| 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 | T | 35.1 | Very low | 27.3 | Very low | 201 Ų | 201 | 150.9 Ų | 150.9 | 100% | 1.233 | 88% | 0.878 | S | S | * | * | 0 | 82.3 | 0 | 15.3 | 0 | 0 | 0 | 0 | 107.9 | |||||
| 2 | M | 25.5 | Very low | 27.4 | Very low | 198 Ų | 198 | 154.8 Ų | 154.8 | 98% | 0.975 | 88% | 0.882 | S | S | * | * | P | Polyproline II helix | trans | -93.8 | 135.6 | 178.8 | -88.1 | -175.2 | -175.3 | 0 | 0 | 109.2 | ||
| 3 | A | 25.8 | Very low | 27.5 | Very low | 105 Ų | 105 | 148.9 Ų | 148.9 | 87% | 0.868 | 88% | 0.876 | S | S | * | * | P | Polyproline II helix | trans | -67 | 129 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 4 | S | 25.8 | Very low | 27.7 | Very low | 109 Ų | 109 | 147.6 Ų | 147.6 | 76% | 0.762 | 87% | 0.87 | S | S | * | * | P | Polyproline II helix | trans | -76 | 129.7 | 169.4 | 46.2 | 0 | 0 | 0 | 0 | 110.3 | ||
| 5 | Y | 26.1 | Very low | 27.9 | Very low | 227 Ų | 227 | 148.9 Ų | 148.9 | 89% | 0.89 | 87% | 0.872 | S | S | * | * | trans | -96.4 | 115 | 170.2 | -163.4 | -94 | 0 | 0 | 0 | 108.1 | ||||
| 6 | T | 24.1 | Very low | 27.9 | Very low | 119 Ų | 119 | 144.6 Ų | 144.6 | 73% | 0.73 | 87% | 0.869 | S | S | * | * | P | Polyproline II helix | trans | -101.4 | 134.2 | 174.2 | 29.1 | 0 | 0 | 0 | 0 | 109.8 | ||
| 7 | P | 28.1 | Very low | 27.9 | Very low | 117 Ų | 117 | 140.5 Ų | 140.5 | 76% | 0.76 | 86% | 0.863 | S | S | * | * | P | Polyproline II helix | trans | -88.2 | 148.2 | 163.7 | 13 | 4.5 | 0 | 0 | 0 | 111.5 | ||
| 8 | S | 24.5 | Very low | 28.4 | Very low | 113 Ų | 113 | 140.2 Ų | 140.2 | 79% | 0.79 | 86% | 0.864 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 159 | -172.5 | -28.2 | 0 | 0 | 0 | 0 | 114.9 | ||
| 9 | P | 27.3 | Very low | 28.5 | Very low | 129 Ų | 129 | 142.7 Ų | 142.7 | 84% | 0.838 | 87% | 0.867 | S | S | * | * | P | Polyproline II helix | trans | -83.9 | 140.2 | 176.6 | 34 | -30.5 | 0 | 0 | 0 | 111.4 | ||
| 10 | T | 28.4 | Very low | 29.1 | Very low | 144 Ų | 144 | 142 Ų | 142 | 88% | 0.883 | 87% | 0.868 | S | S | * | * | P | Polyproline II helix | trans | -103.2 | 136.5 | 164.2 | 28.7 | 0 | 0 | 0 | 0 | 110.1 | ||
| 11 | E | 29.4 | Very low | 29 | Very low | 198 Ų | 198 | 139.3 Ų | 139.3 | 93% | 0.925 | 86% | 0.861 | S | S | * | * | P | Polyproline II helix | trans | -62 | 157 | -168 | -68.9 | 172.9 | 141.8 | 0 | 0 | 116.2 | ||
| 12 | E | 28.2 | Very low | 28.7 | Very low | 198 Ų | 198 | 139 Ų | 139 | 93% | 0.925 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 143.2 | 178.1 | -64.3 | 175.6 | 143.2 | 0 | 0 | 113.9 | ||
| 13 | G | 29 | Very low | 28.8 | Very low | 78 Ų | 78 | 134.9 Ų | 134.9 | 80% | 0.804 | 83% | 0.833 | S | S | * | * | trans | -142.5 | 104.4 | 160.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 14 | T | 30.3 | Very low | 28.9 | Very low | 130 Ų | 130 | 137.8 Ų | 137.8 | 80% | 0.798 | 83% | 0.829 | S | S | * | * | trans | -73.6 | 133.5 | -177.6 | 5.8 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 15 | N | 30.8 | Very low | 28.9 | Very low | 168 Ų | 168 | 137.9 Ų | 137.9 | 90% | 0.898 | 83% | 0.83 | S | S | * | * | trans | 176.9 | 116.6 | 132.1 | -92.4 | -23.6 | 0 | 0 | 0 | 114.2 | ||||
| 16 | G | 28.4 | Very low | 29 | Very low | 80 Ų | 80 | 131.1 Ų | 131.1 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | 81.1 | 97.4 | 126.8 | 0 | 0 | 0 | 0 | 0 | 122.7 | |||||
| 17 | G | 27.3 | Very low | 29.3 | Very low | 75 Ų | 75 | 134.6 Ų | 134.6 | 77% | 0.773 | 82% | 0.823 | S | S | * | * | trans | 85.1 | 149.9 | 137.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 18 | P | 38 | Very low | 29.5 | Very low | 134 Ų | 134 | 137.1 Ų | 137.1 | 87% | 0.87 | 83% | 0.825 | S | S | * | * | trans | -100 | 136.8 | -137.7 | 36.2 | -30.8 | 0 | 0 | 0 | 114 | ||||
| 19 | M | 29.7 | Very low | 29.8 | Very low | 189 Ų | 189 | 135.3 Ų | 135.3 | 93% | 0.931 | 81% | 0.813 | S | S | * | * | trans | -139.4 | 116.4 | 157.3 | -130.7 | 163.4 | 76.2 | 0 | 0 | 110.6 | A21 | M19-A21 PolarHBondContact O-N 3.23Š| ||
| 20 | S | 39.7 | Very low | 30.1 | Very low | 127 Ų | 127 | 138.3 Ų | 138.3 | 89% | 0.888 | 82% | 0.818 | S | S | * | * | trans | -51.8 | 116.2 | 173.1 | 178.1 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 21 | A | 27.8 | Very low | 30.8 | Very low | 87 Ų | 87 | 139.7 Ų | 139.7 | 72% | 0.719 | 81% | 0.811 | S | S | * | * | trans | -161.8 | 88.6 | 151.4 | 0 | 0 | 0 | 0 | 0 | 108.2 | M19 S23 | M19-A21 PolarHBondContact O-N 3.23Å; A21-S23 PolarHBondContact O-N 3.13Å; A21-S23 VanDerWaalsContact O-N 3.08Å | ||
| 22 | K | 29 | Very low | 32 | Very low | 195 Ų | 195 | 134.8 Ų | 134.8 | 85% | 0.848 | 79% | 0.791 | S | S | * | * | trans | -65.3 | 102.7 | 157.6 | -84.3 | -179.2 | 173.7 | -177.5 | 0 | 106.5 | E24 | K22-E24 VanDerWaalsContact C-N 3.26Å; K22-E24 PolarHBondContact O-N 3.32Å; K22-E24 VanDerWaalsContact O-N 3.1Å | ||
| 23 | S | 26.2 | Very low | 33.6 | Very low | 111 Ų | 111 | 133 Ų | 133 | 78% | 0.776 | 78% | 0.78 | S | S | * | * | trans | -73.6 | 89.9 | 158.7 | 57.1 | 0 | 0 | 0 | 0 | 106.8 | A21 S25 | A21-S23 PolarHBondContact O-N 3.13Å; A21-S23 VanDerWaalsContact O-N 3.08Å; S23-S25 VanDerWaalsContact C-N 3.32Å; S23-S25 PolarHBondContact O-N 3.26Å | ||
| 24 | E | 27.9 | Very low | 35.8 | Very low | 166 Ų | 166 | 135.4 Ų | 135.4 | 78% | 0.776 | 77% | 0.768 | S | S | * | * | trans | -60.2 | 103.2 | 158 | -77.9 | 176.5 | 170.3 | 0 | 0 | 106.5 | K22 S26 | K22-E24 VanDerWaalsContact C-N 3.26Å; K22-E24 PolarHBondContact O-N 3.32Å; K22-E24 VanDerWaalsContact O-N 3.1Å; E24-S26 PolarHBondContact O-N 2.95Å | ||
| 25 | S | 27.8 | Very low | 38 | Very low | 111 Ų | 111 | 135.3 Ų | 135.3 | 78% | 0.776 | 76% | 0.759 | S | S | * | * | trans | -68.6 | 82.3 | 160.1 | 53.7 | 0 | 0 | 0 | 0 | 106.6 | S23 E27 | S23-S25 VanDerWaalsContact C-N 3.32Å; S23-S25 PolarHBondContact O-N 3.26Å; S25-E27 PolarHBondContact O-N 2.79Å | ||
| 26 | S | 28 | Very low | 40.3 | Very low | 85 Ų | 85 | 128.3 Ų | 128.3 | 59% | 0.594 | 72% | 0.721 | S | S | * | * | trans | -59.5 | 108.2 | 162 | 50.2 | 0 | 0 | 0 | 0 | 106.6 | E24 E28 | E24-S26 PolarHBondContact O-N 2.95Å; S26-E28 PolarHBondContact O-N 3.17Å | ||
| 27 | E | 30.5 | Very low | 43.1 | Very low | 191 Ų | 191 | 126.2 Ų | 126.2 | 89% | 0.893 | 69% | 0.694 | S | S | * | * | trans | -59.3 | 84.7 | 156.8 | -76.1 | -180 | 160.3 | 0 | 0 | 106.6 | S25 S29 | S25-E27 PolarHBondContact O-N 2.79Å; E27-S29 PolarHBondContact O-N 3.38Å | ||
| 28 | E | 30.4 | Very low | 45.9 | Very low | 171 Ų | 171 | 125.1 Ų | 125.1 | 80% | 0.799 | 67% | 0.67 | S | S | * | * | trans | -67.7 | 88.8 | 170.2 | -81.8 | -166.7 | 152.1 | 0 | 0 | 106.9 | S26 M30 | S26-E28 PolarHBondContact O-N 3.17Å; E28-M30 PolarHBondContact O-N 2.96Å; E28-M30 VanDerWaalsContact O-N 3.07Å | ||
| 29 | S | 31.1 | Very low | 48 | Very low | 75 Ų | 75 | 124.2 Ų | 124.2 | 52% | 0.524 | 66% | 0.657 | S | S | . | * | trans | -45.1 | 120.9 | 161.3 | 59.4 | 0 | 0 | 0 | 0 | 107.6 | E27 K31 | E27-S29 PolarHBondContact O-N 3.38Å; S29-K31 PolarHBondContact O-N 3.1Å; S29-K31 WeakPolarHBondContact OG-CE 3.28Å | ||
| 30 | M | 33.6 | Very low | 50.4 | Low | 192 Ų | 192 | 119.1 Ų | 119.1 | 95% | 0.946 | 63% | 0.634 | S | S | * | * | trans | -72.1 | 79 | -172.3 | -152.8 | -172.5 | -71.7 | 0 | 0 | 108.9 | E28 | E28-M30 PolarHBondContact O-N 2.96Å; E28-M30 VanDerWaalsContact O-N 3.07Å | ||
| 31 | K | 43.7 | Very low | 52.5 | Low | 173 Ų | 173 | 113.2 Ų | 113.2 | 75% | 0.752 | 59% | 0.593 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 138.3 | -179.2 | -70.7 | 179.2 | -178.7 | 173.1 | 0 | 110.3 | S29 K33 | S29-K31 PolarHBondContact O-N 3.1Å; S29-K31 WeakPolarHBondContact OG-CE 3.28Å; K31-K33 PolarHBondContact O-N 3.07Å |
| 32 | L | 54.8 | Low | 55.2 | Low | 95 Ų | 95 | 110.1 Ų | 110.1 | 50% | 0.497 | 57% | 0.565 | S | S | . | * | P | Polyproline II helix | trans | -57.6 | 133.9 | 173.9 | -68.8 | 172.7 | 0 | 0 | 0 | 110.2 | E249 E250 | L32-E249 HydrophobicContact CD1-CB 4.5Å; L32-E250 HydrophobicContact CB-CG 4.2Å; L32-E250 HydrophobicContact CD1-CG 4.23Å |
| 33 | K | 62.2 | Low | 57.7 | Low | 159 Ų | 159 | 103.2 Ų | 103.2 | 69% | 0.691 | 54% | 0.541 | S | S | * | . | P | Polyproline II helix | trans | -71.5 | 131.1 | -179.6 | -70.1 | -174.2 | 179 | -178.8 | 0 | 110.4 | K31 E35 | K31-K33 PolarHBondContact O-N 3.07Å; K33-E35 HydrophobicContact CB-CG 3.89Å; K33-E35 WeakPolarHBondContact CD-OE1 3.43Å; K33-E35 PolarHBondContact O-N 3.47Å |
| 34 | K | 73.8 | Confident | 60.3 | Low | 129 Ų | 129 | 100.2 Ų | 100.2 | 56% | 0.561 | 52% | 0.516 | S | S | * | . | trans | -76.4 | 84.4 | 175.4 | -68 | -178.7 | 179.8 | -179.7 | 0 | 111.1 | E249 E250 K252 | K34-E249 WeakPolarHBondContact CG-O 3.45Å; K34-E250 CarbonylContact C-O 3.29Å; K34-E250 VanDerWaalsContact CA-O 3.31Å; K34-E250 WeakPolarHBondContact CA-O 3.3Å; K34-K252 HydrophobicContact CB-CG 4.36Å; K34-K252 WeakPolarHBondContact O-CE 3.29Å; K34-K252 VanDerWaalsContact O-CG 3.31Å; K34-K252 WeakPolarHBondContact O-CG 3.28Å | ||
| 35 | E | 77.8 | Confident | 62.9 | Low | 128 Ų | 128 | 92.3 Ų | 92.3 | 60% | 0.598 | 48% | 0.479 | S | S | * | . | trans | -106.2 | -20.4 | -174.5 | -65.8 | -173.4 | 175.1 | 0 | 0 | 113.7 | K33 S37 E250 | K33-E35 HydrophobicContact CB-CG 3.89Å; K33-E35 WeakPolarHBondContact CD-OE1 3.43Å; K33-E35 PolarHBondContact O-N 3.47Å; E35-S37 PolarHBondContact O-N 3.19Å; E35-E250 PolarHBondContact N-O 3.08Å | ||
| 36 | I | 78.4 | Confident | 65.7 | Low | 22 Ų | 22 | 88 Ų | 88 | 11% | 0.113 | 45% | 0.448 | C | S | . | . | B | Isolated β-bridge | trans | -78.2 | 113.2 | -173.2 | -55.4 | 178.4 | 0 | 0 | 0 | 110.5 | N40 V247 E250 I251 K252 | I36-N40 HydrophobicContact CG2-CB 4.01Å; I36-V247 HydrophobicContact CD1-CB 4.04Å; I36-V247 HydrophobicContact CD1-CG2 3.85Å; I36-E250 HydrophobicContact CD1-CB 3.78Å; I36-E250 HydrophobicContact CG1-CB 4.13Å; I36-E250 PolarHBondContact N-O 3.16Å; I36-I251 HydrophobicContact CB-CG1 4.25Å; I36-I251 HydrophobicContact CG2-CG1 4.26Å; I36-K252 PolarHBondContact O-N 3.09Å |
| 37 | S | 87.1 | Confident | 68.1 | Low | 36 Ų | 36 | 84.1 Ų | 84.1 | 25% | 0.252 | 42% | 0.421 | S | S | . | . | trans | -80.2 | 169.4 | 174.3 | 79.5 | 0 | 0 | 0 | 0 | 112.2 | E35 L39 N40 G41 | E35-S37 PolarHBondContact O-N 3.19Å; S37-L39 VanDerWaalsContact C-N 3.34Å; S37-L39 PolarHBondContact O-N 3.14Å; S37-N40 PolarHBondContact O-N 3.32Å; S37-N40 PolarHBondContact OG-N 3.39Å; S37-N40 PolarHBondContact OG-OD1 2.93Å; S37-N40 VanDerWaalsContact OG-OD1 3.11Å; S37-G41 PolarHBondContact O-N 2.86Å | ||
