanDerWaalsContact O-CG 3.28Å; E156-Q160 WeakPolarHBondContact O-CG 3.5Å; E156-Q160 PolarHBondContact O-N 3.31Å; E156-Q160 PolarHBondContact OE1-NE2 3.46Å; E156-Q160 VanDerWaalsContact OE1-NE2 3.15Å; Q160-N162 PolarHBondContact O-N 3.43Å |
| 161 | R | 95.2 | Very high | 89.3 | Confident | 158 Ų | 158 | 104.3 Ų | 104.3 | 60% | 0.596 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.8 | 0.5 | 172.9 | -70.2 | -173.9 | 179.9 | 115.1 | -0.6 | 113.5 | E157 E159 I163 | E157-R161 WeakPolarHBondContact O-CB 3.21Å; E157-R161 WeakPolarHBondContact O-CG 3.47Å; E157-R161 PolarHBondContact O-N 3.04Å; E157-R161 VanDerWaalsContact O-N 3.09Å; E157-R161 IonicContact OE2-NH1 3.89Å; E159-R161 VanDerWaalsContact C-N 3.3Å; E159-R161 PolarHBondContact O-N 3.39Å; R161-I163 HydrophobicContact CB-CD1 3.9Å; R161-I163 HydrophobicContact CB-CG1 4Å; R161-I163 PolarHBondContact O-N 3.5Å |
| 162 | N | 90.1 | Very high | 88.7 | Confident | 128 Ų | 128 | 103 Ų | 103 | 68% | 0.684 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.7 | 35.3 | -178.4 | -172.4 | 69.9 | 0 | 0 | 0 | 112.7 | L158 E159 Q160 | L158-N162 PolarHBondContact O-N 3.03Å; E159-N162 WeakPolarHBondContact O-CA 3.19Å; E159-N162 PolarHBondContact O-N 3.43Å; Q160-N162 PolarHBondContact O-N 3.43Å |
| 163 | I | 92.3 | Very high | 88.2 | Confident | 114 Ų | 114 | 95.9 Ų | 95.9 | 59% | 0.585 | 51% | 0.506 | S | S | * | . | trans | -96.9 | -51.2 | 175.3 | -60.1 | 172 | 0 | 0 | 0 | 109.7 | L158 R161 | L158-I163 HydrophobicContact CB-CB 4.45Å; L158-I163 HydrophobicContact CD2-CB 4.27Å; L158-I163 HydrophobicContact CD2-CD1 3.97Å; L158-I163 HydrophobicContact CD2-CG2 4.32Å; L158-I163 PolarHBondContact O-N 2.85Å; R161-I163 HydrophobicContact CB-CD1 3.9Å; R161-I163 HydrophobicContact CB-CG1 4Å; R161-I163 PolarHBondContact O-N 3.5Å | ||
| 164 | L | 89.1 | Confident | 87.9 | Confident | 76 Ų | 76 | 100.8 Ų | 100.8 | 40% | 0.398 | 52% | 0.521 | S | S | . | . | S | Bend | trans | -84.8 | 131.1 | 171.8 | -172.8 | 61.8 | 0 | 0 | 0 | 108.2 | A155 L158 E159 | A155-L164 HydrophobicContact CB-CD2 4.04Å; L158-L164 HydrophobicContact CB-CB 3.67Å; L158-L164 PolarHBondContact O-N 3.1Å; L158-L164 VanDerWaalsContact O-N 3.09Å; E159-L164 HydrophobicContact CG-CB 4.17Å; E159-L164 HydrophobicContact CG-CD2 4.19Å; E159-L164 HydrophobicContact CG-CG 4.3Å |
| 165 | K | 87.8 | Confident | 87.7 | Confident | 159 Ų | 159 | 103.2 Ų | 103.2 | 69% | 0.691 | 53% | 0.528 | S | S | * | . | trans | -111.6 | 132.7 | 176.6 | -60.7 | 177.8 | -177.5 | 176.6 | 0 | 107.7 | ||||
| 166 | D | 83 | Confident | 87.5 | Confident | 88 Ų | 88 | 105.4 Ų | 105.4 | 47% | 0.471 | 53% | 0.53 | S | S | . | . | trans | -62.5 | 142.4 | 174.3 | -40.7 | -30.3 | 0 | 0 | 0 | 109.5 | N168 A169 | D166-N168 PolarHBondContact O-N 3.24Å; D166-A169 HydrophobicContact CB-CB 3.89Å; D166-A169 WeakPolarHBondContact O-CA 3.47Å; D166-A169 WeakPolarHBondContact O-CB 3.25Å; D166-A169 PolarHBondContact O-N 3.3Å | ||
| 167 | E | 77.2 | Confident | 87.6 | Confident | 193 Ų | 193 | 105.7 Ų | 105.7 | 90% | 0.902 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.5 | -28.4 | 179 | -61.4 | -171.9 | 138 | 0 | 0 | 111.7 | A169 P170 | E167-A169 VanDerWaalsContact C-N 3.34Å; E167-P170 WeakPolarHBondContact O-CD 3.18Å |
| 168 | N | 76.7 | Confident | 87.6 | Confident | 126 Ų | 126 | 107 Ų | 107 | 67% | 0.674 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.4 | -6.9 | 173 | -129.4 | 55.3 | 0 | 0 | 0 | 113.2 | D166 M172 | D166-N168 PolarHBondContact O-N 3.24Å; N168-M172 PolarHBondContact O-N 2.94Å |
| 169 | A | 76.1 | Confident | 87.6 | Confident | 25 Ų | 25 | 110 Ų | 110 | 21% | 0.207 | 55% | 0.551 | C | S | . | * | H | α-helix | trans | -64.2 | -32.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | D166 E167 A171 M172 A173 | D166-A169 HydrophobicContact CB-CB 3.89Å; D166-A169 WeakPolarHBondContact O-CA 3.47Å; D166-A169 WeakPolarHBondContact O-CB 3.25Å; D166-A169 PolarHBondContact O-N 3.3Å; E167-A169 VanDerWaalsContact C-N 3.34Å; A169-A171 PolarHBondContact O-N 3.23Å; A169-M172 PolarHBondContact O-N 3.32Å; A169-A173 WeakPolarHBondContact O-CA 3.48Å; A169-A173 WeakPolarHBondContact O-CB 3.38Å; A169-A173 PolarHBondContact O-N 2.98Å |
| 170 | P | 79.9 | Confident | 87.8 | Confident | 95 Ų | 95 | 112.9 Ų | 112.9 | 62% | 0.617 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66.5 | -40 | -175.8 | 24.7 | -31.4 | 0 | 0 | 0 | 111.9 | E167 K174 | E167-P170 WeakPolarHBondContact O-CD 3.18Å; P170-K174 WeakPolarHBondContact O-CB 3.44Å; P170-K174 PolarHBondContact O-N 2.86Å; P170-K174 VanDerWaalsContact O-N 3.14Å |
| 171 | A | 82.6 | Confident | 88 | Confident | 56 Ų | 56 | 114.9 Ų | 114.9 | 46% | 0.463 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -68.5 | -49.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | A169 A173 K174 Q175 | A169-A171 PolarHBondContact O-N 3.23Å; A171-A173 PolarHBondContact O-N 2.97Å; A171-K174 PolarHBondContact O-N 3.47Å; A171-Q175 WeakPolarHBondContact O-CG 3.36Å; A171-Q175 PolarHBondContact O-N 3.43Å |
| 172 | M | 83.9 | Confident | 88.1 | Confident | 108 Ų | 108 | 114.4 Ų | 114.4 | 53% | 0.532 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -63.9 | -39.6 | 179.4 | -69.9 | -63.6 | -74.5 | 0 | 0 | 112.4 | N168 A169 Q175 M176 | N168-M172 PolarHBondContact O-N 2.94Å; A169-M172 PolarHBondContact O-N 3.32Å; M172-Q175 PolarHBondContact O-N 3.09Å; M172-M176 VanDerWaalsContact O-CB 3.22Å; M172-M176 WeakPolarHBondContact O-CB 3.48Å; M172-M176 PolarHBondContact O-N 2.89Å |
| 173 | A | 86.6 | Confident | 88.4 | Confident | 42 Ų | 42 | 111.1 Ų | 111.1 | 35% | 0.347 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.7 | -38.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | A169 A171 M176 M177 | A169-A173 WeakPolarHBondContact O-CA 3.48Å; A169-A173 WeakPolarHBondContact O-CB 3.38Å; A169-A173 PolarHBondContact O-N 2.98Å; A171-A173 PolarHBondContact O-N 2.97Å; A173-M176 PolarHBondContact O-N 3.27Å; A173-M177 WeakPolarHBondContact O-CB 3.18Å; A173-M177 PolarHBondContact O-N 3.25Å |
| 174 | K | 89.4 | Confident | 88.6 | Confident | 158 Ų | 158 | 110.5 Ų | 110.5 | 69% | 0.687 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.8 | -46.9 | 173.7 | -174.6 | 180 | 178.1 | -176.9 | 0 | 111 | P170 A171 M177 E178 | P170-K174 WeakPolarHBondContact O-CB 3.44Å; P170-K174 PolarHBondContact O-N 2.86Å; P170-K174 VanDerWaalsContact O-N 3.14Å; A171-K174 PolarHBondContact O-N 3.47Å; K174-M177 PolarHBondContact O-N 2.85Å; K174-E178 PolarHBondContact O-N 2.88Å |