| 38 | L | 85.9 | Confident | 70.4 | Confident | 52 Ų | 52 | 77 Ų | 77 | 27% | 0.272 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -56.4 | -46 | 174.9 | 176.4 | 62.4 | 0 | 0 | 0 | 112.4 | G41 V42 N257 L260 A261 | L38-G41 WeakPolarHBondContact O-CA 3.33Å; L38-G41 PolarHBondContact O-N 3.49Å; L38-G41 VanDerWaalsContact O-N 3.15Å; L38-V42 WeakPolarHBondContact O-CG2 3.42Å; L38-V42 PolarHBondContact O-N 3.33Å; L38-N257 HydrophobicContact CB-CB 4.43Å; L38-N257 HydrophobicContact CD1-CB 4.27Å; L38-N257 WeakPolarHBondContact CD1-O 3.49Å; L38-L260 HydrophobicContact CD1-CB 3.7Å; L38-L260 HydrophobicContact CD2-CB 4.46Å; L38-L260 HydrophobicContact CD2-CD1 4.41Å; L38-A261 HydrophobicContact CD1-CB 4.04Å |
| 39 | L | 82.6 | Confident | 73 | Confident | 114 Ų | 114 | 69.1 Ų | 69.1 | 60% | 0.597 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -66.6 | -41.4 | -179.3 | -170.4 | 148.2 | 0 | 0 | 0 | 110.9 | S37 G41 V42 C43 | S37-L39 VanDerWaalsContact C-N 3.34Å; S37-L39 PolarHBondContact O-N 3.14Å; L39-G41 PolarHBondContact O-N 3.3Å; L39-V42 PolarHBondContact O-N 2.68Å; L39-C43 WeakPolarHBondContact O-CB 3.46Å; L39-C43 PolarHBondContact O-N 3.14Å; L39-C43 PolarHBondContact O-SG 3.12Å; L39-C43 VanDerWaalsContact O-SG 3.39Å |
| 40 | N | 80.6 | Confident | 75.5 | Confident | 83 Ų | 83 | 65.5 Ų | 65.5 | 44% | 0.444 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -59.8 | -39.9 | 173.2 | -61.5 | 3.1 | 0 | 0 | 0 | 110.4 | I36 S37 C43 L44 | I36-N40 HydrophobicContact CG2-CB 4.01Å; S37-N40 PolarHBondContact O-N 3.32Å; S37-N40 PolarHBondContact OG-N 3.39Å; S37-N40 PolarHBondContact OG-OD1 2.93Å; S37-N40 VanDerWaalsContact OG-OD1 3.11Å; N40-C43 PolarHBondContact O-N 2.94Å; N40-L44 VanDerWaalsContact O-CB 3.25Å; N40-L44 WeakPolarHBondContact O-CB 3.44Å; N40-L44 PolarHBondContact O-N 3.2Å |
| 41 | G | 82.6 | Confident | 77.6 | Confident | 3 Ų | 3 | 56.8 Ų | 56.8 | 3% | 0.031 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.9 | -45.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | S37 L38 L39 L44 I45 | S37-G41 PolarHBondContact O-N 2.86Å; L38-G41 WeakPolarHBondContact O-CA 3.33Å; L38-G41 PolarHBondContact O-N 3.49Å; L38-G41 VanDerWaalsContact O-N 3.15Å; L39-G41 PolarHBondContact O-N 3.3Å; G41-L44 PolarHBondContact O-N 3.39Å; G41-I45 PolarHBondContact O-N 3.18Å |
| 42 | V | 86.2 | Confident | 79.3 | Confident | 22 Ų | 22 | 49 Ų | 49 | 13% | 0.133 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.1 | -48.5 | 174.8 | 174.1 | 0 | 0 | 0 | 0 | 110.7 | L38 L39 L44 I45 V46 A261 I264 | L38-V42 WeakPolarHBondContact O-CG2 3.42Å; L38-V42 PolarHBondContact O-N 3.33Å; L39-V42 PolarHBondContact O-N 2.68Å; V42-L44 VanDerWaalsContact C-N 3.26Å; V42-L44 PolarHBondContact O-N 2.82Å; V42-I45 PolarHBondContact O-N 2.9Å; V42-V46 HydrophobicContact CG1-CG2 4.15Å; V42-V46 WeakPolarHBondContact O-CB 3.33Å; V42-V46 VanDerWaalsContact O-CG2 3.29Å; V42-V46 WeakPolarHBondContact O-CG2 3.36Å; V42-V46 PolarHBondContact O-N 3.32Å; V42-A261 HydrophobicContact CG2-CB 4.14Å; V42-I264 HydrophobicContact CG1-CG2 4.1Å; V42-I264 HydrophobicContact CG2-CB 4.18Å; V42-I264 HydrophobicContact CG2-CD1 4.44Å; V42-I264 HydrophobicContact CG2-CG2 4.16Å |
| 43 | C | 80.9 | Confident | 80.8 | Confident | 49 Ų | 49 | 44.7 Ų | 44.7 | 33% | 0.331 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -60.5 | -36.6 | 177.8 | -71 | 0 | 0 | 0 | 0 | 112.3 | L39 N40 G47 | L39-C43 WeakPolarHBondContact O-CB 3.46Å; L39-C43 PolarHBondContact O-N 3.14Å; L39-C43 PolarHBondContact O-SG 3.12Å; L39-C43 VanDerWaalsContact O-SG 3.39Å; N40-C43 PolarHBondContact O-N 2.94Å; C43-G47 WeakPolarHBondContact O-CA 3.41Å; C43-G47 PolarHBondContact O-N 3.47Å |
| 44 | L | 79.6 | Confident | 82.2 | Confident | 49 Ų | 49 | 37.1 Ų | 37.1 | 26% | 0.257 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -67.9 | -46 | 177.5 | -169.9 | 160.9 | 0 | 0 | 0 | 111.4 | N40 G41 V42 N48 T243 L244 | N40-L44 VanDerWaalsContact O-CB 3.25Å; N40-L44 WeakPolarHBondContact O-CB 3.44Å; N40-L44 PolarHBondContact O-N 3.2Å; G41-L44 PolarHBondContact O-N 3.39Å; V42-L44 VanDerWaalsContact C-N 3.26Å; V42-L44 PolarHBondContact O-N 2.82Å; L44-N48 WeakPolarHBondContact O-CB 3.42Å; L44-N48 PolarHBondContact O-N 3.33Å; L44-T243 HydrophobicContact CD2-CG2 3.83Å; L44-L244 HydrophobicContact CB-CD2 4.26Å; L44-L244 HydrophobicContact CD1-CD2 4.01Å; L44-L244 HydrophobicContact CD2-CD2 3.85Å; L44-L244 HydrophobicContact CD2-CG 4.26Å; L44-L244 HydrophobicContact CG-CD2 4.27Å |
| 45 | I | 84.4 | Confident | 82.9 | Confident | 0 Ų | 0 | 31.2 Ų | 31.2 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.2 | -53.6 | 176.1 | -66.1 | 172.9 | 0 | 0 | 0 | 110.6 | G41 V42 G47 N48 M49 W241 L244 A261 I262 S265 | G41-I45 PolarHBondContact O-N 3.18Å; V42-I45 PolarHBondContact O-N 2.9Å; I45-G47 VanDerWaalsContact C-N 3.27Å; I45-G47 PolarHBondContact O-N 3.42Å; I45-N48 PolarHBondContact O-N 3.37Å; I45-M49 HydrophobicContact CG2-CG 4.05Å; I45-M49 HydrophobicContact CG2-SD 3.44Å; I45-M49 WeakPolarHBondContact CG2-SD 3.35Å; I45-M49 WeakPolarHBondContact O-CB 3.27Å; I45-M49 WeakPolarHBondContact O-CG 3.41Å; I45-M49 PolarHBondContact O-N 2.99Å; I45-W241 HydrophobicContact CG2-CB 4.45Å; I45-L244 HydrophobicContact CD1-CD1 3.34Å; I45-L244 HydrophobicContact CD1-CG 3.92Å; I45-L244 HydrophobicContact CG1-CD1 3.6Å; I45-L244 HydrophobicContact CG1-CG 3.66Å; I45-A261 HydrophobicContact CD1-CB 4.17Å; I45-I262 HydrophobicContact CD1-CG1 3.68Å; I45-S265 WeakPolarHBondContact CD1-OG 3.32Å; I45-S265 VanDerWaalsContact CG2-OG 3.27Å; I45-S265 WeakPolarHBondContact CG2-OG 3.46Å |
| 46 | V | 84.8 | Confident | 83.6 | Confident | 19 Ų | 19 | 25.8 Ų | 25.8 | 12% | 0.115 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59.8 | -43.3 | -178.3 | 174.1 | 0 | 0 | 0 | 0 | 110 | V42 I50 V269 | V42-V46 HydrophobicContact CG1-CG2 4.15Å; V42-V46 WeakPolarHBondContact O-CB 3.33Å; V42-V46 VanDerWaalsContact O-CG2 3.29Å; V42-V46 WeakPolarHBondContact O-CG2 3.36Å; V42-V46 PolarHBondContact O-N 3.32Å; V46-I50 HydrophobicContact CG1-CD1 3.53Å; V46-I50 HydrophobicContact CG1-CG1 4.17Å; V46-I50 WeakPolarHBondContact O-CB 3.45Å; V46-I50 VanDerWaalsContact O-CG1 3.27Å; V46-I50 WeakPolarHBondContact O-CG1 3.39Å; V46-I50 PolarHBondContact O-N 2.94Å; V46-V269 HydrophobicContact CG1-CG2 4.48Å; V46-V269 HydrophobicContact CG2-CG2 4.21Å |
| 47 | G | 78.8 | Confident | 84.3 | Confident | 4 Ų | 4 | 24.7 Ų | 24.7 | 4% | 0.041 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -65.8 | -35.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | C43 I45 K190 | C43-G47 WeakPolarHBondContact O-CA 3.41Å; C43-G47 PolarHBondContact O-N 3.47Å; I45-G47 VanDerWaalsContact C-N 3.27Å; I45-G47 PolarHBondContact O-N 3.42Å; G47-K190 WeakPolarHBondContact O-CE 3.24Å; G47-K190 PolarHBondContact O-NZ 3.48Å |
| 48 | N | 78.6 | Confident | 84.7 | Confident | 43 Ų | 43 | 23 Ų | 23 | 23% | 0.23 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -80.4 | -40.5 | 178.1 | -76.8 | -4.6 | 0 | 0 | 0 | 112.5 | L44 I45 T243 | L44-N48 WeakPolarHBondContact O-CB 3.42Å; L44-N48 PolarHBondContact O-N 3.33Å; I45-N48 PolarHBondContact O-N 3.37Å; N48-T243 WeakPolarHBondContact ND2-CB 3.48Å; N48-T243 WeakPolarHBondContact ND2-CG2 3.41Å; N48-T243 PolarHBondContact ND2-OG1 3.41Å; N48-T243 VanDerWaalsContact ND2-OG1 3.11Å |
| 49 | M | 85.3 | Confident | 85.1 | Confident | 4 Ų | 4 | 21.9 Ų | 21.9 | 2% | 0.02 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -66.5 | -51.5 | 178.2 | -70.6 | 178.7 | 77.9 | 0 | 0 | 111.3 | I45 G51 Y238 S239 W241 M266 V269 Y273 | I45-M49 HydrophobicContact CG2-CG 4.05Å; I45-M49 HydrophobicContact CG2-SD 3.44Å; I45-M49 WeakPolarHBondContact CG2-SD 3.35Å; I45-M49 WeakPolarHBondContact O-CB 3.27Å; I45-M49 WeakPolarHBondContact O-CG 3.41Å; I45-M49 PolarHBondContact O-N 2.99Å; M49-G51 PolarHBondContact O-N 3.4Å; M49-Y238 HydrophobicContact CE-CD1 3.81Å; M49-Y238 VanDerWaalsContact CE-O 3.22Å; M49-Y238 WeakPolarHBondContact CE-O 3.45Å; M49-S239 WeakPolarHBondContact CA-O 3.31Å; M49-W241 HydrophobicContact CE-CB 4.39Å; M49-W241 HydrophobicContact CG-CB 4.45Å; M49-W241 HydrophobicContact SD-CB 3.86Å; M49-M266 HydrophobicContact CE-CE 3.59Å; M49-M266 HydrophobicContact CE-SD 3.6Å; M49-M266 VanDerWaalsContact CE-SD 3.6Å; M49-M266 HydrophobicContact SD-CE 4.41Å; M49-M266 HydrophobicContact SD-SD 3.6Å; M49-M266 VanDerWaalsContact SD-SD 3.6Å; M49-V269 HydrophobicContact CB-CG1 4.24Å; M49-V269 HydrophobicContact CB-CG2 4.27Å; M49-V269 HydrophobicContact CE-CB 4.25Å; M49-V269 HydrophobicContact CE-CG1 3.85Å; M49-V269 HydrophobicContact CE-CG2 4.48Å; M49-V269 HydrophobicContact SD-CB 4.48Å; M49-V269 HydrophobicContact SD-CG1 4.44Å; M49-V269 HydrophobicContact SD-CG2 4.08Å; M49-Y273 VanDerWaalsContact C-OH 3.25Å; M49-Y273 PolarHBondContact O-OH 3.36Å |
| 50 | I | 84.5 | Confident | 85.6 | Confident | 0 Ų | 0 | 16.5 Ų | 16.5 | 0% | 0 | 10% | 0.097 | C | C | . | . | S | Bend | trans | -71.7 | 80.4 | 178 | -57.9 | -175.9 | 0 | 0 | 0 | 108.4 | V46 K190 L194 V269 I272 Y273 | V46-I50 HydrophobicContact CG1-CD1 3.53Å; V46-I50 HydrophobicContact CG1-CG1 4.17Å; V46-I50 WeakPolarHBondContact O-CB 3.45Å; V46-I50 VanDerWaalsContact O-CG1 3.27Å; V46-I50 WeakPolarHBondContact O-CG1 3.39Å; V46-I50 PolarHBondContact O-N 2.94Å; I50-K190 VanDerWaalsContact O-CD 3.24Å; I50-K190 WeakPolarHBondContact O-CD 3.45Å; I50-K190 WeakPolarHBondContact O-CE 3.35Å; I50-K190 PolarHBondContact O-NZ 3.17Å; I50-L194 HydrophobicContact CG2-CD1 3.21Å; I50-V269 HydrophobicContact CD1-CG2 4.28Å; I50-V269 HydrophobicContact CG1-CG1 4.29Å; I50-V269 HydrophobicContact CG1-CG2 4.05Å; I50-I272 HydrophobicContact CD1-CD1 3.81Å; I50-I272 HydrophobicContact CD1-CG2 4.33Å; I50-Y273 WeakPolarHBondContact CA-OH 3.28Å; I50-Y273 HydrophobicContact CG1-CE1 4.09Å |
| 51 | G | 77.9 | Confident | 86.4 | Confident | 9 Ų | 9 | 12.5 Ų | 12.5 | 9% | 0.093 | 8% | 0.076 | C | C | . | . | S | Bend | trans | -119.8 | -144.5 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | M49 G53 F55 | M49-G51 PolarHBondContact O-N 3.4Å; G51-G53 PolarHBondContact O-N 3.39Å; G51-F55 WeakPolarHBondContact O-CD2 3.05Å; G51-F55 WeakPolarHBondContact O-CE2 3.36Å |
| 52 | S | 78.3 | Confident | 87 | Confident | 8 Ų | 8 | 12.5 Ų | 12.5 | 6% | 0.056 | 8% | 0.075 | C | C | . | . | S | Bend | trans | -68.6 | -22.2 | 173.2 | 58.4 | 0 | 0 | 0 | 0 | 112.9 | I54 F55 V56 I134 C319 | S52-I54 PolarHBondContact O-N 2.98Å; S52-F55 WeakPolarHBondContact O-CB 3.03Å; S52-F55 PolarHBondContact O-N 2.84Å; S52-F55 VanDerWaalsContact O-N 3.1Å; S52-V56 PolarHBondContact O-N 3.29Å; S52-I134 VanDerWaalsContact OG-CG1 3.31Å; S52-I134 WeakPolarHBondContact OG-CG1 3.43Å; S52-C319 VanDerWaalsContact CB-SG 3.52Å |
| 53 | G | 87.1 | Confident | 87.3 | Confident | 5 Ų | 5 | 15.1 Ų | 15.1 | 5% | 0.052 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -55.4 | -50.4 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | G51 F55 V56 S57 S237 | G51-G53 PolarHBondContact O-N 3.39Å; G53-F55 PolarHBondContact O-N 3.03Å; G53-V56 PolarHBondContact O-N 2.7Å; G53-S57 VanDerWaalsContact O-CB 3.3Å; G53-S57 WeakPolarHBondContact O-CB 3.41Å; G53-S57 PolarHBondContact O-N 2.79Å; G53-S57 PolarHBondContact O-OG 2.55Å; G53-S57 VanDerWaalsContact O-OG 3.13Å; G53-S237 WeakPolarHBondContact CA-OG 3.29Å; G53-S237 PolarHBondContact O-OG 3.3Å |