| 175 | Q | 91.6 | Very high | 88.9 | Confident | 123 Ų | 123 | 111.9 Ų | 111.9 | 58% | 0.575 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -61.6 | -44.8 | 175.6 | -69.1 | -178.3 | 12.5 | 0 | 0 | 111.7 | A171 M172 M177 E178 H179 | A171-Q175 WeakPolarHBondContact O-CG 3.36Å; A171-Q175 PolarHBondContact O-N 3.43Å; M172-Q175 PolarHBondContact O-N 3.09Å; Q175-M177 VanDerWaalsContact C-N 3.33Å; Q175-M177 PolarHBondContact O-N 3.41Å; Q175-E178 PolarHBondContact O-N 3.35Å; Q175-H179 WeakPolarHBondContact O-CB 3.22Å; Q175-H179 PolarHBondContact O-N 3.29Å |
| 176 | M | 91 | Very high | 89.2 | Confident | 103 Ų | 103 | 110 Ų | 110 | 51% | 0.507 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66.6 | -34.4 | 178.1 | -174.1 | 166.2 | 61.9 | 0 | 0 | 112 | M172 A173 R180 | M172-M176 VanDerWaalsContact O-CB 3.22Å; M172-M176 WeakPolarHBondContact O-CB 3.48Å; M172-M176 PolarHBondContact O-N 2.89Å; A173-M176 PolarHBondContact O-N 3.27Å; M176-R180 VanDerWaalsContact O-CB 3.26Å; M176-R180 WeakPolarHBondContact O-CB 3.47Å; M176-R180 WeakPolarHBondContact O-CG 3.48Å; M176-R180 PolarHBondContact O-N 2.98Å; M176-R180 PolarHBondContact O-NE 2.84Å |
| 177 | M | 93.1 | Very high | 89.9 | Confident | 128 Ų | 128 | 113.4 Ų | 113.4 | 63% | 0.631 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -67.8 | -43.7 | 173.1 | -176.1 | -178 | -68.2 | 0 | 0 | 111.2 | A173 K174 Q175 R180 R181 | A173-M177 WeakPolarHBondContact O-CB 3.18Å; A173-M177 PolarHBondContact O-N 3.25Å; K174-M177 PolarHBondContact O-N 2.85Å; Q175-M177 VanDerWaalsContact C-N 3.33Å; Q175-M177 PolarHBondContact O-N 3.41Å; M177-R180 PolarHBondContact O-N 3.16Å; M177-R181 WeakPolarHBondContact O-CB 3.4Å; M177-R181 PolarHBondContact O-N 3.44Å |
| 178 | E | 95 | Very high | 90.6 | Very high | 102 Ų | 102 | 108.9 Ų | 108.9 | 48% | 0.477 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.8 | -43.3 | 176.6 | -164.2 | -166 | 143.6 | 0 | 0 | 111.5 | K174 Q175 R181 R182 | K174-E178 PolarHBondContact O-N 2.88Å; Q175-E178 PolarHBondContact O-N 3.35Å; E178-R181 WeakPolarHBondContact O-CB 3.3Å; E178-R181 PolarHBondContact O-N 3.37Å; E178-R182 WeakPolarHBondContact O-CB 3.48Å; E178-R182 PolarHBondContact O-N 3.43Å; E178-R182 IonicContact OE1-CZ 3.43Å; E178-R182 IonicContact OE1-NH2 3.78Å; E178-R182 PolarHBondContact OE1-NH2 3.09Å |
| 179 | H | 95.1 | Very high | 91.4 | Very high | 110 Ų | 110 | 106.5 Ų | 106.5 | 51% | 0.509 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60 | -49.9 | 174.4 | -177.9 | 77.4 | 0 | 0 | 0 | 111.2 | Q175 R181 R182 V183 | Q175-H179 WeakPolarHBondContact O-CB 3.22Å; Q175-H179 PolarHBondContact O-N 3.29Å; H179-R181 VanDerWaalsContact C-N 3.32Å; H179-R181 PolarHBondContact O-N 3.29Å; H179-R182 PolarHBondContact O-N 2.91Å; H179-R182 VanDerWaalsContact O-N 3.16Å; H179-V183 WeakPolarHBondContact O-CG2 2.91Å; H179-V183 PolarHBondContact O-N 3.4Å |
| 180 | R | 96.4 | Very high | 92.1 | Very high | 144 Ų | 144 | 110.9 Ų | 110.9 | 54% | 0.543 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -56.3 | -44.5 | 174.8 | -79.3 | -175.5 | -76.3 | -174.5 | -4.6 | 111.7 | M176 M177 L184 | M176-R180 VanDerWaalsContact O-CB 3.26Å; M176-R180 WeakPolarHBondContact O-CB 3.47Å; M176-R180 WeakPolarHBondContact O-CG 3.48Å; M176-R180 PolarHBondContact O-N 2.98Å; M176-R180 PolarHBondContact O-NE 2.84Å; M177-R180 PolarHBondContact O-N 3.16Å; R180-L184 WeakPolarHBondContact O-CB 3.32Å; R180-L184 PolarHBondContact O-N 2.82Å |
| 181 | R | 96.2 | Very high | 92.8 | Very high | 177 Ų | 177 | 115.1 Ų | 115.1 | 67% | 0.668 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -60.6 | -46.6 | 175.9 | -178.5 | -176.7 | -178.6 | -178.8 | 1.4 | 111.7 | M177 E178 H179 L184 L185 | M177-R181 WeakPolarHBondContact O-CB 3.4Å; M177-R181 PolarHBondContact O-N 3.44Å; E178-R181 WeakPolarHBondContact O-CB 3.3Å; E178-R181 PolarHBondContact O-N 3.37Å; H179-R181 VanDerWaalsContact C-N 3.32Å; H179-R181 PolarHBondContact O-N 3.29Å; R181-L184 PolarHBondContact O-N 2.86Å; R181-L185 HydrophobicContact CG-CD1 4.16Å; R181-L185 WeakPolarHBondContact O-CB 3.38Å; R181-L185 VanDerWaalsContact O-CG 3.3Å; R181-L185 WeakPolarHBondContact O-CG 3.34Å; R181-L185 PolarHBondContact O-N 3.36Å |
| 182 | R | 96.2 | Very high | 93.2 | Very high | 148 Ų | 148 | 115 Ų | 115 | 56% | 0.558 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.1 | -48.6 | -178.8 | -167.8 | -173.1 | -56.9 | 158.2 | 2.2 | 111.6 | E178 H179 L184 L185 R186 | E178-R182 WeakPolarHBondContact O-CB 3.48Å; E178-R182 PolarHBondContact O-N 3.43Å; E178-R182 IonicContact OE1-CZ 3.43Å; E178-R182 IonicContact OE1-NH2 3.78Å; E178-R182 PolarHBondContact OE1-NH2 3.09Å; H179-R182 PolarHBondContact O-N 2.91Å; H179-R182 VanDerWaalsContact O-N 3.16Å; R182-L184 VanDerWaalsContact C-N 3.34Å; R182-L185 PolarHBondContact O-N 3.29Å; R182-R186 PolarHBondContact O-N 3.25Å |
| 183 | V | 96.8 | Very high | 93.5 | Very high | 58 Ų | 58 | 113 Ų | 113 | 35% | 0.352 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62 | -43.7 | 176.9 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | H179 R186 K187 | H179-V183 WeakPolarHBondContact O-CG2 2.91Å; H179-V183 PolarHBondContact O-N 3.4Å; V183-R186 PolarHBondContact O-N 3.41Å; V183-K187 PolarHBondContact O-N 2.89Å |
| 184 | L | 97 | Very high | 93.4 | Very high | 102 Ų | 102 | 113.7 Ų | 113.7 | 53% | 0.534 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.2 | -47.1 | 177.7 | 179.7 | 61 | 0 | 0 | 0 | 111.6 | R180 R181 R182 R186 K187 L188 | R180-L184 WeakPolarHBondContact O-CB 3.32Å; R180-L184 PolarHBondContact O-N 2.82Å; R181-L184 PolarHBondContact O-N 2.86Å; R182-L184 VanDerWaalsContact C-N 3.34Å; L184-R186 VanDerWaalsContact C-N 3.33Å; L184-R186 PolarHBondContact O-N 3.31Å; L184-K187 PolarHBondContact O-N 2.93Å; L184-L188 HydrophobicContact CD1-CD1 4.02Å; L184-L188 HydrophobicContact CD1-CG 4.04Å; L184-L188 HydrophobicContact CG-CD1 3.94Å; L184-L188 HydrophobicContact CG-CG 4.36Å; L184-L188 WeakPolarHBondContact O-CB 3.39Å; L184-L188 VanDerWaalsContact O-CG 3.29Å; L184-L188 WeakPolarHBondContact O-CG 3.49Å; L184-L188 PolarHBondContact O-N 3.22Å |
| 185 | L | 95 | Very high | 93.4 | Very high | 104 Ų | 104 | 113.5 Ų | 113.5 | 55% | 0.545 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.3 | -41.6 | 176.9 | -73.3 | 172.6 | 0 | 0 | 0 | 112 | R181 R182 L188 S189 | R181-L185 HydrophobicContact CG-CD1 4.16Å; R181-L185 WeakPolarHBondContact O-CB 3.38Å; R181-L185 VanDerWaalsContact O-CG 3.3Å; R181-L185 WeakPolarHBondContact O-CG 3.34Å; R181-L185 PolarHBondContact O-N 3.36Å; R182-L185 PolarHBondContact O-N 3.29Å; L185-L188 PolarHBondContact O-N 3.34Å; L185-S189 PolarHBondContact O-N 3.31Å |
| 186 | R | 95.1 | Very high | 93.3 | Very high | 121 Ų | 121 | 111.3 Ų | 111.3 | 46% | 0.457 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.5 | -44.6 | 173.9 | -175.2 | -177.3 | -179.4 | 174 | 5.3 | 111.7 | L28 R182 V183 L184 S189 F190 | L28-R186 PolarHBondContact O-NH2 3.49Å; L28-R186 VanDerWaalsContact O-NH2 3.16Å; R182-R186 PolarHBondContact O-N 3.25Å; V183-R186 PolarHBondContact O-N 3.41Å; L184-R186 VanDerWaalsContact C-N 3.33Å; L184-R186 PolarHBondContact O-N 3.31Å; R186-S189 PolarHBondContact O-N 2.71Å; R186-S189 PolarHBondContact O-OG 2.8Å; R186-F190 HydrophobicContact CG-CD2 4.47Å; R186-F190 HydrophobicContact CG-CE2 4.33Å; R186-F190 VanDerWaalsContact O-CD2 3.3Å; R186-F190 WeakPolarHBondContact O-CD2 3.35Å; R186-F190 PolarHBondContact O-N 3.41Å |
| 187 | K | 96.2 | Very high | 93.3 | Very high | 159 Ų | 159 | 107.7 Ų | 107.7 | 69% | 0.691 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -66.7 | -36.9 | 178.2 | -74.7 | -155.8 | 173.9 | -168.3 | 0 | 112.3 | V183 L184 S189 F190 | V183-K187 PolarHBondContact O-N 2.89Å; L184-K187 PolarHBondContact O-N 2.93Å; K187-S189 VanDerWaalsContact C-N 3.34Å; K187-F190 CarbonylContact O-C 3.41Å; K187-F190 PolarHBondContact O-N 2.95Å |
| 188 | L | 93.1 | Very high | 93 | Very high | 98 Ų | 98 | 105.9 Ų | 105.9 | 51% | 0.513 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -70.6 | -27.5 | 177 | -70.2 | 175.8 | 0 | 0 | 0 | 113 | L184 L185 F190 R191 | L184-L188 HydrophobicContact CD1-CD1 4.02Å; L184-L188 HydrophobicContact CD1-CG 4.04Å; L184-L188 HydrophobicContact CG-CD1 3.94Å; L184-L188 HydrophobicContact CG-CG 4.36Å; L184-L188 WeakPolarHBondContact O-CB 3.39Å; L184-L188 VanDerWaalsContact O-CG 3.29Å; L184-L188 WeakPolarHBondContact O-CG 3.49Å; L184-L188 PolarHBondContact O-N 3.22Å; L185-L188 PolarHBondContact O-N 3.34Å; L188-F190 VanDerWaalsContact C-N 3.3Å; L188-R191 VanDerWaalsContact O-CB 3.22Å; L188-R191 WeakPolarHBondContact O-CB 3.43Å; L188-R191 PolarHBondContact O-N 2.87Å |
| 189 | S | 92.5 | Very high | 92.8 | Very high | 76 Ų | 76 | 108.8 Ų | 108.8 | 53% | 0.531 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -71 | -26.3 | 173.8 | 63.6 | 0 | 0 | 0 | 0 | 113.1 | L185 R186 K187 R191 | L185-S189 PolarHBondContact O-N 3.31Å; R186-S189 PolarHBondContact O-N 2.71Å; R186-S189 PolarHBondContact O-OG 2.8Å; K187-S189 VanDerWaalsContact C-N 3.34Å; S189-R191 VanDerWaalsContact C-N 3.32Å |
| 190 | F | 92.2 | Very high | 92.7 | Very high | 117 Ų | 117 | 111.9 Ų | 111.9 | 51% | 0.513 | 51% | 0.508 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.8 | 36.7 | 172.1 | -65.3 | -73.5 | 0 | 0 | 0 | 111.7 | R186 K187 L188 P192 | R186-F190 HydrophobicContact CG-CD2 4.47Å; R186-F190 HydrophobicContact CG-CE2 4.33Å; R186-F190 VanDerWaalsContact O-CD2 3.3Å; R186-F190 WeakPolarHBondContact O-CD2 3.35Å; R186-F190 PolarHBondContact O-N 3.41Å; K187-F190 CarbonylContact O-C 3.41Å; K187-F190 PolarHBondContact O-N 2.95Å; L188-F190 VanDerWaalsContact C-N 3.3Å; F190-P192 WeakPolarHBondContact O-CD 3.38Å |
| 191 | R | 93.7 | Very high | 92.4 | Very high | 184 Ų | 184 | 113.5 Ų | 113.5 | 69% | 0.694 | 52% | 0.522 | S | S | * | . | P | Polyproline II helix | trans | -75.1 | 118 | 176 | -177.8 | 172.7 | -176.4 | -109 | -0.2 | 109.2 | L188 S189 | L188-R191 VanDerWaalsContact O-CB 3.22Å; L188-R191 WeakPolarHBondContact O-CB 3.43Å; L188-R191 PolarHBondContact O-N 2.87Å; S189-R191 VanDerWaalsContact C-N 3.32Å |
| 192 | P | 91.2 | Very high | 92 | Very high | 52 Ų | 52 | 110.4 Ų | 110.4 | 34% | 0.338 | 52% | 0.518 | S | S | . | . | P | Polyproline II helix | trans | -65.6 | 150.3 | 178.9 | 27.7 | -34.5 | 0 | 0 | 0 | 111 | F190 E196 L197 | F190-P192 WeakPolarHBondContact O-CD 3.38Å; P192-E196 VanDerWaalsContact CA-OE2 3.29Å; P192-E196 WeakPolarHBondContact CA-OE2 3.26Å; P192-E196 HydrophobicContact CB-CB 4.48Å; P192-E196 WeakPolarHBondContact CB-OE2 3.48Å; P192-L197 HydrophobicContact CB-CD2 4.28Å; P192-L197 HydrophobicContact CB-CG 4.32Å; P192-L197 HydrophobicContact CG-CD1 4.45Å; P192-L197 HydrophobicContact CG-CD2 3.96Å; P192-L197 HydrophobicContact CG-CG 4.23Å |
| 193 | T | 89.5 | Confident | 91.4 | Very high | 67 Ų | 67 | 104 Ų | 104 | 41% | 0.411 | 49% | 0.494 | S | S | . | . | P | Polyproline II helix | trans | -74.9 | 162.8 | 174.7 | 62.2 | 0 | 0 | 0 | 0 | 111.2 | E195 E196 L197 | T193-E195 PolarHBondContact O-N 3.38Å; T193-E196 PolarHBondContact N-OE2 3.42Å; T193-E196 PolarHBondContact O-N 3.49Å; T193-E196 VanDerWaalsContact OG1-CG 3.22Å; T193-E196 WeakPolarHBondContact OG1-CG 3.22Å; T193-E196 PolarHBondContact OG1-N 3.27Å; T193-E196 PolarHBondContact OG1-OE1 2.86Å; T193-L197 WeakPolarHBondContact O-CG 3.28Å; T193-L197 PolarHBondContact O-N 2.83Å |
| 194 | I | 85.6 | Confident | 90.7 | Very high | 56 Ų | 56 | 108.9 Ų | 108.9 | 29% | 0.287 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.9 | -36 | 177.4 | -65.9 | 165.2 | 0 | 0 | 0 | 110.5 | L197 K198 Y208 V211 | I194-L197 PolarHBondContact O-N 2.87Å; I194-K198 HydrophobicContact CG2-CD 4.34Å; I194-K198 WeakPolarHBondContact O-CG 3.25Å; I194-K198 PolarHBondContact O-N 3.26Å; I194-Y208 HydrophobicContact CG1-CD2 4.3Å; I194-Y208 HydrophobicContact CG2-CD2 4.07Å; I194-V211 HydrophobicContact CD1-CG2 3.71Å |
| 195 | E | 87.9 | Confident | 89.3 | Confident | 155 Ų | 155 | 111 Ų | 111 | 72% | 0.724 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.6 | -47.2 | 177.8 | -65.6 | 174.3 | -176.1 | 0 | 0 | 111.4 | T193 L197 K198 E199 | T193-E195 PolarHBondContact O-N 3.38Å; E195-L197 VanDerWaalsContact C-N 3.29Å; E195-L197 PolarHBondContact O-N 2.94Å; E195-K198 WeakPolarHBondContact O-CB 3.49Å; E195-K198 PolarHBondContact O-N 3.2Å; E195-K198 VanDerWaalsContact O-N 3.1Å; E195-E199 PolarHBondContact O-N 3.02Å |
| 196 | E | 91 | Very high | 88.1 | Confident | 77 Ų | 77 | 112.9 Ų | 112.9 | 36% | 0.36 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -58.3 | -39.6 | 174.7 | -74.1 | 160.3 | -139.8 | 0 | 0 | 112.6 | P192 T193 E199 R200 | P192-E196 VanDerWaalsContact CA-OE2 3.29Å; P192-E196 WeakPolarHBondContact CA-OE2 3.26Å; P192-E196 HydrophobicContact CB-CB 4.48Å; P192-E196 WeakPolarHBondContact CB-OE2 3.48Å; T193-E196 PolarHBondContact N-OE2 3.42Å; T193-E196 PolarHBondContact O-N 3.49Å; T193-E196 VanDerWaalsContact OG1-CG 3.22Å; T193-E196 WeakPolarHBondContact OG1-CG 3.22Å; T193-E196 PolarHBondContact OG1-N 3.27Å; T193-E196 PolarHBondContact OG1-OE1 2.86Å; E196-E199 PolarHBondContact O-N 2.92Å; E196-R200 WeakPolarHBondContact O-CG 3.22Å; E196-R200 PolarHBondContact O-N 2.87Å; E196-R200 VanDerWaalsContact O-N 3.07Å |