| 54 | I | 91.1 | Very high | 88 | Confident | 0 Ų | 0 | 14.3 Ų | 14.3 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -62.7 | -15.7 | -177.3 | -168.2 | 54.8 | 0 | 0 | 0 | 113.4 | S52 P58 W75 L194 S237 Y273 T276 | S52-I54 PolarHBondContact O-N 2.98Å; I54-P58 WeakPolarHBondContact O-CD 3.41Å; I54-P58 WeakPolarHBondContact O-CG 3.45Å; I54-W75 HydrophobicContact CD1-CH2 3.5Å; I54-W75 VanDerWaalsContact CD1-CH2 3.5Å; I54-W75 HydrophobicContact CD1-CZ2 4.06Å; I54-W75 HydrophobicContact CD1-CZ3 3.93Å; I54-L194 HydrophobicContact CG2-CD1 4.35Å; I54-L194 HydrophobicContact CG2-CD2 4.26Å; I54-S237 PolarHBondContact N-OG 2.77Å; I54-S237 VanDerWaalsContact N-OG 3.16Å; I54-Y273 HydrophobicContact CB-CD1 4.14Å; I54-Y273 HydrophobicContact CB-CE1 3.75Å; I54-Y273 HydrophobicContact CD1-CD1 3.61Å; I54-Y273 HydrophobicContact CD1-CD2 4.47Å; I54-Y273 HydrophobicContact CD1-CE1 4.1Å; I54-Y273 HydrophobicContact CD1-CG 3.8Å; I54-Y273 HydrophobicContact CG1-CD1 3.71Å; I54-Y273 HydrophobicContact CG1-CE1 3.86Å; I54-Y273 HydrophobicContact CG1-CG 4.42Å; I54-Y273 HydrophobicContact CG2-CE1 4.32Å; I54-T276 HydrophobicContact CG1-CG2 4.16Å |
| 55 | F | 89 | Confident | 88.6 | Confident | 5 Ų | 5 | 12 Ų | 12 | 2% | 0.022 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -92.9 | -14.6 | 179 | -62.9 | -58 | 0 | 0 | 0 | 113.1 | G51 S52 G53 T137 Y141 L194 A296 V315 | G51-F55 WeakPolarHBondContact O-CD2 3.05Å; G51-F55 WeakPolarHBondContact O-CE2 3.36Å; S52-F55 WeakPolarHBondContact O-CB 3.03Å; S52-F55 PolarHBondContact O-N 2.84Å; S52-F55 VanDerWaalsContact O-N 3.1Å; G53-F55 PolarHBondContact O-N 3.03Å; F55-T137 HydrophobicContact CB-CG2 4.46Å; F55-Y141 HydrophobicContact CB-CE2 3.87Å; F55-Y141 WeakPolarHBondContact CB-OH 3.41Å; F55-Y141 PolarHBondContact O-OH 3.25Å; F55-Y141 VanDerWaalsContact O-OH 3.08Å; F55-L194 HydrophobicContact CE1-CD2 3.84Å; F55-L194 HydrophobicContact CZ-CD2 3.76Å; F55-L194 HydrophobicContact CZ-CG 4.14Å; F55-A296 HydrophobicContact CD1-CB 3.82Å; F55-A296 HydrophobicContact CE1-CB 4.09Å; F55-V315 HydrophobicContact CB-CG1 4.06Å; F55-V315 HydrophobicContact CD1-CG1 4.19Å; F55-V315 HydrophobicContact CD1-CG2 3.74Å; F55-V315 HydrophobicContact CD2-CB 4.42Å; F55-V315 HydrophobicContact CD2-CG1 3.56Å; F55-V315 HydrophobicContact CD2-CG2 4.14Å; F55-V315 HydrophobicContact CE1-CG2 3.52Å; F55-V315 HydrophobicContact CE2-CB 4.44Å; F55-V315 HydrophobicContact CE2-CG1 4.03Å; F55-V315 HydrophobicContact CE2-CG2 3.93Å; F55-V315 HydrophobicContact CG-CG1 3.65Å; F55-V315 HydrophobicContact CG-CG2 4.05Å; F55-V315 HydrophobicContact CZ-CG2 3.62Å |
| 56 | V | 91.2 | Very high | 89.1 | Confident | 14 Ų | 14 | 14.1 Ų | 14.1 | 9% | 0.085 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -111.7 | -45.9 | 178.3 | 178.9 | 0 | 0 | 0 | 0 | 111.9 | S52 G53 K59 T137 V377 F378 I381 | S52-V56 PolarHBondContact O-N 3.29Å; G53-V56 PolarHBondContact O-N 2.7Å; V56-K59 PolarHBondContact O-N 3.37Å; V56-T137 HydrophobicContact CG2-CG2 3.48Å; V56-T137 VanDerWaalsContact CG2-CG2 3.48Å; V56-T137 WeakPolarHBondContact CG2-OG1 3.16Å; V56-V377 HydrophobicContact CG1-CG1 4.3Å; V56-F378 HydrophobicContact CG1-CE1 4.04Å; V56-F378 HydrophobicContact CG1-CZ 4.18Å; V56-I381 HydrophobicContact CG1-CD1 3.92Å |
| 57 | S | 94.3 | Very high | 89.5 | Confident | 0 Ų | 0 | 13.3 Ų | 13.3 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -58.2 | -33.4 | -172.9 | -65.8 | 0 | 0 | 0 | 0 | 115.4 | G53 K59 G60 V61 S233 S237 | G53-S57 VanDerWaalsContact O-CB 3.3Å; G53-S57 WeakPolarHBondContact O-CB 3.41Å; G53-S57 PolarHBondContact O-N 2.79Å; G53-S57 PolarHBondContact O-OG 2.55Å; G53-S57 VanDerWaalsContact O-OG 3.13Å; S57-K59 VanDerWaalsContact C-N 3.26Å; S57-K59 PolarHBondContact O-N 2.88Å; S57-G60 PolarHBondContact O-N 3Å; S57-G60 VanDerWaalsContact O-N 3.09Å; S57-V61 VanDerWaalsContact O-CG2 3.31Å; S57-V61 WeakPolarHBondContact O-CG2 3.29Å; S57-V61 PolarHBondContact O-N 3.46Å; S57-S233 WeakPolarHBondContact CB-O 3.46Å; S57-S233 PolarHBondContact OG-O 3.49Å; S57-S237 WeakPolarHBondContact CB-OG 3.16Å; S57-S237 PolarHBondContact OG-OG 2.79Å |
| 58 | P | 95.1 | Very high | 90.3 | Very high | 0 Ų | 0 | 13.7 Ų | 13.7 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -54.9 | -40 | 178.4 | -29.3 | 36.7 | 0 | 0 | 0 | 113.7 | I54 L62 W75 N277 Y280 | I54-P58 WeakPolarHBondContact O-CD 3.41Å; I54-P58 WeakPolarHBondContact O-CG 3.45Å; P58-L62 VanDerWaalsContact O-CB 3.26Å; P58-L62 WeakPolarHBondContact O-CB 3.39Å; P58-L62 PolarHBondContact O-N 3.28Å; P58-L62 VanDerWaalsContact O-N 3.09Å; P58-W75 HydrophobicContact CG-CZ2 4.17Å; P58-N277 WeakPolarHBondContact CB-OD1 3.21Å; P58-Y280 HydrophobicContact CB-CD2 4.34Å; P58-Y280 HydrophobicContact CG-CD2 4.23Å; P58-Y280 HydrophobicContact CG-CE2 4.05Å |
| 59 | K | 94.6 | Very high | 91.1 | Very high | 29 Ų | 29 | 11.6 Ų | 11.6 | 13% | 0.126 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -65 | -49.1 | 174.6 | 171.8 | 168.4 | 170.5 | 167 | 0 | 110.8 | V56 S57 V61 L62 I63 L290 S292 D293 V295 F378 | V56-K59 PolarHBondContact O-N 3.37Å; S57-K59 VanDerWaalsContact C-N 3.26Å; S57-K59 PolarHBondContact O-N 2.88Å; K59-V61 PolarHBondContact O-N 3.25Å; K59-L62 PolarHBondContact O-N 3.37Å; K59-I63 HydrophobicContact CG-CD1 3.83Å; K59-I63 HydrophobicContact CG-CG1 4.41Å; K59-I63 VanDerWaalsContact O-CG1 3.24Å; K59-I63 WeakPolarHBondContact O-CG1 3.4Å; K59-I63 PolarHBondContact O-N 3.1Å; K59-L290 WeakPolarHBondContact CE-O 3.45Å; K59-L290 PolarHBondContact NZ-O 3.27Å; K59-S292 VanDerWaalsContact CD-O 3.24Å; K59-S292 WeakPolarHBondContact CD-O 3.25Å; K59-S292 PolarHBondContact NZ-O 3.29Å; K59-D293 IonicContact NZ-OD1 2.83Å; K59-D293 PolarHBondContact NZ-OD1 2.68Å; K59-V295 HydrophobicContact CB-CG2 4.29Å; K59-F378 HydrophobicContact CB-CZ 4.14Å; K59-F378 HydrophobicContact CD-CE2 4.37Å; K59-F378 HydrophobicContact CD-CZ 4.35Å; K59-F378 HydrophobicContact CG-CE2 4.23Å; K59-F378 HydrophobicContact CG-CZ 3.91Å |
| 60 | G | 93.3 | Very high | 91.6 | Very high | 0 Ų | 0 | 12.8 Ų | 12.8 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -61.7 | -42.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114 | S57 H64 | S57-G60 PolarHBondContact O-N 3Å; S57-G60 VanDerWaalsContact O-N 3.09Å; G60-H64 PolarHBondContact O-CD2 3.44Å; G60-H64 VanDerWaalsContact O-CD2 3.25Å |
| 61 | V | 96.3 | Very high | 92.2 | Very high | 0 Ų | 0 | 12.8 Ų | 12.8 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -62.8 | -45.8 | 175.5 | 178.7 | 0 | 0 | 0 | 0 | 110 | S57 K59 H64 S65 S71 V74 W75 A230 A234 | S57-V61 VanDerWaalsContact O-CG2 3.31Å; S57-V61 WeakPolarHBondContact O-CG2 3.29Å; S57-V61 PolarHBondContact O-N 3.46Å; K59-V61 PolarHBondContact O-N 3.25Å; V61-H64 PolarHBondContact O-N 3.34Å; V61-S65 VanDerWaalsContact O-CB 3.29Å; V61-S65 WeakPolarHBondContact O-CB 3.38Å; V61-S65 PolarHBondContact O-N 3.1Å; V61-S65 PolarHBondContact O-OG 3.11Å; V61-S71 VanDerWaalsContact CG1-OG 3.23Å; V61-S71 WeakPolarHBondContact CG1-OG 3.28Å; V61-V74 HydrophobicContact CG1-CB 4.08Å; V61-V74 HydrophobicContact CG1-CG1 3.89Å; V61-W75 HydrophobicContact CG2-CZ2 4.24Å; V61-A230 HydrophobicContact CG1-CB 4.41Å; V61-A234 HydrophobicContact CG2-CB 3.92Å |
| 62 | L | 95.1 | Very high | 93 | Very high | 2 Ų | 2 | 13.4 Ų | 13.4 | 1% | 0.01 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -70.3 | -34.6 | -176.4 | -165.2 | 64.7 | 0 | 0 | 0 | 113.3 | P58 K59 H64 S65 A66 Y68 Y281 I286 I289 L290 | P58-L62 VanDerWaalsContact O-CB 3.26Å; P58-L62 WeakPolarHBondContact O-CB 3.39Å; P58-L62 PolarHBondContact O-N 3.28Å; P58-L62 VanDerWaalsContact O-N 3.09Å; K59-L62 PolarHBondContact O-N 3.37Å; L62-H64 PolarHBondContact O-N 3.3Å; L62-S65 WeakPolarHBondContact CA-OG 3.21Å; L62-A66 WeakPolarHBondContact O-CA 3Å; L62-A66 PolarHBondContact O-N 3.46Å; L62-Y68 HydrophobicContact CD1-CD1 3.82Å; L62-Y68 HydrophobicContact CD1-CE1 4.26Å; L62-Y68 HydrophobicContact CD2-CD1 4.38Å; L62-Y68 HydrophobicContact CD2-CE1 4.04Å; L62-Y281 HydrophobicContact CD2-CE1 4.4Å; L62-I286 HydrophobicContact CD2-CB 4.45Å; L62-I286 HydrophobicContact CD2-CG1 4.43Å; L62-I286 HydrophobicContact CD2-CG2 4.05Å; L62-I286 HydrophobicContact CG-CG2 4.39Å; L62-I289 HydrophobicContact CD2-CB 3.94Å; L62-I289 HydrophobicContact CD2-CD1 4.04Å; L62-I289 HydrophobicContact CD2-CG2 3.86Å; L62-L290 HydrophobicContact CB-CD2 4.28Å; L62-L290 HydrophobicContact CD2-CD2 4.4Å; L62-L290 HydrophobicContact CG-CD2 4.34Å |
| 63 | I | 94.1 | Very high | 93.9 | Very high | 77 Ų | 77 | 15.9 Ų | 15.9 | 40% | 0.395 | 9% | 0.09 | S | C | . | . | H | α-helix | trans | -53.9 | -43.6 | 173.2 | -74.9 | 166.5 | 0 | 0 | 0 | 110.5 | K59 L290 F378 | K59-I63 HydrophobicContact CG-CD1 3.83Å; K59-I63 HydrophobicContact CG-CG1 4.41Å; K59-I63 VanDerWaalsContact O-CG1 3.24Å; K59-I63 WeakPolarHBondContact O-CG1 3.4Å; K59-I63 PolarHBondContact O-N 3.1Å; I63-L290 HydrophobicContact CB-CD2 4.38Å; I63-L290 HydrophobicContact CG1-CD2 3.5Å; I63-F378 HydrophobicContact CD1-CE2 4.25Å |
| 64 | H | 93.9 | Very high | 94.4 | Very high | 32 Ų | 32 | 15.8 Ų | 15.8 | 15% | 0.148 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -93.4 | -28.7 | -174.6 | -67.1 | -58.9 | 0 | 0 | 0 | 113.7 | G60 V61 L62 S221 H226 A230 | G60-H64 PolarHBondContact O-CD2 3.44Å; G60-H64 VanDerWaalsContact O-CD2 3.25Å; V61-H64 PolarHBondContact O-N 3.34Å; L62-H64 PolarHBondContact O-N 3.3Å; H64-S221 WeakPolarHBondContact O-CB 3.33Å; H64-H226 HydrophobicContact CB-CB 4.27Å; H64-H226 VanDerWaalsContact CB-O 3.31Å; H64-H226 WeakPolarHBondContact CB-O 3.39Å; H64-A230 HydrophobicContact CB-CB 3.8Å |
| 65 | S | 94.2 | Very high | 94.7 | Very high | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -78.6 | -27.9 | 176.3 | 74 | 0 | 0 | 0 | 0 | 112.6 | V61 L62 S67 S71 S221 | V61-S65 VanDerWaalsContact O-CB 3.29Å; V61-S65 WeakPolarHBondContact O-CB 3.38Å; V61-S65 PolarHBondContact O-N 3.1Å; V61-S65 PolarHBondContact O-OG 3.11Å; L62-S65 WeakPolarHBondContact CA-OG 3.21Å; S65-S67 PolarHBondContact O-N 3.2Å; S65-S67 PolarHBondContact OG-O 2.76Å; S65-S71 WeakPolarHBondContact OG-CB 3.49Å; S65-S221 PolarHBondContact O-N 3.16Å |
| 66 | A | 93.4 | Very high | 95 | Very high | 45 Ų | 45 | 18 Ų | 18 | 37% | 0.372 | 10% | 0.103 | S | C | . | . | trans | 58.7 | -1.3 | -177.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | L62 G219 | L62-A66 WeakPolarHBondContact O-CA 3Å; L62-A66 PolarHBondContact O-N 3.46Å; A66-G219 VanDerWaalsContact CB-O 3.31Å; A66-G219 WeakPolarHBondContact CB-O 3.24Å | ||