| 197 | L | 90.8 | Very high | 87 | Confident | 27 Ų | 27 | 112.6 Ų | 112.6 | 14% | 0.141 | 53% | 0.534 | C | S | . | . | H | α-helix | trans | -69.3 | -33.9 | 177.5 | -67.9 | 176 | 0 | 0 | 0 | 112.3 | P192 T193 I194 E195 Q201 I202 I203 Y208 | P192-L197 HydrophobicContact CB-CD2 4.28Å; P192-L197 HydrophobicContact CB-CG 4.32Å; P192-L197 HydrophobicContact CG-CD1 4.45Å; P192-L197 HydrophobicContact CG-CD2 3.96Å; P192-L197 HydrophobicContact CG-CG 4.23Å; T193-L197 WeakPolarHBondContact O-CG 3.28Å; T193-L197 PolarHBondContact O-N 2.83Å; I194-L197 PolarHBondContact O-N 2.87Å; E195-L197 VanDerWaalsContact C-N 3.29Å; E195-L197 PolarHBondContact O-N 2.94Å; L197-Q201 PolarHBondContact O-N 2.78Å; L197-I202 HydrophobicContact CD2-CB 4.31Å; L197-I202 HydrophobicContact CD2-CD1 3.85Å; L197-I202 HydrophobicContact CD2-CG2 4.32Å; L197-I202 PolarHBondContact O-N 3.3Å; L197-I203 HydrophobicContact CB-CG2 3.6Å; L197-Y208 HydrophobicContact CD1-CE2 4.12Å |
| 198 | K | 86.6 | Confident | 85.5 | Confident | 89 Ų | 89 | 110.2 Ų | 110.2 | 39% | 0.387 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67.8 | -43.4 | 174.6 | -75.5 | 175.5 | 176.8 | 179.1 | 0 | 110.9 | I194 E195 R200 Q201 I203 | I194-K198 HydrophobicContact CG2-CD 4.34Å; I194-K198 WeakPolarHBondContact O-CG 3.25Å; I194-K198 PolarHBondContact O-N 3.26Å; E195-K198 WeakPolarHBondContact O-CB 3.49Å; E195-K198 PolarHBondContact O-N 3.2Å; E195-K198 VanDerWaalsContact O-N 3.1Å; K198-R200 VanDerWaalsContact C-N 3.32Å; K198-R200 PolarHBondContact O-N 3.34Å; K198-Q201 PolarHBondContact O-N 3.16Å; K198-I203 HydrophobicContact CG-CG2 4.08Å |
| 199 | E | 91.6 | Very high | 84.2 | Confident | 163 Ų | 163 | 111.8 Ų | 111.8 | 76% | 0.762 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.5 | -41 | 176.7 | -174.5 | 177 | -162.1 | 0 | 0 | 111.6 | E195 E196 Q201 | E195-E199 PolarHBondContact O-N 3.02Å; E196-E199 PolarHBondContact O-N 2.92Å; E199-Q201 PolarHBondContact O-N 3.15Å |
| 200 | R | 92.6 | Very high | 83.1 | Confident | 176 Ų | 176 | 115.2 Ų | 115.2 | 66% | 0.664 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.1 | 2.5 | 174.7 | -67.2 | -178.6 | -178.3 | 173.3 | 3.3 | 114.5 | E196 K198 I202 | E196-R200 WeakPolarHBondContact O-CG 3.22Å; E196-R200 PolarHBondContact O-N 2.87Å; E196-R200 VanDerWaalsContact O-N 3.07Å; K198-R200 VanDerWaalsContact C-N 3.32Å; K198-R200 PolarHBondContact O-N 3.34Å; R200-I202 HydrophobicContact CB-CD1 3.89Å; R200-I202 HydrophobicContact CB-CG1 3.95Å; R200-I202 PolarHBondContact O-N 2.85Å |
| 201 | Q | 89.6 | Confident | 82 | Confident | 178 Ų | 178 | 114.7 Ų | 114.7 | 83% | 0.832 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.9 | 27.3 | -177.3 | -55.9 | -165.9 | -45.8 | 0 | 0 | 114.6 | L197 K198 E199 | L197-Q201 PolarHBondContact O-N 2.78Å; K198-Q201 PolarHBondContact O-N 3.16Å; E199-Q201 PolarHBondContact O-N 3.15Å |
| 202 | I | 88.1 | Confident | 80.6 | Confident | 112 Ų | 112 | 110.9 Ų | 110.9 | 57% | 0.574 | 55% | 0.546 | S | S | * | . | S | Bend | trans | -76.6 | -32.7 | 177.6 | -66.1 | 171.6 | 0 | 0 | 0 | 110.4 | L197 R200 | L197-I202 HydrophobicContact CD2-CB 4.31Å; L197-I202 HydrophobicContact CD2-CD1 3.85Å; L197-I202 HydrophobicContact CD2-CG2 4.32Å; L197-I202 PolarHBondContact O-N 3.3Å; R200-I202 HydrophobicContact CB-CD1 3.89Å; R200-I202 HydrophobicContact CB-CG1 3.95Å; R200-I202 PolarHBondContact O-N 2.85Å |
| 203 | I | 82.8 | Confident | 79.4 | Confident | 13 Ų | 13 | 116.2 Ų | 116.2 | 7% | 0.067 | 57% | 0.572 | C | S | . | * | S | Bend | trans | -127.4 | 137.6 | -175 | -162.6 | -106.1 | 0 | 0 | 0 | 111.5 | L197 K198 D207 Y208 | L197-I203 HydrophobicContact CB-CG2 3.6Å; K198-I203 HydrophobicContact CG-CG2 4.08Å; I203-D207 HydrophobicContact CD1-CB 3.94Å; I203-D207 HydrophobicContact CG1-CB 4.03Å; I203-Y208 HydrophobicContact CB-CD2 4.35Å; I203-Y208 HydrophobicContact CB-CE2 3.66Å; I203-Y208 HydrophobicContact CD1-CD1 4.19Å; I203-Y208 HydrophobicContact CD1-CD2 2.98Å; I203-Y208 HydrophobicContact CD1-CE1 4.36Å; I203-Y208 HydrophobicContact CD1-CE2 3.18Å; I203-Y208 HydrophobicContact CD1-CG 3.48Å; I203-Y208 VanDerWaalsContact CD1-CG 3.48Å; I203-Y208 HydrophobicContact CG1-CD2 3.6Å; I203-Y208 HydrophobicContact CG1-CE1 4.19Å; I203-Y208 HydrophobicContact CG1-CE2 3.17Å; I203-Y208 HydrophobicContact CG1-CG 4.2Å; I203-Y208 VanDerWaalsContact CG1-CZ 3.48Å; I203-Y208 HydrophobicContact CG2-CD2 4.19Å; I203-Y208 HydrophobicContact CG2-CE2 3.69Å |
| 204 | K | 82.7 | Confident | 78.3 | Confident | 161 Ų | 161 | 116.7 Ų | 116.7 | 70% | 0.7 | 58% | 0.583 | S | S | * | * | trans | -95.3 | 143.3 | 177.3 | -64.3 | 177.4 | -176.7 | 176.9 | 0 | 109.8 | N206 D207 | K204-N206 PolarHBondContact O-N 3.31Å; K204-D207 PolarHBondContact O-N 3.11Å | ||
| 205 | F | 66.8 | Low | 77.7 | Confident | 146 Ų | 146 | 122.3 Ų | 122.3 | 64% | 0.64 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -47.4 | -23.8 | -171.5 | -177.7 | -99.9 | 0 | 0 | 0 | 116.1 | ||
| 206 | N | 70.4 | Confident | 76.9 | Confident | 143 Ų | 143 | 124.4 Ų | 124.4 | 77% | 0.765 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | -12.6 | -178.5 | -58.5 | -30.8 | 0 | 0 | 0 | 115.3 | K204 | K204-N206 PolarHBondContact O-N 3.31Š|
| 207 | D | 72.9 | Confident | 76.1 | Confident | 115 Ų | 115 | 128.2 Ų | 128.2 | 62% | 0.615 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -89.7 | -15.5 | -170.6 | -67.7 | -21.3 | 0 | 0 | 0 | 114.1 | I203 K204 | I203-D207 HydrophobicContact CD1-CB 3.94Å; I203-D207 HydrophobicContact CG1-CB 4.03Å; K204-D207 PolarHBondContact O-N 3.11Å |
| 208 | Y | 64.1 | Low | 75.4 | Confident | 109 Ų | 109 | 132 Ų | 132 | 43% | 0.427 | 65% | 0.653 | S | S | . | * | trans | -111.6 | 123.3 | 176.3 | -68.4 | -35.4 | 0 | 0 | 0 | 111.7 | I194 L197 I203 E210 | I194-Y208 HydrophobicContact CG1-CD2 4.3Å; I194-Y208 HydrophobicContact CG2-CD2 4.07Å; L197-Y208 HydrophobicContact CD1-CE2 4.12Å; I203-Y208 HydrophobicContact CB-CD2 4.35Å; I203-Y208 HydrophobicContact CB-CE2 3.66Å; I203-Y208 HydrophobicContact CD1-CD1 4.19Å; I203-Y208 HydrophobicContact CD1-CD2 2.98Å; I203-Y208 HydrophobicContact CD1-CE1 4.36Å; I203-Y208 HydrophobicContact CD1-CE2 3.18Å; I203-Y208 HydrophobicContact CD1-CG 3.48Å; I203-Y208 VanDerWaalsContact CD1-CG 3.48Å; I203-Y208 HydrophobicContact CG1-CD2 3.6Å; I203-Y208 HydrophobicContact CG1-CE1 4.19Å; I203-Y208 HydrophobicContact CG1-CE2 3.17Å; I203-Y208 HydrophobicContact CG1-CG 4.2Å; I203-Y208 VanDerWaalsContact CG1-CZ 3.48Å; I203-Y208 HydrophobicContact CG2-CD2 4.19Å; I203-Y208 HydrophobicContact CG2-CE2 3.69Å; Y208-E210 PolarHBondContact O-N 2.77Å | ||
| 209 | V | 65.5 | Low | 75 | Confident | 132 Ų | 132 | 136.5 Ų | 136.5 | 80% | 0.8 | 67% | 0.667 | S | S | * | * | trans | -61.3 | 124.8 | 158.2 | -175.4 | 0 | 0 | 0 | 0 | 106.4 | V211 | V209-V211 PolarHBondContact O-N 2.8Š| ||
| 210 | E | 69.7 | Low | 74.2 | Confident | 147 Ų | 147 | 139 Ų | 139 | 69% | 0.687 | 67% | 0.67 | S | S | * | * | trans | -46 | 129.5 | 172.4 | -63.4 | -178.5 | 168.5 | 0 | 0 | 108.7 | Y208 T212 | Y208-E210 PolarHBondContact O-N 2.77Å; E210-T212 PolarHBondContact O-N 2.77Å | ||
| 211 | V | 69.3 | Low | 73.2 | Confident | 106 Ų | 106 | 133.3 Ų | 133.3 | 64% | 0.642 | 66% | 0.66 | S | S | * | * | trans | -72.4 | 78.5 | 176.3 | 179.8 | 0 | 0 | 0 | 0 | 106.9 | I194 V209 | I194-V211 HydrophobicContact CD1-CG2 3.71Å; V209-V211 PolarHBondContact O-N 2.8Å | ||
| 212 | T | 63 | Low | 72.4 | Confident | 105 Ų | 105 | 129.5 Ų | 129.5 | 64% | 0.644 | 65% | 0.645 | S | S | * | * | trans | -66.1 | 137.6 | 167.9 | 41.8 | 0 | 0 | 0 | 0 | 108.4 | E210 A214 | E210-T212 PolarHBondContact O-N 2.77Å; T212-A214 PolarHBondContact O-N 3.39Å | ||
| 213 | N | 66.3 | Low | 72.1 | Confident | 163 Ų | 163 | 129.2 Ų | 129.2 | 87% | 0.872 | 64% | 0.64 | S | S | * | * | trans | -55.6 | 106.2 | 172.6 | -72.4 | -28.8 | 0 | 0 | 0 | 108.6 | E215 | N213-E215 PolarHBondContact O-N 2.89Š| ||
| 214 | A | 66.3 | Low | 71.8 | Confident | 78 Ų | 78 | 133.2 Ų | 133.2 | 65% | 0.645 | 67% | 0.667 | S | S | * | * | trans | -65.7 | 129.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | T212 M216 | T212-A214 PolarHBondContact O-N 3.39Å; A214-M216 PolarHBondContact O-N 3.36Å | ||
| 215 | E | 74.1 | Confident | 71.8 | Confident | 174 Ų | 174 | 133.5 Ų | 133.5 | 81% | 0.813 | 66% | 0.663 | S | S | * | * | trans | -53.4 | 130.2 | 170.9 | -68.6 | -178.1 | 165.4 | 0 | 0 | 109.1 | N213 Y217 | N213-E215 PolarHBondContact O-N 2.89Å; E215-Y217 VanDerWaalsContact C-N 3.25Å; E215-Y217 WeakPolarHBondContact O-CD1 3.46Å; E215-Y217 PolarHBondContact O-N 3.03Å | ||
| 216 | M | 71.1 | Confident | 72.5 | Confident | 199 Ų | 199 | 129.6 Ų | 129.6 | 98% | 0.98 | 66% | 0.658 | S | S | * | * | trans | -71.2 | 86.5 | 172.9 | -82.1 | -176.4 | 178.4 | 0 | 0 | 108.7 | A214 | A214-M216 PolarHBondContact O-N 3.36Š| ||
| 217 | Y | 73.6 | Confident | 73 | Confident | 157 Ų | 157 | 131 Ų | 131 | 62% | 0.616 | 65% | 0.653 | S | S | * | * | trans | -91.2 | 143.8 | 163.4 | 69.1 | -86.4 | 0 | 0 | 0 | 109.7 | E215 R219 | E215-Y217 VanDerWaalsContact C-N 3.25Å; E215-Y217 WeakPolarHBondContact O-CD1 3.46Å; E215-Y217 PolarHBondContact O-N 3.03Å; Y217-R219 HydrophobicContact CD2-CG 4.22Å; Y217-R219 HydrophobicContact CE2-CG 3.73Å; Y217-R219 PolarHBondContact O-N 3.35Å; Y217-R219 VanDerWaalsContact O-N 3.09Å | ||
| 218 | D | 77.1 | Confident | 73.5 | Confident | 107 Ų | 107 | 128 Ų | 128 | 57% | 0.572 | 64% | 0.636 | S | S | * | * | trans | -69.9 | 106.9 | 178.9 | -175.1 | 8.9 | 0 | 0 | 0 | 110.7 | R220 A221 | D218-R220 PolarHBondContact O-N 3.43Å; D218-R220 WeakPolarHBondContact OD1-CA 3.26Å; D218-R220 VanDerWaalsContact OD1-CB 3.25Å; D218-R220 WeakPolarHBondContact OD1-CB 3.32Å; D218-R220 PolarHBondContact OD1-N 3.44Å; D218-A221 WeakPolarHBondContact O-CB 3.32Å; D218-A221 PolarHBondContact O-N 3.38Å | ||
| 219 | R | 76.5 | Confident | 74.5 | Confident | 183 Ų | 183 | 125.9 Ų | 125.9 | 69% | 0.691 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | -12.4 | 175.8 | -62.7 | -176.5 | -176.9 | 177.3 | 2 | 113.3 | Y217 | Y217-R219 HydrophobicContact CD2-CG 4.22Å; Y217-R219 HydrophobicContact CE2-CG 3.73Å; Y217-R219 PolarHBondContact O-N 3.35Å; Y217-R219 VanDerWaalsContact O-N 3.09Å |
| 220 | R | 75.7 | Confident | 75.5 | Confident | 216 Ų | 216 | 124.4 Ų | 124.4 | 82% | 0.815 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | -15 | 177.6 | -56.9 | 176.8 | 69.6 | -173.3 | 0.8 | 111.9 | D218 D222 | D218-R220 PolarHBondContact O-N 3.43Å; D218-R220 WeakPolarHBondContact OD1-CA 3.26Å; D218-R220 VanDerWaalsContact OD1-CB 3.25Å; D218-R220 WeakPolarHBondContact OD1-CB 3.32Å; D218-R220 PolarHBondContact OD1-N 3.44Å; R220-D222 PolarHBondContact O-N 3.32Å |
| 221 | A | 71.2 | Confident | 76.3 | Confident | 55 Ų | 55 | 125.6 Ų | 125.6 | 46% | 0.455 | 63% | 0.631 | S | S | . | * | S | Bend | trans | -50.6 | 141.2 | 171.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | D218 K223 | D218-A221 WeakPolarHBondContact O-CB 3.32Å; D218-A221 PolarHBondContact O-N 3.38Å; A221-K223 PolarHBondContact O-N 3.47Å |
| 222 | D | 73.6 | Confident | 77.2 | Confident | 99 Ų | 99 | 122.7 Ų | 122.7 | 53% | 0.529 | 61% | 0.612 | S | S | . | * | trans | -50.9 | 111.4 | 179.6 | -85.8 | -25.6 | 0 | 0 | 0 | 110 | R220 R227 | R220-D222 PolarHBondContact O-N 3.32Å; D222-R227 VanDerWaalsContact CB-NH2 3.34Å; D222-R227 IonicContact OD2-CZ 3.81Å; D222-R227 IonicContact OD2-NE 2.81Å; D222-R227 IonicContact OD2-NH2 3.54Å; D222-R227 PolarHBondContact OD2-NH2 2.82Å | ||
| 223 | K | 81.5 | Confident | 78.4 | Confident | 106 Ų | 106 | 123.4 Ų | 123.4 | 46% | 0.461 | 61% | 0.606 | S | S | . | * | trans | -60.2 | 134 | 173.9 | -58.6 | 129.3 | 165.6 | -176.6 | 0 | 107.2 | A221 W225 A226 | A221-K223 PolarHBondContact O-N 3.47Å; K223-W225 HydrophobicContact CB-CD2 3.41Å; K223-W225 VanDerWaalsContact CB-CD2 3.41Å; K223-W225 HydrophobicContact CB-CE3 3.62Å; K223-W225 HydrophobicContact CB-CG 4.15Å; K223-W225 HydrophobicContact CB-CH2 3.53Å; K223-W225 HydrophobicContact CB-CZ2 3.32Å; K223-W225 HydrophobicContact CB-CZ3 3.66Å; K223-W225 HydrophobicContact CD-CH2 3.98Å; K223-W225 HydrophobicContact CD-CZ2 3.28Å; K223-W225 HydrophobicContact CG-CD2 4.33Å; K223-W225 HydrophobicContact CG-CE3 4.47Å; K223-W225 HydrophobicContact CG-CH2 3.43Å; K223-W225 VanDerWaalsContact CG-CH2 3.43Å; K223-W225 HydrophobicContact CG-CZ2 3.24Å; K223-W225 HydrophobicContact CG-CZ3 4.05Å; K223-W225 PolarHBondContact O-N 2.89Å; K223-A226 WeakPolarHBondContact O-CB 3.14Å; K223-A226 PolarHBondContact O-N 3.06Å | ||
| 224 | P | 76 | Confident | 79.4 | Confident | 97 Ų | 97 | 119.2 Ų | 119.2 | 63% | 0.63 | 59% | 0.586 | S | S | * | * | G | 310 helix | trans | -57.3 | -27.3 | -172.4 | 20.6 | -32.5 | 0 | 0 | 0 | 113 | A226 R227 | P224-A226 PolarHBondContact O-N 3.34Å; P224-R227 PolarHBondContact O-N 3.29Å |