| 67 | S | 94.4 | Very high | 95.2 | Very high | 2 Ų | 2 | 21.3 Ų | 21.3 | 1% | 0.014 | 12% | 0.119 | C | C | . | . | S | Bend | trans | -143.1 | 153.9 | 176.3 | 77.9 | 0 | 0 | 0 | 0 | 111.3 | S65 L70 S71 M216 D218 S220 | S65-S67 PolarHBondContact O-N 3.2Å; S65-S67 PolarHBondContact OG-O 2.76Å; S67-L70 VanDerWaalsContact OG-CB 3.22Å; S67-L70 WeakPolarHBondContact OG-CB 3.48Å; S67-L70 PolarHBondContact OG-N 3.39Å; S67-L70 VanDerWaalsContact OG-N 3.13Å; S67-S71 WeakPolarHBondContact O-CB 3.45Å; S67-S71 PolarHBondContact O-N 2.92Å; S67-S71 VanDerWaalsContact O-N 3.08Å; S67-M216 WeakPolarHBondContact CB-O 3.34Å; S67-D218 WeakPolarHBondContact CB-O 3.45Å; S67-S220 WeakPolarHBondContact CB-OG 3.31Å; S67-S220 PolarHBondContact OG-OG 3.01Å |
| 68 | Y | 94.6 | Very high | 95.2 | Very high | 12 Ų | 12 | 21.3 Ų | 21.3 | 5% | 0.047 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -67.2 | -40.7 | 176.8 | -62 | -43.4 | 0 | 0 | 0 | 112.3 | L62 S71 L72 N212 M216 Y281 L284 P285 I286 I289 | L62-Y68 HydrophobicContact CD1-CD1 3.82Å; L62-Y68 HydrophobicContact CD1-CE1 4.26Å; L62-Y68 HydrophobicContact CD2-CD1 4.38Å; L62-Y68 HydrophobicContact CD2-CE1 4.04Å; Y68-S71 WeakPolarHBondContact O-CB 3.49Å; Y68-S71 PolarHBondContact O-N 3.25Å; Y68-L72 WeakPolarHBondContact O-CG 3.37Å; Y68-L72 PolarHBondContact O-N 3.46Å; Y68-N212 WeakPolarHBondContact CD2-O 3.41Å; Y68-N212 HydrophobicContact CE2-CB 3.92Å; Y68-N212 VanDerWaalsContact CE2-O 3.24Å; Y68-N212 WeakPolarHBondContact CE2-O 3.49Å; Y68-M216 PolarHBondContact N-O 3.34Å; Y68-Y281 AromaticContact CD1-CD1 3.52Å; Y68-Y281 HydrophobicContact CD1-CD1 3.52Å; Y68-Y281 AromaticContact CD1-CD2 3.75Å; Y68-Y281 HydrophobicContact CD1-CD2 3.75Å; Y68-Y281 AromaticContact CD1-CE1 3.85Å; Y68-Y281 HydrophobicContact CD1-CE1 3.85Å; Y68-Y281 HydrophobicContact CD1-CE2 4.04Å; Y68-Y281 AromaticContact CD1-CG 3.48Å; Y68-Y281 HydrophobicContact CD1-CG 3.48Å; Y68-Y281 VanDerWaalsContact CD1-CG 3.48Å; Y68-Y281 AromaticContact CE1-CD1 3.54Å; Y68-Y281 HydrophobicContact CE1-CD1 3.54Å; Y68-Y281 HydrophobicContact CE1-CE1 4.06Å; Y68-Y281 AromaticContact CE1-CG 3.84Å; Y68-Y281 HydrophobicContact CE1-CG 3.84Å; Y68-Y281 HydrophobicContact CG-CD1 4.43Å; Y68-Y281 HydrophobicContact CG-CD2 4.01Å; Y68-Y281 AromaticContact CG-CG 3.96Å; Y68-Y281 HydrophobicContact CG-CG 3.96Å; Y68-L284 PolarHBondContact OH-O 3.23Å; Y68-P285 WeakPolarHBondContact OH-CA 3.34Å; Y68-I286 HydrophobicContact CD1-CG1 4.11Å; Y68-I286 HydrophobicContact CE1-CB 4.41Å; Y68-I286 HydrophobicContact CE1-CD1 4.29Å; Y68-I286 HydrophobicContact CE1-CG1 3.37Å; Y68-I286 HydrophobicContact CE2-CD1 4.4Å; Y68-I286 HydrophobicContact CE2-CG1 3.9Å; Y68-I286 WeakPolarHBondContact OH-CG1 3.44Å; Y68-I286 PolarHBondContact OH-N 3.16Å; Y68-I289 HydrophobicContact CE1-CD1 4.29Å |
| 69 | G | 94.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -64.2 | -47.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | S71 L72 V73 M216 F217 | G69-S71 VanDerWaalsContact C-N 3.32Å; G69-S71 PolarHBondContact O-N 2.88Å; G69-L72 PolarHBondContact O-N 2.92Å; G69-V73 WeakPolarHBondContact O-CG2 3.47Å; G69-V73 PolarHBondContact O-N 3.1Å; G69-V73 VanDerWaalsContact O-N 3.1Å; G69-M216 VanDerWaalsContact CA-CE 3.44Å; G69-M216 WeakPolarHBondContact CA-O 3.46Å; G69-M216 PolarHBondContact N-O 2.84Å; G69-F217 VanDerWaalsContact C-CE1 3.4Å |
| 70 | L | 96 | Very high | 95.1 | Very high | 28 Ų | 28 | 24.2 Ų | 24.2 | 15% | 0.147 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -66.2 | -36.5 | 175.4 | -175.2 | 60.7 | 0 | 0 | 0 | 111.3 | S67 L72 V73 V74 S221 | S67-L70 VanDerWaalsContact OG-CB 3.22Å; S67-L70 WeakPolarHBondContact OG-CB 3.48Å; S67-L70 PolarHBondContact OG-N 3.39Å; S67-L70 VanDerWaalsContact OG-N 3.13Å; L70-L72 PolarHBondContact O-N 3.41Å; L70-V73 WeakPolarHBondContact O-CB 3.36Å; L70-V73 PolarHBondContact O-N 3.26Å; L70-V74 HydrophobicContact CG-CG2 4.49Å; L70-V74 VanDerWaalsContact O-CG2 3.32Å; L70-V74 WeakPolarHBondContact O-CG2 3.41Å; L70-V74 PolarHBondContact O-N 2.93Å; L70-S221 WeakPolarHBondContact CD2-O 3.23Å |
| 71 | S | 96.6 | Very high | 95.1 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -57.7 | -49.7 | 174.2 | 178.2 | 0 | 0 | 0 | 0 | 112.1 | V61 S65 S67 Y68 G69 V73 V74 W75 Y281 | V61-S71 VanDerWaalsContact CG1-OG 3.23Å; V61-S71 WeakPolarHBondContact CG1-OG 3.28Å; S65-S71 WeakPolarHBondContact OG-CB 3.49Å; S67-S71 WeakPolarHBondContact O-CB 3.45Å; S67-S71 PolarHBondContact O-N 2.92Å; S67-S71 VanDerWaalsContact O-N 3.08Å; Y68-S71 WeakPolarHBondContact O-CB 3.49Å; Y68-S71 PolarHBondContact O-N 3.25Å; G69-S71 VanDerWaalsContact C-N 3.32Å; G69-S71 PolarHBondContact O-N 2.88Å; S71-V73 VanDerWaalsContact C-N 3.29Å; S71-V73 PolarHBondContact O-N 2.91Å; S71-V74 WeakPolarHBondContact O-CB 3.26Å; S71-V74 PolarHBondContact O-N 2.98Å; S71-V74 VanDerWaalsContact O-N 3.1Å; S71-W75 PolarHBondContact O-N 3.34Å; S71-Y281 WeakPolarHBondContact CB-OH 3.43Å; S71-Y281 PolarHBondContact OG-OH 3.12Å |
| 72 | L | 96.5 | Very high | 95 | Very high | 23 Ų | 23 | 24.7 Ų | 24.7 | 12% | 0.12 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -62.9 | -36 | 178.7 | -68 | 175.7 | 0 | 0 | 0 | 112.3 | Y68 G69 L70 W75 T76 M216 N277 V278 Y281 | Y68-L72 WeakPolarHBondContact O-CG 3.37Å; Y68-L72 PolarHBondContact O-N 3.46Å; G69-L72 PolarHBondContact O-N 2.92Å; L70-L72 PolarHBondContact O-N 3.41Å; L72-W75 PolarHBondContact O-N 2.9Å; L72-T76 WeakPolarHBondContact O-CB 3.37Å; L72-T76 PolarHBondContact O-N 3.01Å; L72-T76 PolarHBondContact O-OG1 3.01Å; L72-M216 HydrophobicContact CD1-CE 4.28Å; L72-N277 HydrophobicContact CD2-CB 3.85Å; L72-V278 HydrophobicContact CD1-CG2 4.06Å; L72-V278 HydrophobicContact CD2-CG2 3.92Å; L72-Y281 HydrophobicContact CD2-CD2 4.23Å; L72-Y281 HydrophobicContact CD2-CE2 3.94Å; L72-Y281 HydrophobicContact CG-CD2 4.27Å; L72-Y281 HydrophobicContact CG-CE2 4.03Å |
| 73 | V | 96.6 | Very high | 94.8 | Very high | 59 Ų | 59 | 26.5 Ų | 26.5 | 36% | 0.358 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -62.7 | -45.7 | 172.4 | 171 | 0 | 0 | 0 | 0 | 110.6 | G69 L70 S71 W75 T76 I77 F217 | G69-V73 WeakPolarHBondContact O-CG2 3.47Å; G69-V73 PolarHBondContact O-N 3.1Å; G69-V73 VanDerWaalsContact O-N 3.1Å; L70-V73 WeakPolarHBondContact O-CB 3.36Å; L70-V73 PolarHBondContact O-N 3.26Å; S71-V73 VanDerWaalsContact C-N 3.29Å; S71-V73 PolarHBondContact O-N 2.91Å; V73-W75 PolarHBondContact O-N 3.14Å; V73-T76 WeakPolarHBondContact O-CB 3.37Å; V73-T76 PolarHBondContact O-N 2.82Å; V73-T76 VanDerWaalsContact O-N 3.16Å; V73-I77 HydrophobicContact CG1-CD1 3.62Å; V73-I77 HydrophobicContact CG1-CG1 4.24Å; V73-I77 WeakPolarHBondContact O-CG1 3.47Å; V73-I77 PolarHBondContact O-N 3.16Å; V73-F217 HydrophobicContact CG2-CE1 4.33Å |
| 74 | V | 96.8 | Very high | 94.7 | Very high | 3 Ų | 3 | 25.1 Ų | 25.1 | 2% | 0.018 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -59.9 | -44 | 176.7 | 169.1 | 0 | 0 | 0 | 0 | 111.4 | V61 L70 S71 T76 I77 G78 A230 L231 A234 | V61-V74 HydrophobicContact CG1-CB 4.08Å; V61-V74 HydrophobicContact CG1-CG1 3.89Å; L70-V74 HydrophobicContact CG-CG2 4.49Å; L70-V74 VanDerWaalsContact O-CG2 3.32Å; L70-V74 WeakPolarHBondContact O-CG2 3.41Å; L70-V74 PolarHBondContact O-N 2.93Å; S71-V74 WeakPolarHBondContact O-CB 3.26Å; S71-V74 PolarHBondContact O-N 2.98Å; S71-V74 VanDerWaalsContact O-N 3.1Å; V74-T76 VanDerWaalsContact C-N 3.31Å; V74-T76 PolarHBondContact O-N 3.39Å; V74-I77 PolarHBondContact O-N 2.93Å; V74-G78 PolarHBondContact O-N 3.28Å; V74-A230 HydrophobicContact CG1-CB 4.01Å; V74-A230 HydrophobicContact CG2-CB 4.2Å; V74-L231 HydrophobicContact CG1-CD2 3.97Å; V74-L231 HydrophobicContact CG1-CG 4.13Å; V74-A234 HydrophobicContact CG1-CB 4.01Å |
| 75 | W | 97.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 23.6 Ų | 23.6 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -61.2 | -38.9 | 174.8 | -82.2 | 103.9 | 0 | 0 | 0 | 113 | I54 P58 V61 S71 L72 V73 G79 A234 S237 Y238 Y273 I274 N277 | I54-W75 HydrophobicContact CD1-CH2 3.5Å; I54-W75 VanDerWaalsContact CD1-CH2 3.5Å; I54-W75 HydrophobicContact CD1-CZ2 4.06Å; I54-W75 HydrophobicContact CD1-CZ3 3.93Å; P58-W75 HydrophobicContact CG-CZ2 4.17Å; V61-W75 HydrophobicContact CG2-CZ2 4.24Å; S71-W75 PolarHBondContact O-N 3.34Å; L72-W75 PolarHBondContact O-N 2.9Å; V73-W75 PolarHBondContact O-N 3.14Å; W75-G79 PolarHBondContact O-N 3.17Å; W75-G79 VanDerWaalsContact O-N 3.1Å; W75-A234 HydrophobicContact CD2-CB 4.33Å; W75-A234 HydrophobicContact CE3-CB 4.31Å; W75-S237 WeakPolarHBondContact CH2-OG 3.26Å; W75-Y238 HydrophobicContact CE3-CD2 4.49Å; W75-Y238 AromaticContact CE3-CE2 3.69Å; W75-Y238 HydrophobicContact CE3-CE2 3.69Å; W75-Y238 HydrophobicContact CZ3-CE2 4.1Å; W75-Y238 WeakPolarHBondContact O-CE2 3.49Å; W75-Y238 PolarHBondContact O-OH 2.74Å; W75-Y273 AromaticContact CE3-CD2 4Å; W75-Y273 HydrophobicContact CE3-CD2 4Å; W75-Y273 HydrophobicContact CE3-CG 4.33Å; W75-Y273 AromaticContact CZ3-CD2 3.48Å; W75-Y273 HydrophobicContact CZ3-CD2 3.48Å; W75-Y273 VanDerWaalsContact CZ3-CD2 3.48Å; W75-Y273 HydrophobicContact CZ3-CE2 4.14Å; W75-Y273 AromaticContact CZ3-CG 3.93Å; W75-Y273 HydrophobicContact CZ3-CG 3.93Å; W75-I274 HydrophobicContact CB-CG1 4.45Å; W75-N277 PolarHBondContact NE1-ND2 3.39Å; W75-N277 PolarHBondContact NE1-OD1 2.91Å |
| 76 | T | 96.5 | Very high | 94.5 | Very high | 52 Ų | 52 | 23.6 Ų | 23.6 | 32% | 0.319 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -68.9 | -47.9 | 178 | -55.9 | 0 | 0 | 0 | 0 | 111 | L72 V73 V74 G78 G79 I80 I274 | L72-T76 WeakPolarHBondContact O-CB 3.37Å; L72-T76 PolarHBondContact O-N 3.01Å; L72-T76 PolarHBondContact O-OG1 3.01Å; V73-T76 WeakPolarHBondContact O-CB 3.37Å; V73-T76 PolarHBondContact O-N 2.82Å; V73-T76 VanDerWaalsContact O-N 3.16Å; V74-T76 VanDerWaalsContact C-N 3.31Å; V74-T76 PolarHBondContact O-N 3.39Å; T76-G78 VanDerWaalsContact C-N 3.32Å; T76-G78 PolarHBondContact O-N 3.17Å; T76-G79 PolarHBondContact O-N 3.41Å; T76-I80 HydrophobicContact CG2-CD1 4.09Å; T76-I80 WeakPolarHBondContact O-CG1 3.17Å; T76-I80 PolarHBondContact O-N 3.17Å; T76-I274 HydrophobicContact CG2-CD1 4.5Å; T76-I274 WeakPolarHBondContact OG1-CD1 3.24Å |
| 77 | I | 95.3 | Very high | 94.4 | Very high | 84 Ų | 84 | 23.1 Ų | 23.1 | 43% | 0.431 | 12% | 0.124 | S | C | . | . | H | α-helix | trans | -61.3 | -42.5 | 176.8 | -68.2 | 172.4 | 0 | 0 | 0 | 110.4 | V73 V74 G79 I80 F81 L231 | V73-I77 HydrophobicContact CG1-CD1 3.62Å; V73-I77 HydrophobicContact CG1-CG1 4.24Å; V73-I77 WeakPolarHBondContact O-CG1 3.47Å; V73-I77 PolarHBondContact O-N 3.16Å; V74-I77 PolarHBondContact O-N 2.93Å; I77-G79 VanDerWaalsContact C-N 3.32Å; I77-G79 PolarHBondContact O-N 2.96Å; I77-I80 PolarHBondContact O-N 2.92Å; I77-F81 VanDerWaalsContact O-CB 3.26Å; I77-F81 WeakPolarHBondContact O-CB 3.4Å; I77-F81 PolarHBondContact O-N 3.42Å; I77-L231 HydrophobicContact CB-CD2 4.35Å; I77-L231 HydrophobicContact CG2-CD2 3.94Å |
| 78 | G | 94.8 | Very high | 94.3 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.3 | -39.7 | 176 | 0 | 0 | 0 | 0 | 0 | 113.1 | V74 T76 S82 | V74-G78 PolarHBondContact O-N 3.28Å; T76-G78 VanDerWaalsContact C-N 3.32Å; T76-G78 PolarHBondContact O-N 3.17Å; G78-S82 WeakPolarHBondContact O-CB 3.48Å; G78-S82 PolarHBondContact O-N 2.92Å; G78-S82 PolarHBondContact O-OG 3.42Å |