| 225 | W | 82.3 | Confident | 80.4 | Confident | 166 Ų | 166 | 123.5 Ų | 123.5 | 63% | 0.629 | 59% | 0.586 | S | S | * | * | G | 310 helix | trans | -67.4 | -16.7 | 173.7 | 65.4 | 80.2 | 0 | 0 | 0 | 114.9 | K223 R227 L228 | K223-W225 HydrophobicContact CB-CD2 3.41Å; K223-W225 VanDerWaalsContact CB-CD2 3.41Å; K223-W225 HydrophobicContact CB-CE3 3.62Å; K223-W225 HydrophobicContact CB-CG 4.15Å; K223-W225 HydrophobicContact CB-CH2 3.53Å; K223-W225 HydrophobicContact CB-CZ2 3.32Å; K223-W225 HydrophobicContact CB-CZ3 3.66Å; K223-W225 HydrophobicContact CD-CH2 3.98Å; K223-W225 HydrophobicContact CD-CZ2 3.28Å; K223-W225 HydrophobicContact CG-CD2 4.33Å; K223-W225 HydrophobicContact CG-CE3 4.47Å; K223-W225 HydrophobicContact CG-CH2 3.43Å; K223-W225 VanDerWaalsContact CG-CH2 3.43Å; K223-W225 HydrophobicContact CG-CZ2 3.24Å; K223-W225 HydrophobicContact CG-CZ3 4.05Å; K223-W225 PolarHBondContact O-N 2.89Å; W225-R227 VanDerWaalsContact C-N 3.31Å; W225-L228 WeakPolarHBondContact O-CB 3.37Å |
| 226 | A | 82.1 | Confident | 80.9 | Confident | 65 Ų | 65 | 120.2 Ų | 120.2 | 54% | 0.537 | 57% | 0.569 | S | S | . | * | G | 310 helix | trans | -72.7 | -26 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | K223 P224 L228 | K223-A226 WeakPolarHBondContact O-CB 3.14Å; K223-A226 PolarHBondContact O-N 3.06Å; P224-A226 PolarHBondContact O-N 3.34Å; A226-L228 VanDerWaalsContact C-N 3.34Å |
| 227 | R | 81.2 | Confident | 81.6 | Confident | 172 Ų | 172 | 117.9 Ų | 117.9 | 65% | 0.649 | 55% | 0.554 | S | S | * | * | G | 310 helix | trans | -89.6 | 3.6 | 177.8 | -62.9 | -177 | -178.7 | 134.7 | 1.9 | 113.7 | D222 P224 W225 T229 | D222-R227 VanDerWaalsContact CB-NH2 3.34Å; D222-R227 IonicContact OD2-CZ 3.81Å; D222-R227 IonicContact OD2-NE 2.81Å; D222-R227 IonicContact OD2-NH2 3.54Å; D222-R227 PolarHBondContact OD2-NH2 2.82Å; P224-R227 PolarHBondContact O-N 3.29Å; W225-R227 VanDerWaalsContact C-N 3.31Å; R227-T229 PolarHBondContact O-N 2.65Å |
| 228 | L | 83 | Confident | 82.1 | Confident | 51 Ų | 51 | 117.8 Ų | 117.8 | 27% | 0.267 | 55% | 0.553 | S | S | . | * | trans | -68.9 | 116.9 | 177.7 | -111.6 | 59.6 | 0 | 0 | 0 | 110.4 | W225 A226 D232 K233 F236 | W225-L228 WeakPolarHBondContact O-CB 3.37Å; A226-L228 VanDerWaalsContact C-N 3.34Å; L228-D232 HydrophobicContact CB-CB 4.43Å; L228-D232 HydrophobicContact CG-CB 3.86Å; L228-K233 HydrophobicContact CB-CG 4.01Å; L228-K233 HydrophobicContact CD2-CG 4.08Å; L228-K233 HydrophobicContact CG-CG 4.45Å; L228-K233 WeakPolarHBondContact O-CE 3.48Å; L228-F236 HydrophobicContact CD1-CE2 3.74Å; L228-F236 HydrophobicContact CD1-CZ 4.43Å; L228-F236 HydrophobicContact CD2-CD2 3.47Å; L228-F236 VanDerWaalsContact CD2-CD2 3.47Å; L228-F236 HydrophobicContact CD2-CE2 3.46Å; L228-F236 VanDerWaalsContact CD2-CE2 3.46Å; L228-F236 HydrophobicContact CG-CD2 4.06Å; L228-F236 HydrophobicContact CG-CE2 3.6Å | ||
| 229 | T | 85.1 | Confident | 82.5 | Confident | 65 Ų | 65 | 119.2 Ų | 119.2 | 40% | 0.399 | 56% | 0.555 | S | S | . | * | trans | -67.5 | 158.1 | 172.1 | 68.1 | 0 | 0 | 0 | 0 | 110.2 | R227 K231 D232 K233 | R227-T229 PolarHBondContact O-N 2.65Å; T229-K231 PolarHBondContact O-N 2.79Å; T229-K231 VanDerWaalsContact O-N 3.15Å; T229-D232 WeakPolarHBondContact CB-OD2 3.19Å; T229-D232 PolarHBondContact N-OD2 3.08Å; T229-D232 VanDerWaalsContact N-OD2 3.15Å; T229-D232 WeakPolarHBondContact O-CB 3.4Å; T229-D232 PolarHBondContact O-N 3.26Å; T229-D232 PolarHBondContact OG1-N 3.49Å; T229-D232 PolarHBondContact OG1-OD2 3.31Å; T229-K233 PolarHBondContact O-N 2.84Å | ||
| 230 | P | 86.9 | Confident | 82.9 | Confident | 102 Ų | 102 | 115.5 Ų | 115.5 | 66% | 0.662 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -52.4 | -34.9 | 172.6 | -28.2 | 35.8 | 0 | 0 | 0 | 113 | K233 V234 | P230-K233 PolarHBondContact O-N 2.86Å; P230-V234 WeakPolarHBondContact O-CB 3.29Å; P230-V234 WeakPolarHBondContact O-CG2 3.43Å; P230-V234 PolarHBondContact O-N 2.99Å |
| 231 | K | 86.3 | Confident | 83.3 | Confident | 172 Ų | 172 | 108.3 Ų | 108.3 | 75% | 0.748 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.5 | -42.4 | 174.5 | -68.6 | -177.4 | 178.6 | 178.4 | 0 | 112.2 | T229 V234 R235 | T229-K231 PolarHBondContact O-N 2.79Å; T229-K231 VanDerWaalsContact O-N 3.15Å; K231-V234 PolarHBondContact O-N 2.74Å; K231-R235 WeakPolarHBondContact O-CB 3.16Å; K231-R235 PolarHBondContact O-N 3.37Å |
| 232 | D | 89.2 | Confident | 83.8 | Confident | 44 Ų | 44 | 109.3 Ų | 109.3 | 24% | 0.235 | 53% | 0.53 | C | S | . | . | H | α-helix | trans | -66.8 | -45.2 | 177.7 | -60.3 | -43.5 | 0 | 0 | 0 | 110.9 | L228 T229 V234 R235 F236 | L228-D232 HydrophobicContact CB-CB 4.43Å; L228-D232 HydrophobicContact CG-CB 3.86Å; T229-D232 WeakPolarHBondContact CB-OD2 3.19Å; T229-D232 PolarHBondContact N-OD2 3.08Å; T229-D232 VanDerWaalsContact N-OD2 3.15Å; T229-D232 WeakPolarHBondContact O-CB 3.4Å; T229-D232 PolarHBondContact O-N 3.26Å; T229-D232 PolarHBondContact OG1-N 3.49Å; T229-D232 PolarHBondContact OG1-OD2 3.31Å; D232-V234 VanDerWaalsContact C-N 3.29Å; D232-V234 PolarHBondContact O-N 3.34Å; D232-R235 WeakPolarHBondContact O-CB 3.48Å; D232-R235 PolarHBondContact O-N 3.29Å; D232-R235 VanDerWaalsContact O-N 3.1Å; D232-R235 IonicContact OD1-NH1 3.6Å; D232-R235 PolarHBondContact OD1-NH1 3.43Å; D232-F236 HydrophobicContact CB-CD2 4.33Å; D232-F236 HydrophobicContact CB-CE2 3.91Å; D232-F236 WeakPolarHBondContact O-CD2 3.35Å; D232-F236 WeakPolarHBondContact O-CG 3.14Å; D232-F236 PolarHBondContact O-N 3.27Å |
| 233 | K | 87.2 | Confident | 84.2 | Confident | 120 Ų | 120 | 111.3 Ų | 111.3 | 52% | 0.522 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -54.6 | -46.2 | 175.4 | -65.9 | 177.3 | -176.4 | 176.3 | 0 | 111.6 | L228 T229 P230 F236 F237 | L228-K233 HydrophobicContact CB-CG 4.01Å; L228-K233 HydrophobicContact CD2-CG 4.08Å; L228-K233 HydrophobicContact CG-CG 4.45Å; L228-K233 WeakPolarHBondContact O-CE 3.48Å; T229-K233 PolarHBondContact O-N 2.84Å; P230-K233 PolarHBondContact O-N 2.86Å; K233-F236 PolarHBondContact O-N 2.96Å; K233-F237 WeakPolarHBondContact O-CB 3.05Å; K233-F237 PolarHBondContact O-N 3.37Å |
| 234 | V | 88.2 | Confident | 84.2 | Confident | 76 Ų | 76 | 110 Ų | 110 | 46% | 0.461 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.4 | -42.3 | 177.5 | 171.9 | 0 | 0 | 0 | 0 | 111.2 | P230 K231 D232 F236 F237 Y238 | P230-V234 WeakPolarHBondContact O-CB 3.29Å; P230-V234 WeakPolarHBondContact O-CG2 3.43Å; P230-V234 PolarHBondContact O-N 2.99Å; K231-V234 PolarHBondContact O-N 2.74Å; D232-V234 VanDerWaalsContact C-N 3.29Å; D232-V234 PolarHBondContact O-N 3.34Å; V234-F236 PolarHBondContact O-N 2.95Å; V234-F237 PolarHBondContact O-N 3.37Å; V234-Y238 HydrophobicContact CG1-CD2 3.48Å; V234-Y238 VanDerWaalsContact CG1-CD2 3.48Å; V234-Y238 HydrophobicContact CG1-CE2 3.2Å; V234-Y238 WeakPolarHBondContact O-CD2 3.3Å; V234-Y238 PolarHBondContact O-N 3.23Å |