| 79 | G | 94.3 | Very high | 94.2 | Very high | 1 Ų | 1 | 22.5 Ų | 22.5 | 1% | 0.01 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -65.1 | -49 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | W75 T76 I77 F81 S82 V83 | W75-G79 PolarHBondContact O-N 3.17Å; W75-G79 VanDerWaalsContact O-N 3.1Å; T76-G79 PolarHBondContact O-N 3.41Å; I77-G79 VanDerWaalsContact C-N 3.32Å; I77-G79 PolarHBondContact O-N 2.96Å; G79-F81 PolarHBondContact O-N 2.75Å; G79-S82 PolarHBondContact O-N 3.4Å; G79-V83 WeakPolarHBondContact O-CG2 2.98Å; G79-V83 PolarHBondContact O-N 3.21Å |
| 80 | I | 93.5 | Very high | 94 | Very high | 89 Ų | 89 | 22.5 Ų | 22.5 | 46% | 0.456 | 12% | 0.121 | S | C | . | . | H | α-helix | trans | -60.5 | -45.6 | 177.5 | -66.3 | 168.4 | 0 | 0 | 0 | 111 | T76 I77 S82 V83 F84 | T76-I80 HydrophobicContact CG2-CD1 4.09Å; T76-I80 WeakPolarHBondContact O-CG1 3.17Å; T76-I80 PolarHBondContact O-N 3.17Å; I77-I80 PolarHBondContact O-N 2.92Å; I80-S82 VanDerWaalsContact C-N 3.3Å; I80-S82 PolarHBondContact O-N 3.32Å; I80-V83 WeakPolarHBondContact O-CB 3.36Å; I80-V83 PolarHBondContact O-N 3.46Å; I80-F84 HydrophobicContact CG2-CZ 4.44Å; I80-F84 PolarHBondContact O-N 2.89Å; I80-F84 VanDerWaalsContact O-N 3.15Å |
| 81 | F | 93.2 | Very high | 93.8 | Very high | 10 Ų | 10 | 21.2 Ų | 21.2 | 4% | 0.044 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -58.5 | -43.6 | 176.2 | 172.4 | -94.9 | 0 | 0 | 0 | 111.6 | I77 G79 V83 F84 G85 L235 W389 F423 L426 T427 L430 | I77-F81 VanDerWaalsContact O-CB 3.26Å; I77-F81 WeakPolarHBondContact O-CB 3.4Å; I77-F81 PolarHBondContact O-N 3.42Å; G79-F81 PolarHBondContact O-N 2.75Å; F81-V83 VanDerWaalsContact C-N 3.35Å; F81-V83 PolarHBondContact O-N 2.81Å; F81-F84 PolarHBondContact O-N 2.73Å; F81-G85 PolarHBondContact O-N 3.24Å; F81-L235 HydrophobicContact CD1-CD1 3.98Å; F81-L235 HydrophobicContact CD1-CD2 3.42Å; F81-L235 VanDerWaalsContact CD1-CD2 3.42Å; F81-L235 HydrophobicContact CD1-CG 4.37Å; F81-L235 HydrophobicContact CE1-CD1 3.86Å; F81-L235 HydrophobicContact CE1-CD2 3.95Å; F81-L235 HydrophobicContact CG-CD2 4.37Å; F81-W389 HydrophobicContact CD1-CH2 4.35Å; F81-W389 HydrophobicContact CD1-CZ3 4.39Å; F81-W389 HydrophobicContact CE1-CD2 4.14Å; F81-W389 AromaticContact CE1-CE3 3.65Å; F81-W389 HydrophobicContact CE1-CE3 3.65Å; F81-W389 AromaticContact CE1-CH2 3.7Å; F81-W389 HydrophobicContact CE1-CH2 3.7Å; F81-W389 HydrophobicContact CE1-CZ2 4.19Å; F81-W389 AromaticContact CE1-CZ3 3.4Å; F81-W389 HydrophobicContact CE1-CZ3 3.4Å; F81-W389 VanDerWaalsContact CE1-CZ3 3.4Å; F81-W389 AromaticContact CZ-CE3 3.94Å; F81-W389 HydrophobicContact CZ-CE3 3.94Å; F81-W389 HydrophobicContact CZ-CZ3 4.04Å; F81-F423 HydrophobicContact CD1-CE2 4.18Å; F81-F423 HydrophobicContact CD2-CD2 4.15Å; F81-F423 HydrophobicContact CD2-CE2 4.04Å; F81-F423 AromaticContact CE1-CE2 3.73Å; F81-F423 HydrophobicContact CE1-CE2 3.73Å; F81-F423 HydrophobicContact CE1-CZ 4.01Å; F81-F423 AromaticContact CE2-CD2 3.78Å; F81-F423 HydrophobicContact CE2-CD2 3.78Å; F81-F423 AromaticContact CE2-CE2 3.51Å; F81-F423 HydrophobicContact CE2-CE2 3.51Å; F81-F423 HydrophobicContact CE2-CG 4.48Å; F81-F423 HydrophobicContact CE2-CZ 4.01Å; F81-F423 HydrophobicContact CG-CE2 4.36Å; F81-F423 HydrophobicContact CZ-CD2 4.11Å; F81-F423 HydrophobicContact CZ-CE1 4.35Å; F81-F423 AromaticContact CZ-CE2 3.36Å; F81-F423 HydrophobicContact CZ-CE2 3.36Å; F81-F423 AromaticContact CZ-CZ 3.51Å; F81-F423 HydrophobicContact CZ-CZ 3.51Å; F81-L426 HydrophobicContact CD2-CB 3.63Å; F81-L426 HydrophobicContact CD2-CD1 3.7Å; F81-L426 HydrophobicContact CD2-CG 4.27Å; F81-L426 HydrophobicContact CE2-CB 3.45Å; F81-L426 VanDerWaalsContact CE2-CB 3.45Å; F81-L426 HydrophobicContact CE2-CD1 4.35Å; F81-T427 HydrophobicContact CE2-CG2 4.23Å; F81-T427 HydrophobicContact CZ-CG2 3.84Å; F81-L430 HydrophobicContact CE1-CD1 3.83Å; F81-L430 HydrophobicContact CE2-CD1 4.01Å; F81-L430 HydrophobicContact CZ-CD1 3.47Å; F81-L430 VanDerWaalsContact CZ-CD1 3.47Å |
| 82 | S | 92.9 | Very high | 93.5 | Very high | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -67.2 | -34.5 | 178.8 | -57.7 | 0 | 0 | 0 | 0 | 112.3 | G78 G79 I80 G85 A86 Y238 | G78-S82 WeakPolarHBondContact O-CB 3.48Å; G78-S82 PolarHBondContact O-N 2.92Å; G78-S82 PolarHBondContact O-OG 3.42Å; G79-S82 PolarHBondContact O-N 3.4Å; I80-S82 VanDerWaalsContact C-N 3.3Å; I80-S82 PolarHBondContact O-N 3.32Å; S82-G85 PolarHBondContact O-N 2.9Å; S82-A86 VanDerWaalsContact O-CB 3.28Å; S82-A86 WeakPolarHBondContact O-CB 3.47Å; S82-A86 PolarHBondContact O-N 2.84Å; S82-Y238 VanDerWaalsContact OG-CB 3.31Å; S82-Y238 WeakPolarHBondContact OG-CB 3.39Å |
| 83 | V | 91.8 | Very high | 93.1 | Very high | 39 Ų | 39 | 20.3 Ų | 20.3 | 24% | 0.236 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -60.2 | -46.5 | 172.8 | 170.8 | 0 | 0 | 0 | 0 | 110.6 | G79 I80 F81 A86 L87 M266 | G79-V83 WeakPolarHBondContact O-CG2 2.98Å; G79-V83 PolarHBondContact O-N 3.21Å; I80-V83 WeakPolarHBondContact O-CB 3.36Å; I80-V83 PolarHBondContact O-N 3.46Å; F81-V83 VanDerWaalsContact C-N 3.35Å; F81-V83 PolarHBondContact O-N 2.81Å; V83-A86 PolarHBondContact O-N 3.45Å; V83-L87 HydrophobicContact CG1-CD1 3.92Å; V83-L87 HydrophobicContact CG1-CG 4.38Å; V83-L87 WeakPolarHBondContact O-CB 3.27Å; V83-L87 VanDerWaalsContact O-CG 3.28Å; V83-L87 WeakPolarHBondContact O-CG 3.49Å; V83-L87 PolarHBondContact O-N 3.28Å; V83-M266 HydrophobicContact CG2-CB 3.63Å; V83-M266 HydrophobicContact CG2-CE 4.34Å; V83-M266 HydrophobicContact CG2-CG 4.34Å |
| 84 | F | 92 | Very high | 92.8 | Very high | 49 Ų | 49 | 17.9 Ų | 17.9 | 22% | 0.215 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -62.3 | -44.1 | 177.6 | -72.3 | -5.9 | 0 | 0 | 0 | 111.9 | I80 F81 L87 C88 Y419 I422 F423 | I80-F84 HydrophobicContact CG2-CZ 4.44Å; I80-F84 PolarHBondContact O-N 2.89Å; I80-F84 VanDerWaalsContact O-N 3.15Å; F81-F84 PolarHBondContact O-N 2.73Å; F84-L87 PolarHBondContact O-N 2.91Å; F84-C88 PolarHBondContact O-N 3.06Å; F84-C88 PolarHBondContact O-SG 3.02Å; F84-C88 VanDerWaalsContact O-SG 3.33Å; F84-Y419 AromaticContact CD1-CD1 3.64Å; F84-Y419 HydrophobicContact CD1-CD1 3.64Å; F84-Y419 AromaticContact CD1-CE1 3.93Å; F84-Y419 HydrophobicContact CD1-CE1 3.93Å; F84-Y419 AromaticContact CE1-CD1 3.75Å; F84-Y419 HydrophobicContact CE1-CD1 3.75Å; F84-Y419 AromaticContact CE1-CE1 3.64Å; F84-Y419 HydrophobicContact CE1-CE1 3.64Å; F84-Y419 HydrophobicContact CG-CD1 4.25Å; F84-Y419 HydrophobicContact CZ-CD1 4.43Å; F84-Y419 HydrophobicContact CZ-CE1 4.42Å; F84-I422 HydrophobicContact CD2-CG2 4.02Å; F84-I422 HydrophobicContact CE2-CG2 3.96Å; F84-F423 HydrophobicContact CB-CD2 4.19Å |
| 85 | G | 91.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 18.7 Ų | 18.7 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -59.5 | -48.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | F81 S82 L87 C88 Y89 | F81-G85 PolarHBondContact O-N 3.24Å; S82-G85 PolarHBondContact O-N 2.9Å; G85-L87 PolarHBondContact O-N 3.42Å; G85-C88 PolarHBondContact O-N 3.2Å; G85-Y89 WeakPolarHBondContact O-CD2 3.42Å; G85-Y89 PolarHBondContact O-N 2.86Å |
| 86 | A | 91.8 | Very high | 92 | Very high | 0 Ų | 0 | 18.9 Ų | 18.9 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -64.5 | -40.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | S82 V83 Y89 A90 W241 I262 M266 | S82-A86 VanDerWaalsContact O-CB 3.28Å; S82-A86 WeakPolarHBondContact O-CB 3.47Å; S82-A86 PolarHBondContact O-N 2.84Å; V83-A86 PolarHBondContact O-N 3.45Å; A86-Y89 PolarHBondContact O-N 2.94Å; A86-A90 PolarHBondContact O-N 2.98Å; A86-W241 VanDerWaalsContact CA-CE3 3.46Å; A86-W241 HydrophobicContact CB-CB 4.24Å; A86-W241 HydrophobicContact CB-CD2 3.8Å; A86-W241 HydrophobicContact CB-CE3 3.63Å; A86-W241 HydrophobicContact CB-CG 4.07Å; A86-W241 HydrophobicContact CB-CZ3 4.3Å; A86-I262 HydrophobicContact CB-CD1 4.48Å; A86-I262 HydrophobicContact CB-CG2 3.43Å; A86-I262 VanDerWaalsContact CB-CG2 3.43Å; A86-M266 HydrophobicContact CB-CG 4.22Å; A86-M266 HydrophobicContact CB-SD 4.28Å |
| 87 | L | 91.4 | Very high | 91.2 | Very high | 35 Ų | 35 | 20 Ų | 20 | 18% | 0.183 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -62.3 | -46.9 | 174 | -72.1 | 173.5 | 0 | 0 | 0 | 111.5 | V83 F84 G85 Y89 A90 E91 L415 Y419 | V83-L87 HydrophobicContact CG1-CD1 3.92Å; V83-L87 HydrophobicContact CG1-CG 4.38Å; V83-L87 WeakPolarHBondContact O-CB 3.27Å; V83-L87 VanDerWaalsContact O-CG 3.28Å; V83-L87 WeakPolarHBondContact O-CG 3.49Å; V83-L87 PolarHBondContact O-N 3.28Å; F84-L87 PolarHBondContact O-N 2.91Å; G85-L87 PolarHBondContact O-N 3.42Å; L87-Y89 VanDerWaalsContact C-N 3.28Å; L87-Y89 PolarHBondContact O-N 3.23Å; L87-A90 VanDerWaalsContact O-CB 3.29Å; L87-A90 WeakPolarHBondContact O-CB 3.18Å; L87-A90 PolarHBondContact O-N 3.23Å; L87-E91 PolarHBondContact O-N 2.88Å; L87-E91 VanDerWaalsContact O-N 3.15Å; L87-L415 HydrophobicContact CB-CD1 3.8Å; L87-L415 WeakPolarHBondContact O-CD1 3.3Å; L87-Y419 HydrophobicContact CD1-CE1 4.42Å |
| 88 | C | 92.9 | Very high | 90.3 | Very high | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -59.2 | -40.4 | 175.9 | -70.4 | 0 | 0 | 0 | 0 | 112.2 | F84 G85 E91 L92 I396 Q399 P420 | F84-C88 PolarHBondContact O-N 3.06Å; F84-C88 PolarHBondContact O-SG 3.02Å; F84-C88 VanDerWaalsContact O-SG 3.33Å; G85-C88 PolarHBondContact O-N 3.2Å; C88-E91 PolarHBondContact O-N 3.34Å; C88-L92 PolarHBondContact O-N 3.28Å; C88-L92 VanDerWaalsContact O-N 3.09Å; C88-I396 HydrophobicContact CB-CD1 3.7Å; C88-I396 HydrophobicContact CB-CG1 3.86Å; C88-I396 HydrophobicContact CB-CG2 4.32Å; C88-Q399 PolarHBondContact O-OE1 3.37Å; C88-P420 VanDerWaalsContact SG-CA 3.59Å |
| 89 | Y | 91.6 | Very high | 89.2 | Confident | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -68.9 | -30.6 | 173.8 | -94.4 | -118.5 | 0 | 0 | 0 | 113.5 | G85 A86 L87 E91 L92 G93 S102 Y105 W241 D242 N245 V392 S395 I396 | G85-Y89 WeakPolarHBondContact O-CD2 3.42Å; G85-Y89 PolarHBondContact O-N 2.86Å; A86-Y89 PolarHBondContact O-N 2.94Å; L87-Y89 VanDerWaalsContact C-N 3.28Å; L87-Y89 PolarHBondContact O-N 3.23Å; Y89-E91 VanDerWaalsContact C-N 3.3Å; Y89-E91 PolarHBondContact O-N 3.42Å; Y89-L92 PolarHBondContact O-N 2.9Å; Y89-G93 PolarHBondContact O-N 3.44Å; Y89-S102 PolarHBondContact OH-OG 3.22Å; Y89-Y105 HydrophobicContact CD1-CD2 4.42Å; Y89-Y105 AromaticContact CD1-CE2 3.76Å; Y89-Y105 HydrophobicContact CD1-CE2 3.76Å; Y89-Y105 HydrophobicContact CE1-CD2 4.17Å; Y89-Y105 AromaticContact CE1-CE2 3.89Å; Y89-Y105 HydrophobicContact CE1-CE2 3.89Å; Y89-Y105 HydrophobicContact CG-CE2 4.48Å; Y89-W241 HydrophobicContact CD1-CH2 4.38Å; Y89-W241 AromaticContact CD1-CZ3 3.81Å; Y89-W241 HydrophobicContact CD1-CZ3 3.81Å; Y89-W241 AromaticContact CD2-CH2 3.64Å; Y89-W241 HydrophobicContact CD2-CH2 3.64Å; Y89-W241 AromaticContact CD2-CZ3 3.65Å; Y89-W241 HydrophobicContact CD2-CZ3 3.65Å; Y89-W241 HydrophobicContact CE1-CZ3 4.38Å; Y89-W241 AromaticContact CE2-CH2 3.91Å; Y89-W241 HydrophobicContact CE2-CH2 3.91Å; Y89-W241 HydrophobicContact CE2-CZ3 4.25Å; Y89-W241 AromaticContact CG-CH2 3.92Å; Y89-W241 HydrophobicContact CG-CH2 3.92Å; Y89-W241 AromaticContact CG-CZ3 3.42Å; Y89-W241 HydrophobicContact CG-CZ3 3.42Å; Y89-W241 VanDerWaalsContact CG-CZ3 3.42Å; Y89-D242 HydrophobicContact CD1-CB 4.05Å; Y89-D242 HydrophobicContact CE1-CB 4.16Å; Y89-N245 PolarHBondContact O-ND2 3.42Å; Y89-V392 HydrophobicContact CE2-CG1 3.75Å; Y89-V392 WeakPolarHBondContact OH-CA 3.44Å; Y89-S395 VanDerWaalsContact OH-CB 3.3Å; Y89-S395 WeakPolarHBondContact OH-CB 3.26Å; Y89-S395 PolarHBondContact OH-OG 2.81Å; Y89-I396 HydrophobicContact CD2-CD1 3.92Å; Y89-I396 HydrophobicContact CD2-CG1 4.03Å; Y89-I396 HydrophobicContact CE2-CD1 3.86Å; Y89-I396 HydrophobicContact CE2-CG1 3.86Å |