| 235 | R | 86.2 | Confident | 84.5 | Confident | 167 Ų | 167 | 110.9 Ų | 110.9 | 63% | 0.63 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.9 | -44.7 | 175.5 | -175.9 | -175.1 | -75.6 | 142.3 | -9.4 | 111.9 | K231 D232 F237 Y238 F239 | K231-R235 WeakPolarHBondContact O-CB 3.16Å; K231-R235 PolarHBondContact O-N 3.37Å; D232-R235 WeakPolarHBondContact O-CB 3.48Å; D232-R235 PolarHBondContact O-N 3.29Å; D232-R235 VanDerWaalsContact O-N 3.1Å; D232-R235 IonicContact OD1-NH1 3.6Å; D232-R235 PolarHBondContact OD1-NH1 3.43Å; R235-F237 VanDerWaalsContact C-N 3.32Å; R235-F237 PolarHBondContact O-N 2.92Å; R235-Y238 PolarHBondContact O-N 3.33Å; R235-F239 WeakPolarHBondContact O-CB 3.16Å; R235-F239 PolarHBondContact O-N 3.2Å |
| 236 | F | 86.2 | Confident | 84.3 | Confident | 105 Ų | 105 | 106.7 Ų | 106.7 | 46% | 0.461 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62 | -41.9 | 175.2 | -68.9 | -61.8 | 0 | 0 | 0 | 111.4 | L228 D232 K233 V234 F239 I240 | L228-F236 HydrophobicContact CD1-CE2 3.74Å; L228-F236 HydrophobicContact CD1-CZ 4.43Å; L228-F236 HydrophobicContact CD2-CD2 3.47Å; L228-F236 VanDerWaalsContact CD2-CD2 3.47Å; L228-F236 HydrophobicContact CD2-CE2 3.46Å; L228-F236 VanDerWaalsContact CD2-CE2 3.46Å; L228-F236 HydrophobicContact CG-CD2 4.06Å; L228-F236 HydrophobicContact CG-CE2 3.6Å; D232-F236 HydrophobicContact CB-CD2 4.33Å; D232-F236 HydrophobicContact CB-CE2 3.91Å; D232-F236 WeakPolarHBondContact O-CD2 3.35Å; D232-F236 WeakPolarHBondContact O-CG 3.14Å; D232-F236 PolarHBondContact O-N 3.27Å; K233-F236 PolarHBondContact O-N 2.96Å; V234-F236 PolarHBondContact O-N 2.95Å; F236-F239 PolarHBondContact O-N 3.1Å; F236-I240 WeakPolarHBondContact O-CG1 3.25Å; F236-I240 PolarHBondContact O-N 3.42Å |
| 237 | F | 85.2 | Confident | 84.2 | Confident | 150 Ų | 150 | 107.3 Ų | 107.3 | 66% | 0.658 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.3 | -43.3 | 176.5 | -163.9 | -95.8 | 0 | 0 | 0 | 112 | K233 V234 R235 I240 C241 | K233-F237 WeakPolarHBondContact O-CB 3.05Å; K233-F237 PolarHBondContact O-N 3.37Å; V234-F237 PolarHBondContact O-N 3.37Å; R235-F237 VanDerWaalsContact C-N 3.32Å; R235-F237 PolarHBondContact O-N 2.92Å; F237-I240 PolarHBondContact O-N 3.33Å; F237-C241 WeakPolarHBondContact O-CB 3.22Å; F237-C241 PolarHBondContact O-N 3.03Å |
| 238 | Y | 84.6 | Confident | 84 | Confident | 155 Ų | 155 | 102.4 Ų | 102.4 | 61% | 0.608 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.2 | -39.1 | 173.8 | -78.9 | -62.7 | 0 | 0 | 0 | 112.6 | V234 R235 C241 T242 | V234-Y238 HydrophobicContact CG1-CD2 3.48Å; V234-Y238 VanDerWaalsContact CG1-CD2 3.48Å; V234-Y238 HydrophobicContact CG1-CE2 3.2Å; V234-Y238 WeakPolarHBondContact O-CD2 3.3Å; V234-Y238 PolarHBondContact O-N 3.23Å; R235-Y238 PolarHBondContact O-N 3.33Å; Y238-C241 PolarHBondContact O-N 3.37Å; Y238-T242 VanDerWaalsContact O-CB 3.32Å; Y238-T242 WeakPolarHBondContact O-CB 3.22Å; Y238-T242 VanDerWaalsContact O-CG2 3.26Å; Y238-T242 WeakPolarHBondContact O-CG2 3.32Å; Y238-T242 PolarHBondContact O-N 2.95Å; Y238-T242 PolarHBondContact O-OG1 3.49Å |
| 239 | F | 84.4 | Confident | 83.4 | Confident | 138 Ų | 138 | 107.2 Ų | 107.2 | 61% | 0.605 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64 | -45.3 | 177.4 | -174.4 | -99.6 | 0 | 0 | 0 | 111.3 | R235 F236 T242 Y243 | R235-F239 WeakPolarHBondContact O-CB 3.16Å; R235-F239 PolarHBondContact O-N 3.2Å; F236-F239 PolarHBondContact O-N 3.1Å; F239-T242 PolarHBondContact O-OG1 3.47Å; F239-T242 VanDerWaalsContact O-OG1 3.11Å; F239-Y243 WeakPolarHBondContact O-CB 3.43Å; F239-Y243 PolarHBondContact O-N 3.29Å |
| 240 | I | 85.9 | Confident | 82.8 | Confident | 105 Ų | 105 | 113.6 Ų | 113.6 | 54% | 0.538 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.8 | -45.1 | 175.9 | -65.2 | 165.9 | 0 | 0 | 0 | 110.3 | F236 F237 Y243 V244 | F236-I240 WeakPolarHBondContact O-CG1 3.25Å; F236-I240 PolarHBondContact O-N 3.42Å; F237-I240 PolarHBondContact O-N 3.33Å; I240-Y243 PolarHBondContact O-N 3.03Å; I240-V244 HydrophobicContact CG2-CG2 4.14Å; I240-V244 WeakPolarHBondContact O-CB 3.26Å; I240-V244 VanDerWaalsContact O-CG2 3.25Å; I240-V244 WeakPolarHBondContact O-CG2 3.46Å; I240-V244 PolarHBondContact O-N 3.41Å |
| 241 | C | 82.8 | Confident | 82.3 | Confident | 65 Ų | 65 | 113.4 Ų | 113.4 | 44% | 0.439 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.1 | -45.2 | -179.5 | -172.1 | 0 | 0 | 0 | 0 | 111.5 | F237 Y238 F245 | F237-C241 WeakPolarHBondContact O-CB 3.22Å; F237-C241 PolarHBondContact O-N 3.03Å; Y238-C241 PolarHBondContact O-N 3.37Å; C241-F245 WeakPolarHBondContact O-CA 3.39Å; C241-F245 WeakPolarHBondContact O-CB 3.29Å; C241-F245 PolarHBondContact O-N 2.78Å |
| 242 | T | 81.7 | Confident | 81.6 | Confident | 76 Ų | 76 | 114.9 Ų | 114.9 | 47% | 0.466 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -68.2 | -38.3 | 175.6 | 53.1 | 0 | 0 | 0 | 0 | 111.8 | Y238 F239 V246 | Y238-T242 VanDerWaalsContact O-CB 3.32Å; Y238-T242 WeakPolarHBondContact O-CB 3.22Å; Y238-T242 VanDerWaalsContact O-CG2 3.26Å; Y238-T242 WeakPolarHBondContact O-CG2 3.32Å; Y238-T242 PolarHBondContact O-N 2.95Å; Y238-T242 PolarHBondContact O-OG1 3.49Å; F239-T242 PolarHBondContact O-OG1 3.47Å; F239-T242 VanDerWaalsContact O-OG1 3.11Å; T242-V246 WeakPolarHBondContact O-CB 3.33Å; T242-V246 WeakPolarHBondContact O-CG2 3.45Å; T242-V246 PolarHBondContact O-N 3.07Å |
| 243 | Y | 83.5 | Confident | 80.2 | Confident | 141 Ų | 141 | 124.6 Ų | 124.6 | 55% | 0.553 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -66.9 | -44.3 | 176.8 | -170.4 | -93.7 | 0 | 0 | 0 | 111.8 | F239 I240 N247 | F239-Y243 WeakPolarHBondContact O-CB 3.43Å; F239-Y243 PolarHBondContact O-N 3.29Å; I240-Y243 PolarHBondContact O-N 3.03Å; Y243-N247 WeakPolarHBondContact CD1-ND2 3.22Å; Y243-N247 VanDerWaalsContact CD2-ND2 3.32Å; Y243-N247 WeakPolarHBondContact CD2-ND2 2.89Å; Y243-N247 VanDerWaalsContact CE1-ND2 3.33Å; Y243-N247 WeakPolarHBondContact CE1-ND2 3.11Å; Y243-N247 WeakPolarHBondContact CE2-ND2 3.47Å; Y243-N247 WeakPolarHBondContact O-CB 3.39Å; Y243-N247 PolarHBondContact O-N 3.24Å; Y243-N247 PolarHBondContact O-ND2 3.1Å |
| 244 | V | 81.1 | Confident | 79.9 | Confident | 77 Ų | 77 | 124.9 Ų | 124.9 | 47% | 0.467 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -67 | -45 | 175.2 | 173.9 | 0 | 0 | 0 | 0 | 110 | I240 N247 V248 | I240-V244 HydrophobicContact CG2-CG2 4.14Å; I240-V244 WeakPolarHBondContact O-CB 3.26Å; I240-V244 VanDerWaalsContact O-CG2 3.25Å; I240-V244 WeakPolarHBondContact O-CG2 3.46Å; I240-V244 PolarHBondContact O-N 3.41Å; V244-N247 PolarHBondContact O-N 3.07Å; V244-V248 HydrophobicContact CG1-CG2 3.84Å; V244-V248 WeakPolarHBondContact O-CA 3.13Å; V244-V248 WeakPolarHBondContact O-CB 3.43Å; V244-V248 VanDerWaalsContact O-CG2 3.26Å; V244-V248 WeakPolarHBondContact O-CG2 3.27Å; V244-V248 PolarHBondContact O-N 3.43Å |