| 90 | A | 90.7 | Very high | 88.2 | Confident | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -61.3 | -42.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | A86 L87 G93 T94 P259 I262 L413 | A86-A90 PolarHBondContact O-N 2.98Å; L87-A90 VanDerWaalsContact O-CB 3.29Å; L87-A90 WeakPolarHBondContact O-CB 3.18Å; L87-A90 PolarHBondContact O-N 3.23Å; A90-G93 PolarHBondContact O-N 2.91Å; A90-T94 VanDerWaalsContact O-CG2 3.3Å; A90-T94 WeakPolarHBondContact O-CG2 3.33Å; A90-T94 PolarHBondContact O-N 3.13Å; A90-T94 PolarHBondContact O-OG1 2.99Å; A90-P259 HydrophobicContact CB-CB 4.42Å; A90-P259 HydrophobicContact CB-CG 4.32Å; A90-I262 HydrophobicContact CB-CD1 3.78Å; A90-L413 HydrophobicContact CB-CD2 3.8Å |
| 91 | E | 91.6 | Very high | 87.7 | Confident | 1 Ų | 1 | 18.1 Ų | 18.1 | 1% | 0.005 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -63 | -47.6 | 173.9 | 171.8 | 170 | 152.1 | 0 | 0 | 111.7 | L87 C88 Y89 G93 T94 T95 Q399 R403 L413 L415 | L87-E91 PolarHBondContact O-N 2.88Å; L87-E91 VanDerWaalsContact O-N 3.15Å; C88-E91 PolarHBondContact O-N 3.34Å; Y89-E91 VanDerWaalsContact C-N 3.3Å; Y89-E91 PolarHBondContact O-N 3.42Å; E91-G93 VanDerWaalsContact C-N 3.34Å; E91-G93 PolarHBondContact O-N 3.47Å; E91-T94 PolarHBondContact O-N 2.89Å; E91-T94 PolarHBondContact O-OG1 3.49Å; E91-T95 WeakPolarHBondContact O-CB 3.2Å; E91-T95 PolarHBondContact O-N 3.2Å; E91-T95 PolarHBondContact O-OG1 3.34Å; E91-Q399 PolarHBondContact OE1-NE2 2.81Å; E91-Q399 PolarHBondContact OE2-NE2 3.38Å; E91-R403 IonicContact OE1-CZ 2.7Å; E91-R403 IonicContact OE1-NE 2.7Å; E91-R403 PolarHBondContact OE1-NE 3.08Å; E91-R403 IonicContact OE1-NH2 3.76Å; E91-R403 PolarHBondContact OE1-NH2 3.43Å; E91-R403 IonicContact OE2-CZ 2.84Å; E91-R403 IonicContact OE2-NH2 3.79Å; E91-R403 PolarHBondContact OE2-NH2 3.22Å; E91-L413 HydrophobicContact CB-CD2 4.19Å; E91-L413 WeakPolarHBondContact CG-O 3.45Å; E91-L415 HydrophobicContact CB-CD1 4.28Å; E91-L415 WeakPolarHBondContact OE2-CB 3.49Å; E91-L415 PolarHBondContact OE2-N 2.99Å |
| 92 | L | 91.3 | Very high | 87.4 | Confident | 5 Ų | 5 | 17.6 Ų | 17.6 | 3% | 0.026 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -59.7 | -43.6 | 177.1 | -77.1 | 171.8 | 0 | 0 | 0 | 112.2 | C88 Y89 T94 T95 I96 Y105 Q399 | C88-L92 PolarHBondContact O-N 3.28Å; C88-L92 VanDerWaalsContact O-N 3.09Å; Y89-L92 PolarHBondContact O-N 2.9Å; L92-T94 PolarHBondContact O-N 3.31Å; L92-T95 PolarHBondContact O-N 3.08Å; L92-I96 HydrophobicContact CD2-CD1 4.4Å; L92-I96 PolarHBondContact O-N 3.26Å; L92-Y105 HydrophobicContact CB-CD1 4.28Å; L92-Y105 HydrophobicContact CB-CD2 3.92Å; L92-Y105 HydrophobicContact CB-CE1 4.15Å; L92-Y105 HydrophobicContact CB-CE2 3.75Å; L92-Y105 HydrophobicContact CB-CG 4.18Å; L92-Y105 HydrophobicContact CD1-CD2 3.81Å; L92-Y105 HydrophobicContact CD1-CE2 4.29Å; L92-Y105 HydrophobicContact CD1-CG 4.26Å; L92-Y105 HydrophobicContact CG-CD2 4.41Å; L92-Q399 HydrophobicContact CD1-CB 4.18Å; L92-Q399 HydrophobicContact CD2-CB 3.72Å; L92-Q399 HydrophobicContact CD2-CG 3.91Å; L92-Q399 HydrophobicContact CG-CB 4Å; L92-Q399 HydrophobicContact CG-CG 4.05Å |
| 93 | G | 87.9 | Confident | 87.3 | Confident | 0 Ų | 0 | 17.8 Ų | 17.8 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -69.1 | -31.6 | -180 | 0 | 0 | 0 | 0 | 0 | 114 | Y89 A90 E91 Y105 | Y89-G93 PolarHBondContact O-N 3.44Å; A90-G93 PolarHBondContact O-N 2.91Å; E91-G93 VanDerWaalsContact C-N 3.34Å; E91-G93 PolarHBondContact O-N 3.47Å; G93-Y105 WeakPolarHBondContact CA-OH 3.28Å; G93-Y105 PolarHBondContact N-OH 3.21Å |
| 94 | T | 89.3 | Confident | 87.1 | Confident | 8 Ų | 8 | 16.1 Ų | 16.1 | 5% | 0.049 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -76.7 | -23.7 | 172.4 | 56.8 | 0 | 0 | 0 | 0 | 113 | A90 E91 L92 L258 P259 L413 | A90-T94 VanDerWaalsContact O-CG2 3.3Å; A90-T94 WeakPolarHBondContact O-CG2 3.33Å; A90-T94 PolarHBondContact O-N 3.13Å; A90-T94 PolarHBondContact O-OG1 2.99Å; E91-T94 PolarHBondContact O-N 2.89Å; E91-T94 PolarHBondContact O-OG1 3.49Å; L92-T94 PolarHBondContact O-N 3.31Å; T94-L258 HydrophobicContact CG2-CD2 4.29Å; T94-P259 HydrophobicContact CG2-CG 4.49Å; T94-L413 HydrophobicContact CG2-CB 4.36Å; T94-L413 WeakPolarHBondContact OG1-CB 3.46Å |
| 95 | T | 89.6 | Confident | 87.1 | Confident | 20 Ų | 20 | 13.9 Ų | 13.9 | 12% | 0.123 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -90.6 | -35 | 179.9 | -53.7 | 0 | 0 | 0 | 0 | 112.8 | E91 L92 R409 R411 | E91-T95 WeakPolarHBondContact O-CB 3.2Å; E91-T95 PolarHBondContact O-N 3.2Å; E91-T95 PolarHBondContact O-OG1 3.34Å; L92-T95 PolarHBondContact O-N 3.08Å; T95-R409 HydrophobicContact CG2-CG 4.24Å; T95-R411 HydrophobicContact CG2-CG 4.07Å |
| 96 | I | 87.6 | Confident | 87.2 | Confident | 3 Ų | 3 | 13.9 Ų | 13.9 | 2% | 0.015 | 8% | 0.076 | C | C | . | . | trans | -123.3 | 90.8 | -179.4 | -54.5 | 168.9 | 0 | 0 | 0 | 106.4 | L92 K98 Y105 E108 L402 | L92-I96 HydrophobicContact CD2-CD1 4.4Å; L92-I96 PolarHBondContact O-N 3.26Å; I96-K98 HydrophobicContact CG2-CB 4.27Å; I96-K98 HydrophobicContact CG2-CD 4.49Å; I96-K98 HydrophobicContact CG2-CG 4.41Å; I96-K98 PolarHBondContact O-N 2.9Å; I96-Y105 HydrophobicContact CB-CD1 3.9Å; I96-Y105 HydrophobicContact CB-CE1 3.99Å; I96-Y105 HydrophobicContact CD1-CD1 3.91Å; I96-Y105 HydrophobicContact CG1-CD1 4.48Å; I96-Y105 HydrophobicContact CG2-CD1 4.07Å; I96-Y105 HydrophobicContact CG2-CE1 4.33Å; I96-E108 HydrophobicContact CD1-CB 3.94Å; I96-E108 HydrophobicContact CD1-CG 3.95Å; I96-E108 HydrophobicContact CG1-CG 4.37Å; I96-L402 HydrophobicContact CD1-CD1 3.94Å | ||
| 97 | T | 79.5 | Confident | 87.2 | Confident | 76 Ų | 76 | 15.6 Ų | 15.6 | 47% | 0.466 | 9% | 0.085 | S | C | . | . | trans | -80 | 4.3 | -175.2 | 50.3 | 0 | 0 | 0 | 0 | 114 | E249 | T97-E249 WeakPolarHBondContact O-CG 3.24Š| ||
| 98 | K | 77.6 | Confident | 87.2 | Confident | 102 Ų | 102 | 16.8 Ų | 16.8 | 44% | 0.443 | 9% | 0.09 | S | C | . | . | trans | -66.7 | 135.8 | 177 | -64 | 177.1 | -178.7 | 167.9 | 0 | 110.8 | I96 A104 E108 E249 | I96-K98 HydrophobicContact CG2-CB 4.27Å; I96-K98 HydrophobicContact CG2-CD 4.49Å; I96-K98 HydrophobicContact CG2-CG 4.41Å; I96-K98 PolarHBondContact O-N 2.9Å; K98-A104 HydrophobicContact CB-CB 4.24Å; K98-E108 IonicContact NZ-OE2 3.58Å; K98-E108 PolarHBondContact NZ-OE2 2.87Å; K98-E249 WeakPolarHBondContact CA-OE1 3.34Å | ||
| 99 | S | 71.1 | Confident | 87.2 | Confident | 29 Ų | 29 | 17.1 Ų | 17.1 | 20% | 0.203 | 9% | 0.092 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.9 | 143.4 | 170.4 | -78.3 | 0 | 0 | 0 | 0 | 113.2 | F246 E249 | S99-F246 PolarHBondContact OG-O 3.43Å; S99-E249 PolarHBondContact N-OE1 3.49Å |
| 100 | G | 73.4 | Confident | 87.3 | Confident | 3 Ų | 3 | 20.5 Ų | 20.5 | 3% | 0.031 | 11% | 0.107 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 122.3 | -3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | S102 Y103 F246 | G100-S102 PolarHBondContact O-N 3.4Å; G100-Y103 WeakPolarHBondContact O-CB 3.42Å; G100-Y103 PolarHBondContact O-N 3.21Å; G100-Y103 VanDerWaalsContact O-N 3.1Å; G100-F246 WeakPolarHBondContact O-CE1 3.42Å |
| 101 | A | 83.3 | Confident | 87.3 | Confident | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 12% | 0.122 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 44.6 | -119.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y103 A104 Y105 N245 F246 | A101-Y103 PolarHBondContact O-N 2.9Å; A101-Y103 VanDerWaalsContact O-N 3.1Å; A101-A104 PolarHBondContact O-N 3.48Å; A101-Y105 HydrophobicContact CB-CE2 4.46Å; A101-Y105 WeakPolarHBondContact O-CD1 3.42Å; A101-Y105 VanDerWaalsContact O-CD2 3.32Å; A101-Y105 WeakPolarHBondContact O-CD2 3.35Å; A101-Y105 PolarHBondContact O-N 2.98Å; A101-N245 HydrophobicContact CB-CB 3.84Å; A101-F246 HydrophobicContact CB-CD1 3.72Å; A101-F246 HydrophobicContact CB-CD2 3.61Å; A101-F246 HydrophobicContact CB-CE1 3.64Å; A101-F246 HydrophobicContact CB-CE2 3.55Å; A101-F246 HydrophobicContact CB-CG 3.72Å; A101-F246 HydrophobicContact CB-CZ 3.58Å |
| 102 | S | 86.9 | Confident | 87.3 | Confident | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -52.9 | -35.9 | -177.2 | -48.5 | 0 | 0 | 0 | 0 | 113.7 | Y89 G100 I106 | Y89-S102 PolarHBondContact OH-OG 3.22Å; G100-S102 PolarHBondContact O-N 3.4Å; S102-I106 WeakPolarHBondContact O-CB 3.32Å; S102-I106 WeakPolarHBondContact O-CD1 3.13Å; S102-I106 VanDerWaalsContact O-CG1 3.23Å; S102-I106 WeakPolarHBondContact O-CG1 3.24Å; S102-I106 PolarHBondContact O-N 3.45Å |
| 103 | Y | 89.8 | Confident | 87.3 | Confident | 3 Ų | 3 | 26 Ų | 26 | 1% | 0.012 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64.2 | -49.2 | 176.9 | 168 | -100.6 | 0 | 0 | 0 | 111.2 | G100 A101 Y105 I106 L107 A115 L119 V336 E340 H342 | G100-Y103 WeakPolarHBondContact O-CB 3.42Å; G100-Y103 PolarHBondContact O-N 3.21Å; G100-Y103 VanDerWaalsContact O-N 3.1Å; A101-Y103 PolarHBondContact O-N 2.9Å; A101-Y103 VanDerWaalsContact O-N 3.1Å; Y103-Y105 VanDerWaalsContact C-N 3.34Å; Y103-Y105 PolarHBondContact O-N 3.3Å; Y103-I106 PolarHBondContact O-N 3.17Å; Y103-L107 HydrophobicContact CE1-CD2 4.26Å; Y103-L107 VanDerWaalsContact O-CB 3.28Å; Y103-L107 WeakPolarHBondContact O-CB 3.46Å; Y103-L107 PolarHBondContact O-N 3.38Å; Y103-A115 HydrophobicContact CD2-CB 4.04Å; Y103-A115 VanDerWaalsContact CD2-O 3.29Å; Y103-A115 WeakPolarHBondContact CD2-O 3.47Å; Y103-A115 HydrophobicContact CE2-CB 3.73Å; Y103-A115 WeakPolarHBondContact CE2-O 3.48Å; Y103-L119 HydrophobicContact CD2-CB 3.88Å; Y103-L119 HydrophobicContact CE2-CB 3.99Å; Y103-L119 HydrophobicContact CE2-CD2 4.02Å; Y103-L119 HydrophobicContact CE2-CG 4.5Å; Y103-V336 HydrophobicContact CD1-CG1 4.16Å; Y103-V336 HydrophobicContact CE1-CG1 4.03Å; Y103-E340 HydrophobicContact CE1-CG 4.15Å; Y103-E340 WeakPolarHBondContact OH-CB 3.47Å; Y103-H342 AromaticContact CE2-ND1 3.75Å; Y103-H342 AromaticContact CZ-ND1 3.7Å; Y103-H342 PolarHBondContact OH-CE1 3.33Å; Y103-H342 PolarHBondContact OH-ND1 3.13Å |
| 104 | A | 88.4 | Confident | 87.6 | Confident | 5 Ų | 5 | 28.7 Ų | 28.7 | 4% | 0.041 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -65.1 | -37.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | K98 A101 L107 E108 | K98-A104 HydrophobicContact CB-CB 4.24Å; A101-A104 PolarHBondContact O-N 3.48Å; A104-L107 PolarHBondContact O-N 3.35Å; A104-E108 WeakPolarHBondContact O-CB 3.3Å; A104-E108 PolarHBondContact O-N 2.96Å |
| 105 | Y | 91.6 | Very high | 87.7 | Confident | 1 Ų | 1 | 28.3 Ų | 28.3 | 0% | 0.004 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -66.9 | -44.6 | 178.5 | -54.7 | -24.9 | 0 | 0 | 0 | 112.1 | Y89 L92 G93 I96 A101 Y103 L107 E108 A109 N245 | Y89-Y105 HydrophobicContact CD1-CD2 4.42Å; Y89-Y105 AromaticContact CD1-CE2 3.76Å; Y89-Y105 HydrophobicContact CD1-CE2 3.76Å; Y89-Y105 HydrophobicContact CE1-CD2 4.17Å; Y89-Y105 AromaticContact CE1-CE2 3.89Å; Y89-Y105 HydrophobicContact CE1-CE2 3.89Å; Y89-Y105 HydrophobicContact CG-CE2 4.48Å; L92-Y105 HydrophobicContact CB-CD1 4.28Å; L92-Y105 HydrophobicContact CB-CD2 3.92Å; L92-Y105 HydrophobicContact CB-CE1 4.15Å; L92-Y105 HydrophobicContact CB-CE2 3.75Å; L92-Y105 HydrophobicContact CB-CG 4.18Å; L92-Y105 HydrophobicContact CD1-CD2 3.81Å; L92-Y105 HydrophobicContact CD1-CE2 4.29Å; L92-Y105 HydrophobicContact CD1-CG 4.26Å; L92-Y105 HydrophobicContact CG-CD2 4.41Å; G93-Y105 WeakPolarHBondContact CA-OH 3.28Å; G93-Y105 PolarHBondContact N-OH 3.21Å; I96-Y105 HydrophobicContact CB-CD1 3.9Å; I96-Y105 HydrophobicContact CB-CE1 3.99Å; I96-Y105 HydrophobicContact CD1-CD1 3.91Å; I96-Y105 HydrophobicContact CG1-CD1 4.48Å; I96-Y105 HydrophobicContact CG2-CD1 4.07Å; I96-Y105 HydrophobicContact CG2-CE1 4.33Å; A101-Y105 HydrophobicContact CB-CE2 4.46Å; A101-Y105 WeakPolarHBondContact O-CD1 3.42Å; A101-Y105 VanDerWaalsContact O-CD2 3.32Å; A101-Y105 WeakPolarHBondContact O-CD2 3.35Å; A101-Y105 PolarHBondContact O-N 2.98Å; Y103-Y105 VanDerWaalsContact C-N 3.34Å; Y103-Y105 PolarHBondContact O-N 3.3Å; Y105-L107 VanDerWaalsContact C-N 3.33Å; Y105-E108 PolarHBondContact O-N 2.87Å; Y105-A109 VanDerWaalsContact O-CB 3.29Å; Y105-A109 WeakPolarHBondContact O-CB 3.32Å; Y105-A109 PolarHBondContact O-N 2.89Å; Y105-N245 WeakPolarHBondContact OH-CB 3.47Å; Y105-N245 PolarHBondContact OH-ND2 2.99Å |
| 106 | I | 93.6 | Very high | 87.9 | Confident | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -67.2 | -37.8 | 177 | -69 | 167.7 | 0 | 0 | 0 | 110.4 | S102 Y103 A109 F110 G111 L114 A115 R118 F391 L394 | S102-I106 WeakPolarHBondContact O-CB 3.32Å; S102-I106 WeakPolarHBondContact O-CD1 3.13Å; S102-I106 VanDerWaalsContact O-CG1 3.23Å; S102-I106 WeakPolarHBondContact O-CG1 3.24Å; S102-I106 PolarHBondContact O-N 3.45Å; Y103-I106 PolarHBondContact O-N 3.17Å; I106-A109 PolarHBondContact O-N 3.35Å; I106-F110 HydrophobicContact CG2-CD2 4.21Å; I106-F110 PolarHBondContact O-N 3.22Å; I106-G111 PolarHBondContact O-N 2.88Å; I106-L114 HydrophobicContact CG2-CB 3.72Å; I106-A115 HydrophobicContact CG2-CB 4.42Å; I106-R118 HydrophobicContact CD1-CB 3.99Å; I106-R118 HydrophobicContact CD1-CG 3.86Å; I106-F391 HydrophobicContact CD1-CD1 4.1Å; I106-L394 HydrophobicContact CD1-CB 4.44Å; I106-L394 HydrophobicContact CD1-CD2 4.1Å; I106-L394 HydrophobicContact CD1-CG 4.34Å; I106-L394 HydrophobicContact CG1-CD2 4.5Å; I106-L394 HydrophobicContact CG1-CG 4.45Å; I106-L394 HydrophobicContact CG2-CD2 4.47Å |
| 107 | L | 92.1 | Very high | 88.2 | Confident | 36 Ų | 36 | 28 Ų | 28 | 19% | 0.188 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -60.1 | -47.1 | 175.9 | -178.2 | 60.7 | 0 | 0 | 0 | 111.9 | Y103 A104 Y105 G111 A115 E340 | Y103-L107 HydrophobicContact CE1-CD2 4.26Å; Y103-L107 VanDerWaalsContact O-CB 3.28Å; Y103-L107 WeakPolarHBondContact O-CB 3.46Å; Y103-L107 PolarHBondContact O-N 3.38Å; A104-L107 PolarHBondContact O-N 3.35Å; Y105-L107 VanDerWaalsContact C-N 3.33Å; L107-G111 WeakPolarHBondContact O-CA 3.21Å; L107-G111 PolarHBondContact O-N 3.17Å; L107-A115 HydrophobicContact CB-CB 3.69Å; L107-A115 HydrophobicContact CD1-CB 3.75Å; L107-A115 HydrophobicContact CG-CB 4.31Å; L107-E340 HydrophobicContact CD2-CG 4.26Å |
| 108 | E | 91.6 | Very high | 88.8 | Confident | 61 Ų | 61 | 24.7 Ų | 24.7 | 29% | 0.285 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -69.8 | -37.7 | 179.9 | -169.5 | 80.8 | -177.6 | 0 | 0 | 112.2 | I96 K98 A104 Y105 R409 | I96-E108 HydrophobicContact CD1-CB 3.94Å; I96-E108 HydrophobicContact CD1-CG 3.95Å; I96-E108 HydrophobicContact CG1-CG 4.37Å; K98-E108 IonicContact NZ-OE2 3.58Å; K98-E108 PolarHBondContact NZ-OE2 2.87Å; A104-E108 WeakPolarHBondContact O-CB 3.3Å; A104-E108 PolarHBondContact O-N 2.96Å; Y105-E108 PolarHBondContact O-N 2.87Å; E108-R409 IonicContact OE1-CZ 3.47Å; E108-R409 IonicContact OE1-NH1 2.68Å; E108-R409 PolarHBondContact OE1-NH1 2.88Å; E108-R409 IonicContact OE1-NH2 3.13Å; E108-R409 PolarHBondContact OE1-NH2 3.47Å; E108-R409 VanDerWaalsContact OE1-NH2 3.13Å |
| 109 | A | 93.1 | Very high | 89.5 | Confident | 6 Ų | 6 | 19.8 Ų | 19.8 | 5% | 0.05 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -80.3 | -45.9 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y105 I106 Y401 L402 | Y105-A109 VanDerWaalsContact O-CB 3.29Å; Y105-A109 WeakPolarHBondContact O-CB 3.32Å; Y105-A109 PolarHBondContact O-N 2.89Å; I106-A109 PolarHBondContact O-N 3.35Å; A109-Y401 HydrophobicContact CB-CD1 4.5Å; A109-Y401 WeakPolarHBondContact O-CD1 3.39Å; A109-Y401 WeakPolarHBondContact O-CE1 3.45Å; A109-L402 HydrophobicContact CB-CD1 4.11Å; A109-L402 HydrophobicContact CB-CD2 4.5Å; A109-L402 HydrophobicContact CB-CG 4.07Å |
| 110 | F | 93.9 | Very high | 90.6 | Very high | 71 Ų | 71 | 21 Ų | 21 | 31% | 0.311 | 11% | 0.112 | S | C | . | . | H | α-helix | trans | -120.1 | -7 | -168.3 | -58.5 | -67.9 | 0 | 0 | 0 | 114.7 | I106 L114 L394 L397 Y401 | I106-F110 HydrophobicContact CG2-CD2 4.21Å; I106-F110 PolarHBondContact O-N 3.22Å; F110-L114 HydrophobicContact CB-CB 4.15Å; F110-L114 HydrophobicContact CB-CD1 3.68Å; F110-L114 HydrophobicContact CB-CG 4.45Å; F110-L114 HydrophobicContact CD1-CD1 4.41Å; F110-L114 HydrophobicContact CD2-CD1 4.38Å; F110-L114 HydrophobicContact CG-CD1 3.93Å; F110-L394 HydrophobicContact CD2-CD1 4.38Å; F110-L394 HydrophobicContact CD2-CG 4.39Å; F110-L394 HydrophobicContact CE2-CD1 3.84Å; F110-L394 HydrophobicContact CE2-CG 4.03Å; F110-L394 WeakPolarHBondContact CE2-O 3.41Å; F110-L394 HydrophobicContact CZ-CD1 4.16Å; F110-L397 HydrophobicContact CZ-CB 4.45Å; F110-Y401 HydrophobicContact CE1-CD1 4.48Å; F110-Y401 HydrophobicContact CE1-CG 4.32Å |
| 111 | G | 91.3 | Very high | 91.5 | Very high | 29 Ų | 29 | 20.8 Ų | 20.8 | 30% | 0.299 | 11% | 0.11 | S | C | . | . | trans | 88.5 | -177.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 115 | I106 L107 F113 A115 | I106-G111 PolarHBondContact O-N 2.88Å; L107-G111 WeakPolarHBondContact O-CA 3.21Å; L107-G111 PolarHBondContact O-N 3.17Å; G111-F113 PolarHBondContact O-N 2.93Å; G111-A115 WeakPolarHBondContact O-CB 3.47Å; G111-A115 PolarHBondContact O-N 3.44Å | ||
| 112 | G | 89.6 | Confident | 91.9 | Very high | 20 Ų | 20 | 20.8 Ų | 20.8 | 21% | 0.206 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -62.6 | -32.6 | -167.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | A115 F116 H342 | G112-A115 PolarHBondContact O-N 2.98Å; G112-F116 WeakPolarHBondContact O-CB 3.48Å; G112-F116 PolarHBondContact O-N 2.98Å; G112-H342 PolarHBondContact O-CE1 3.26Å |
| 113 | F | 92.4 | Very high | 92.1 | Very high | 74 Ų | 74 | 21 Ų | 21 | 33% | 0.325 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -64 | -55.7 | -177.8 | 175.1 | -111 | 0 | 0 | 0 | 112.5 | G111 A115 F116 I117 V453 Y456 F457 | G111-F113 PolarHBondContact O-N 2.93Å; F113-A115 VanDerWaalsContact C-N 3.29Å; F113-A115 PolarHBondContact O-N 3.46Å; F113-F116 PolarHBondContact O-N 2.69Å; F113-I117 HydrophobicContact CE2-CD1 4.32Å; F113-I117 HydrophobicContact CE2-CG1 4.2Å; F113-I117 HydrophobicContact CZ-CD1 4.5Å; F113-I117 HydrophobicContact CZ-CG1 4.2Å; F113-I117 WeakPolarHBondContact O-CG1 3.26Å; F113-I117 PolarHBondContact O-N 3.32Å; F113-V453 HydrophobicContact CE2-CG1 4.24Å; F113-V453 HydrophobicContact CE2-CG2 4.21Å; F113-V453 HydrophobicContact CZ-CG1 4.33Å; F113-V453 HydrophobicContact CZ-CG2 3.93Å; F113-Y456 HydrophobicContact CB-CE1 3.99Å; F113-Y456 AromaticContact CD2-CD1 3.49Å; F113-Y456 HydrophobicContact CD2-CD1 3.49Å; F113-Y456 VanDerWaalsContact CD2-CD1 3.49Å; F113-Y456 AromaticContact CD2-CE1 3.71Å; F113-Y456 HydrophobicContact CD2-CE1 3.71Å; F113-Y456 AromaticContact CD2-CG 3.9Å; F113-Y456 HydrophobicContact CD2-CG 3.9Å; F113-Y456 HydrophobicContact CE2-CD1 4.16Å; F113-Y456 HydrophobicContact CE2-CG 4.48Å; F113-Y456 HydrophobicContact CG-CE1 4.33Å; F113-Y456 PolarHBondContact N-OH 3.17Å; F113-F457 HydrophobicContact CE2-CE2 4.31Å |
| 114 | L | 93.4 | Very high | 92.2 | Very high | 55 Ų | 55 | 22.1 Ų | 22.1 | 29% | 0.288 | 12% | 0.118 | S | C | . | . | H | α-helix | trans | -68.6 | -31.5 | 180 | -77.3 | 177.9 | 0 | 0 | 0 | 111.9 | I106 F110 I117 R118 L394 | I106-L114 HydrophobicContact CG2-CB 3.72Å; F110-L114 HydrophobicContact CB-CB 4.15Å; F110-L114 HydrophobicContact CB-CD1 3.68Å; F110-L114 HydrophobicContact CB-CG 4.45Å; F110-L114 HydrophobicContact CD1-CD1 4.41Å; F110-L114 HydrophobicContact CD2-CD1 4.38Å; F110-L114 HydrophobicContact CG-CD1 3.93Å; L114-I117 PolarHBondContact O-N 3.42Å; L114-R118 WeakPolarHBondContact O-CB 3.49Å; L114-R118 PolarHBondContact O-N 3.36Å; L114-L394 HydrophobicContact CD1-CD2 4.44Å; L114-L394 HydrophobicContact CD2-CD2 4.47Å |
| 115 | A | 92.6 | Very high | 92.4 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -63.1 | -42.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y103 I106 L107 G111 G112 F113 R118 L119 | Y103-A115 HydrophobicContact CD2-CB 4.04Å; Y103-A115 VanDerWaalsContact CD2-O 3.29Å; Y103-A115 WeakPolarHBondContact CD2-O 3.47Å; Y103-A115 HydrophobicContact CE2-CB 3.73Å; Y103-A115 WeakPolarHBondContact CE2-O 3.48Å; I106-A115 HydrophobicContact CG2-CB 4.42Å; L107-A115 HydrophobicContact CB-CB 3.69Å; L107-A115 HydrophobicContact CD1-CB 3.75Å; L107-A115 HydrophobicContact CG-CB 4.31Å; G111-A115 WeakPolarHBondContact O-CB 3.47Å; G111-A115 PolarHBondContact O-N 3.44Å; G112-A115 PolarHBondContact O-N 2.98Å; F113-A115 VanDerWaalsContact C-N 3.29Å; F113-A115 PolarHBondContact O-N 3.46Å; A115-R118 WeakPolarHBondContact O-CB 3.44Å; A115-R118 PolarHBondContact O-N 3.25Å; A115-L119 WeakPolarHBondContact O-CB 3.29Å; A115-L119 PolarHBondContact O-N 3.12Å |