| 245 | F | 80.8 | Confident | 79.4 | Confident | 117 Ų | 117 | 127.4 Ų | 127.4 | 51% | 0.513 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -61.3 | -49.4 | 178 | -170 | -96 | 0 | 0 | 0 | 110.6 | C241 Y249 | C241-F245 WeakPolarHBondContact O-CA 3.39Å; C241-F245 WeakPolarHBondContact O-CB 3.29Å; C241-F245 PolarHBondContact O-N 2.78Å; F245-Y249 HydrophobicContact CD1-CD2 4.45Å; F245-Y249 AromaticContact CD2-CD2 3.46Å; F245-Y249 HydrophobicContact CD2-CD2 3.46Å; F245-Y249 VanDerWaalsContact CD2-CD2 3.46Å; F245-Y249 AromaticContact CD2-CE2 3.44Å; F245-Y249 HydrophobicContact CD2-CE2 3.44Å; F245-Y249 VanDerWaalsContact CD2-CE2 3.44Å; F245-Y249 HydrophobicContact CD2-CG 4.36Å; F245-Y249 HydrophobicContact CE1-CD2 4.48Å; F245-Y249 HydrophobicContact CE2-CD1 4.46Å; F245-Y249 AromaticContact CE2-CD2 3.5Å; F245-Y249 HydrophobicContact CE2-CD2 3.5Å; F245-Y249 VanDerWaalsContact CE2-CD2 3.5Å; F245-Y249 HydrophobicContact CE2-CE1 4.27Å; F245-Y249 AromaticContact CE2-CE2 3.25Å; F245-Y249 HydrophobicContact CE2-CE2 3.25Å; F245-Y249 HydrophobicContact CE2-CG 4.11Å; F245-Y249 AromaticContact CE2-CZ 3.67Å; F245-Y249 AromaticContact CG-CD2 3.97Å; F245-Y249 HydrophobicContact CG-CD2 3.97Å; F245-Y249 HydrophobicContact CG-CE2 4.39Å; F245-Y249 HydrophobicContact CZ-CD1 4.4Å; F245-Y249 HydrophobicContact CZ-CD2 4.03Å; F245-Y249 HydrophobicContact CZ-CE1 4.45Å; F245-Y249 HydrophobicContact CZ-CE2 4.09Å; F245-Y249 HydrophobicContact CZ-CG 4.19Å; F245-Y249 WeakPolarHBondContact O-CA 3.33Å; F245-Y249 WeakPolarHBondContact O-CB 3.35Å; F245-Y249 PolarHBondContact O-N 2.92Å |
| 246 | V | 79.3 | Confident | 79 | Confident | 78 Ų | 78 | 125.2 Ų | 125.2 | 47% | 0.473 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -66.6 | -44.6 | 179.1 | 174 | 0 | 0 | 0 | 0 | 111.5 | T242 R250 | T242-V246 WeakPolarHBondContact O-CB 3.33Å; T242-V246 WeakPolarHBondContact O-CG2 3.45Å; T242-V246 PolarHBondContact O-N 3.07Å; V246-R250 WeakPolarHBondContact O-CB 3.22Å; V246-R250 PolarHBondContact O-N 3.04Å |
| 247 | N | 78.6 | Confident | 78.6 | Confident | 77 Ų | 77 | 126.4 Ų | 126.4 | 41% | 0.412 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -76.1 | -39.8 | -177.2 | -75.5 | -80.8 | 0 | 0 | 0 | 113 | Y243 V244 S251 | Y243-N247 WeakPolarHBondContact CD1-ND2 3.22Å; Y243-N247 VanDerWaalsContact CD2-ND2 3.32Å; Y243-N247 WeakPolarHBondContact CD2-ND2 2.89Å; Y243-N247 VanDerWaalsContact CE1-ND2 3.33Å; Y243-N247 WeakPolarHBondContact CE1-ND2 3.11Å; Y243-N247 WeakPolarHBondContact CE2-ND2 3.47Å; Y243-N247 WeakPolarHBondContact O-CB 3.39Å; Y243-N247 PolarHBondContact O-N 3.24Å; Y243-N247 PolarHBondContact O-ND2 3.1Å; V244-N247 PolarHBondContact O-N 3.07Å; N247-S251 PolarHBondContact O-N 3.15Å |
| 248 | V | 77.6 | Confident | 78.2 | Confident | 69 Ų | 69 | 124.9 Ų | 124.9 | 42% | 0.418 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -73 | -50.7 | 177.1 | -179.7 | 0 | 0 | 0 | 0 | 109.7 | V244 R250 S251 Y252 | V244-V248 HydrophobicContact CG1-CG2 3.84Å; V244-V248 WeakPolarHBondContact O-CA 3.13Å; V244-V248 WeakPolarHBondContact O-CB 3.43Å; V244-V248 VanDerWaalsContact O-CG2 3.26Å; V244-V248 WeakPolarHBondContact O-CG2 3.27Å; V244-V248 PolarHBondContact O-N 3.43Å; V248-R250 VanDerWaalsContact C-N 3.3Å; V248-R250 PolarHBondContact O-N 3.32Å; V248-S251 PolarHBondContact O-N 3.44Å; V248-S251 VanDerWaalsContact O-N 3.08Å; V248-Y252 HydrophobicContact CG1-CD2 3.97Å; V248-Y252 HydrophobicContact CG1-CE2 3.92Å; V248-Y252 WeakPolarHBondContact O-CD2 3.39Å; V248-Y252 PolarHBondContact O-N 3.38Å |
| 249 | Y | 71.4 | Confident | 77.8 | Confident | 153 Ų | 153 | 122.9 Ų | 122.9 | 60% | 0.6 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -66.5 | -29.5 | 179.7 | -83.5 | -101.4 | 0 | 0 | 0 | 113.3 | F245 S251 Y252 | F245-Y249 HydrophobicContact CD1-CD2 4.45Å; F245-Y249 AromaticContact CD2-CD2 3.46Å; F245-Y249 HydrophobicContact CD2-CD2 3.46Å; F245-Y249 VanDerWaalsContact CD2-CD2 3.46Å; F245-Y249 AromaticContact CD2-CE2 3.44Å; F245-Y249 HydrophobicContact CD2-CE2 3.44Å; F245-Y249 VanDerWaalsContact CD2-CE2 3.44Å; F245-Y249 HydrophobicContact CD2-CG 4.36Å; F245-Y249 HydrophobicContact CE1-CD2 4.48Å; F245-Y249 HydrophobicContact CE2-CD1 4.46Å; F245-Y249 AromaticContact CE2-CD2 3.5Å; F245-Y249 HydrophobicContact CE2-CD2 3.5Å; F245-Y249 VanDerWaalsContact CE2-CD2 3.5Å; F245-Y249 HydrophobicContact CE2-CE1 4.27Å; F245-Y249 AromaticContact CE2-CE2 3.25Å; F245-Y249 HydrophobicContact CE2-CE2 3.25Å; F245-Y249 HydrophobicContact CE2-CG 4.11Å; F245-Y249 AromaticContact CE2-CZ 3.67Å; F245-Y249 AromaticContact CG-CD2 3.97Å; F245-Y249 HydrophobicContact CG-CD2 3.97Å; F245-Y249 HydrophobicContact CG-CE2 4.39Å; F245-Y249 HydrophobicContact CZ-CD1 4.4Å; F245-Y249 HydrophobicContact CZ-CD2 4.03Å; F245-Y249 HydrophobicContact CZ-CE1 4.45Å; F245-Y249 HydrophobicContact CZ-CE2 4.09Å; F245-Y249 HydrophobicContact CZ-CG 4.19Å; F245-Y249 WeakPolarHBondContact O-CA 3.33Å; F245-Y249 WeakPolarHBondContact O-CB 3.35Å; F245-Y249 PolarHBondContact O-N 2.92Å; Y249-S251 VanDerWaalsContact C-N 3.3Å; Y249-Y252 PolarHBondContact O-N 3.24Å |
| 250 | R | 72.5 | Confident | 77.3 | Confident | 199 Ų | 199 | 121.9 Ų | 121.9 | 75% | 0.751 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -73.4 | -21.9 | 174.4 | -170.7 | 171.4 | -178.9 | 161 | 0.4 | 113 | V246 V248 | V246-R250 WeakPolarHBondContact O-CB 3.22Å; V246-R250 PolarHBondContact O-N 3.04Å; V248-R250 VanDerWaalsContact C-N 3.3Å; V248-R250 PolarHBondContact O-N 3.32Å |
| 251 | S | 75.7 | Confident | 76.7 | Confident | 97 Ų | 97 | 123.2 Ų | 123.2 | 68% | 0.678 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -81.5 | -15.7 | 173.4 | -168.5 | 0 | 0 | 0 | 0 | 113.3 | N247 V248 Y249 | N247-S251 PolarHBondContact O-N 3.15Å; V248-S251 PolarHBondContact O-N 3.44Å; V248-S251 VanDerWaalsContact O-N 3.08Å; Y249-S251 VanDerWaalsContact C-N 3.3Å |
| 252 | Y | 70.9 | Confident | 76.2 | Confident | 203 Ų | 203 | 128 Ų | 128 | 80% | 0.796 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.7 | 10.3 | 180 | -84.7 | -80 | 0 | 0 | 0 | 113.8 | V248 Y249 | V248-Y252 HydrophobicContact CG1-CD2 3.97Å; V248-Y252 HydrophobicContact CG1-CE2 3.92Å; V248-Y252 WeakPolarHBondContact O-CD2 3.39Å; V248-Y252 PolarHBondContact O-N 3.38Å; Y249-Y252 PolarHBondContact O-N 3.24Å |
| 253 | K | 60.8 | Low | 75.6 | Confident | 249 Ų | 249 | 132.7 Ų | 132.7 | 100% | 1.083 | 61% | 0.613 | S | S | * | * | trans | -129.3 | 0 | 176.5 | -160.9 | -178.9 | -171.8 | 178.4 | 0 | 110.6 |
Retrieved 253 of 253 residues in 488 ms
(Link to these results)