| 116 | F | 93 | Very high | 92.4 | Very high | 4 Ų | 4 | 22.1 Ų | 22.1 | 2% | 0.018 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -62.4 | -45.8 | 174 | 175 | -86.3 | 0 | 0 | 0 | 111.5 | G112 F113 R118 L119 W120 H342 G452 V455 Y456 | G112-F116 WeakPolarHBondContact O-CB 3.48Å; G112-F116 PolarHBondContact O-N 2.98Å; F113-F116 PolarHBondContact O-N 2.69Å; F116-R118 VanDerWaalsContact C-N 3.3Å; F116-R118 PolarHBondContact O-N 3.37Å; F116-L119 WeakPolarHBondContact O-CB 3.48Å; F116-L119 PolarHBondContact O-N 3.05Å; F116-L119 VanDerWaalsContact O-N 3.09Å; F116-W120 HydrophobicContact CD1-CB 4.38Å; F116-W120 HydrophobicContact CE1-CB 3.99Å; F116-W120 HydrophobicContact CE1-CD2 4.28Å; F116-W120 HydrophobicContact CE1-CE3 4.27Å; F116-W120 HydrophobicContact CE1-CG 4.19Å; F116-W120 HydrophobicContact CZ-CB 4.38Å; F116-W120 HydrophobicContact CZ-CD2 4.19Å; F116-W120 AromaticContact CZ-CE3 3.72Å; F116-W120 HydrophobicContact CZ-CE3 3.72Å; F116-W120 HydrophobicContact CZ-CG 4.5Å; F116-W120 HydrophobicContact CZ-CZ3 4.38Å; F116-W120 VanDerWaalsContact O-CB 3.26Å; F116-W120 WeakPolarHBondContact O-CB 3.29Å; F116-W120 PolarHBondContact O-N 3.44Å; F116-H342 HydrophobicContact CD2-CB 3.99Å; F116-H342 WeakPolarHBondContact CD2-O 3.44Å; F116-H342 WeakPolarHBondContact CE2-O 3.44Å; F116-G452 WeakPolarHBondContact CE1-O 3.07Å; F116-V455 HydrophobicContact CZ-CB 4.18Å; F116-V455 HydrophobicContact CZ-CG1 3.85Å; F116-Y456 HydrophobicContact CB-CD2 3.43Å; F116-Y456 VanDerWaalsContact CB-CD2 3.43Å; F116-Y456 HydrophobicContact CB-CE2 3.8Å; F116-Y456 HydrophobicContact CB-CG 4.45Å; F116-Y456 AromaticContact CD1-CD2 3.81Å; F116-Y456 HydrophobicContact CD1-CD2 3.81Å; F116-Y456 HydrophobicContact CD1-CG 4.16Å; F116-Y456 AromaticContact CD2-CD2 3.95Å; F116-Y456 HydrophobicContact CD2-CD2 3.95Å; F116-Y456 AromaticContact CG-CD2 3.44Å; F116-Y456 HydrophobicContact CG-CD2 3.44Å; F116-Y456 VanDerWaalsContact CG-CD2 3.44Å; F116-Y456 HydrophobicContact CG-CE2 4.28Å; F116-Y456 HydrophobicContact CG-CG 4.25Å |
| 117 | I | 94.1 | Very high | 92.2 | Very high | 14 Ų | 14 | 23.4 Ų | 23.4 | 7% | 0.072 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -62.6 | -38.9 | 179.5 | -61.8 | -64.6 | 0 | 0 | 0 | 111.1 | F113 L114 T121 F391 A449 V453 | F113-I117 HydrophobicContact CE2-CD1 4.32Å; F113-I117 HydrophobicContact CE2-CG1 4.2Å; F113-I117 HydrophobicContact CZ-CD1 4.5Å; F113-I117 HydrophobicContact CZ-CG1 4.2Å; F113-I117 WeakPolarHBondContact O-CG1 3.26Å; F113-I117 PolarHBondContact O-N 3.32Å; L114-I117 PolarHBondContact O-N 3.42Å; I117-T121 WeakPolarHBondContact O-CB 3.3Å; I117-T121 PolarHBondContact O-N 3.45Å; I117-T121 PolarHBondContact O-OG1 3.32Å; I117-F391 HydrophobicContact CG2-CE1 4.39Å; I117-F391 HydrophobicContact CG2-CZ 3.99Å; I117-A449 HydrophobicContact CG2-CB 4.43Å; I117-V453 HydrophobicContact CD1-CG2 3.87Å |
| 118 | R | 93 | Very high | 92.3 | Very high | 5 Ų | 5 | 21.7 Ų | 21.7 | 2% | 0.019 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -58.9 | -46.8 | 170.6 | 170 | 66.6 | -175 | 74.2 | -2.9 | 112.1 | I106 L114 A115 F116 S122 F391 | I106-R118 HydrophobicContact CD1-CB 3.99Å; I106-R118 HydrophobicContact CD1-CG 3.86Å; L114-R118 WeakPolarHBondContact O-CB 3.49Å; L114-R118 PolarHBondContact O-N 3.36Å; A115-R118 WeakPolarHBondContact O-CB 3.44Å; A115-R118 PolarHBondContact O-N 3.25Å; F116-R118 VanDerWaalsContact C-N 3.3Å; F116-R118 PolarHBondContact O-N 3.37Å; R118-S122 PolarHBondContact NH1-OG 3.28Å; R118-S122 PolarHBondContact O-N 3.02Å; R118-F391 HydrophobicContact CB-CD1 3.78Å; R118-F391 HydrophobicContact CB-CE1 3.8Å; R118-F391 HydrophobicContact CB-CG 4.43Å; R118-F391 HydrophobicContact CB-CZ 4.49Å; R118-F391 HydrophobicContact CG-CD1 4.17Å; R118-F391 HydrophobicContact CG-CG 4.42Å |
| 119 | L | 92.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -65.7 | -48.1 | -179.3 | -179.6 | 64.1 | 0 | 0 | 0 | 111.2 | Y103 A115 F116 T121 S122 L123 L333 H342 L343 | Y103-L119 HydrophobicContact CD2-CB 3.88Å; Y103-L119 HydrophobicContact CE2-CB 3.99Å; Y103-L119 HydrophobicContact CE2-CD2 4.02Å; Y103-L119 HydrophobicContact CE2-CG 4.5Å; A115-L119 WeakPolarHBondContact O-CB 3.29Å; A115-L119 PolarHBondContact O-N 3.12Å; F116-L119 WeakPolarHBondContact O-CB 3.48Å; F116-L119 PolarHBondContact O-N 3.05Å; F116-L119 VanDerWaalsContact O-N 3.09Å; L119-T121 VanDerWaalsContact C-N 3.3Å; L119-T121 PolarHBondContact O-N 3.34Å; L119-S122 WeakPolarHBondContact O-CB 3.34Å; L119-S122 PolarHBondContact O-N 3.48Å; L119-S122 VanDerWaalsContact O-N 3.11Å; L119-L123 HydrophobicContact CD1-CD1 4.37Å; L119-L123 HydrophobicContact CG-CD1 3.96Å; L119-L123 WeakPolarHBondContact O-CD1 3.35Å; L119-L123 WeakPolarHBondContact O-CG 3.43Å; L119-L123 PolarHBondContact O-N 3.2Å; L119-L333 HydrophobicContact CD1-CD1 3.97Å; L119-L333 HydrophobicContact CD1-CD2 4.33Å; L119-L333 HydrophobicContact CD1-CG 3.8Å; L119-H342 HydrophobicContact CD2-CB 3.94Å; L119-L343 HydrophobicContact CD1-CD1 4.32Å; L119-L343 HydrophobicContact CD2-CD1 3.8Å; L119-L343 HydrophobicContact CD2-CD2 4.26Å; L119-L343 HydrophobicContact CD2-CG 3.73Å; L119-L343 HydrophobicContact CG-CD1 4.19Å; L119-L343 HydrophobicContact CG-CG 4.42Å |
| 120 | W | 93.1 | Very high | 92.4 | Very high | 53 Ų | 53 | 19.3 Ų | 19.3 | 20% | 0.201 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -55.1 | -44.7 | 175.8 | -173.3 | -104.2 | 0 | 0 | 0 | 112 | F116 L123 L124 I448 S451 G452 V455 | F116-W120 HydrophobicContact CD1-CB 4.38Å; F116-W120 HydrophobicContact CE1-CB 3.99Å; F116-W120 HydrophobicContact CE1-CD2 4.28Å; F116-W120 HydrophobicContact CE1-CE3 4.27Å; F116-W120 HydrophobicContact CE1-CG 4.19Å; F116-W120 HydrophobicContact CZ-CB 4.38Å; F116-W120 HydrophobicContact CZ-CD2 4.19Å; F116-W120 AromaticContact CZ-CE3 3.72Å; F116-W120 HydrophobicContact CZ-CE3 3.72Å; F116-W120 HydrophobicContact CZ-CG 4.5Å; F116-W120 HydrophobicContact CZ-CZ3 4.38Å; F116-W120 VanDerWaalsContact O-CB 3.26Å; F116-W120 WeakPolarHBondContact O-CB 3.29Å; F116-W120 PolarHBondContact O-N 3.44Å; W120-L123 WeakPolarHBondContact O-CB 3.49Å; W120-L123 PolarHBondContact O-N 3.47Å; W120-L124 HydrophobicContact CD2-CD1 4.09Å; W120-L124 HydrophobicContact CG-CD1 4.48Å; W120-L124 HydrophobicContact CH2-CD1 4.37Å; W120-L124 HydrophobicContact CZ2-CD1 3.57Å; W120-L124 WeakPolarHBondContact O-CG 3.47Å; W120-L124 PolarHBondContact O-N 3.09Å; W120-I448 PolarHBondContact NE1-O 3.35Å; W120-S451 PolarHBondContact NE1-OG 3.49Å; W120-S451 VanDerWaalsContact NE1-OG 3.11Å; W120-G452 VanDerWaalsContact CD1-CA 3.45Å; W120-V455 HydrophobicContact CH2-CB 4.42Å; W120-V455 HydrophobicContact CH2-CG1 4.09Å; W120-V455 HydrophobicContact CH2-CG2 4Å; W120-V455 HydrophobicContact CZ2-CG2 4.02Å; W120-V455 HydrophobicContact CZ3-CG1 3.98Å |
| 121 | T | 93.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 15.9 Ų | 15.9 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -71.5 | -33.1 | 178.7 | -50 | 0 | 0 | 0 | 0 | 112 | I117 L119 I125 I126 F391 | I117-T121 WeakPolarHBondContact O-CB 3.3Å; I117-T121 PolarHBondContact O-N 3.45Å; I117-T121 PolarHBondContact O-OG1 3.32Å; L119-T121 VanDerWaalsContact C-N 3.3Å; L119-T121 PolarHBondContact O-N 3.34Å; T121-I125 HydrophobicContact CG2-CB 4.24Å; T121-I125 HydrophobicContact CG2-CD1 3.77Å; T121-I125 HydrophobicContact CG2-CG1 4.2Å; T121-I125 WeakPolarHBondContact O-CA 3.41Å; T121-I125 WeakPolarHBondContact O-CB 3.24Å; T121-I125 PolarHBondContact O-N 2.87Å; T121-I126 PolarHBondContact O-N 3.28Å; T121-I126 VanDerWaalsContact O-N 3.15Å; T121-F391 VanDerWaalsContact CB-CE2 3.45Å; T121-F391 HydrophobicContact CG2-CD2 4.37Å; T121-F391 HydrophobicContact CG2-CE2 3.63Å; T121-F391 WeakPolarHBondContact OG1-CE2 3.4Å |
| 122 | S | 91.5 | Very high | 92.6 | Very high | 0 Ų | 0 | 14.5 Ų | 14.5 | 0% | 0 | 7% | 0.074 | C | C | . | . | I | π-helix | trans | -62.8 | -48.3 | 172.3 | -119.5 | 0 | 0 | 0 | 0 | 112 | R118 L119 L124 I126 E127 | R118-S122 PolarHBondContact NH1-OG 3.28Å; R118-S122 PolarHBondContact O-N 3.02Å; L119-S122 WeakPolarHBondContact O-CB 3.34Å; L119-S122 PolarHBondContact O-N 3.48Å; L119-S122 VanDerWaalsContact O-N 3.11Å; S122-L124 PolarHBondContact O-N 3.39Å; S122-I126 PolarHBondContact O-N 3.28Å; S122-E127 WeakPolarHBondContact O-CG 3.27Å; S122-E127 PolarHBondContact O-N 2.92Å; S122-E127 PolarHBondContact OG-OE1 3.11Å |
| 123 | L | 90.3 | Very high | 92.9 | Very high | 4 Ų | 4 | 13.6 Ų | 13.6 | 2% | 0.021 | 6% | 0.064 | C | C | . | . | I | π-helix | trans | -58.7 | -44.8 | -180 | -82 | 155 | 0 | 0 | 0 | 112.6 | L119 W120 P128 F334 L343 F363 | L119-L123 HydrophobicContact CD1-CD1 4.37Å; L119-L123 HydrophobicContact CG-CD1 3.96Å; L119-L123 WeakPolarHBondContact O-CD1 3.35Å; L119-L123 WeakPolarHBondContact O-CG 3.43Å; L119-L123 PolarHBondContact O-N 3.2Å; W120-L123 WeakPolarHBondContact O-CB 3.49Å; W120-L123 PolarHBondContact O-N 3.47Å; L123-P128 WeakPolarHBondContact O-CD 3.26Å; L123-P128 WeakPolarHBondContact O-CG 3.49Å; L123-F334 HydrophobicContact CB-CE1 4.48Å; L123-F334 HydrophobicContact CD2-CD1 3.29Å; L123-F334 HydrophobicContact CD2-CD2 3.83Å; L123-F334 HydrophobicContact CD2-CE1 3.13Å; L123-F334 HydrophobicContact CD2-CE2 3.64Å; L123-F334 HydrophobicContact CD2-CG 3.7Å; L123-F334 HydrophobicContact CD2-CZ 3.34Å; L123-F334 HydrophobicContact CG-CD1 3.93Å; L123-F334 HydrophobicContact CG-CE1 3.67Å; L123-F334 HydrophobicContact CG-CZ 4.22Å; L123-L343 HydrophobicContact CD1-CD1 3.89Å; L123-L343 HydrophobicContact CD1-CD2 3.42Å; L123-L343 VanDerWaalsContact CD1-CD2 3.42Å; L123-L343 HydrophobicContact CD1-CG 4.24Å; L123-F363 HydrophobicContact CD2-CD1 4.23Å; L123-F363 HydrophobicContact CD2-CE1 3.81Å |
| 124 | L | 92.2 | Very high | 92.9 | Very high | 27 Ų | 27 | 10.7 Ų | 10.7 | 14% | 0.141 | 5% | 0.052 | C | C | . | . | I | π-helix | trans | -92.8 | -31.1 | -171.6 | -65 | -173 | 0 | 0 | 0 | 113.6 | W120 S122 F363 M367 Y371 I448 | W120-L124 HydrophobicContact CD2-CD1 4.09Å; W120-L124 HydrophobicContact CG-CD1 4.48Å; W120-L124 HydrophobicContact CH2-CD1 4.37Å; W120-L124 HydrophobicContact CZ2-CD1 3.57Å; W120-L124 WeakPolarHBondContact O-CG 3.47Å; W120-L124 PolarHBondContact O-N 3.09Å; S122-L124 PolarHBondContact O-N 3.39Å; L124-F363 HydrophobicContact CD2-CZ 4.18Å; L124-M367 HydrophobicContact CD2-CE 3.8Å; L124-M367 HydrophobicContact CD2-SD 4.31Å; L124-Y371 WeakPolarHBondContact O-CE2 3.29Å; L124-Y371 PolarHBondContact O-OH 3.34Å; L124-I448 HydrophobicContact CB-CG2 3.91Å; L124-I448 HydrophobicContact CD1-CG2 3.88Å |
| 125 | I | 91.9 | Very high | 93 | Very high | 2 Ų | 2 | 8 Ų | 8 | 1% | 0.01 | 4% | 0.039 | C | C | . | . | I | π-helix | trans | -118.2 | -63.1 | -172.5 | -50.7 | -179.8 | 0 | 0 | 0 | 110.7 | T121 P128 T129 I448 | T121-I125 HydrophobicContact CG2-CB 4.24Å; T121-I125 HydrophobicContact CG2-CD1 3.77Å; T121-I125 HydrophobicContact CG2-CG1 4.2Å; T121-I125 WeakPolarHBondContact O-CA 3.41Å; T121-I125 WeakPolarHBondContact O-CB 3.24Å; T121-I125 PolarHBondContact O-N 2.87Å; I125-P128 WeakPolarHBondContact O-CD 3.49Å; I125-T129 WeakPolarHBondContact O-CB 3.46Å; I125-T129 PolarHBondContact O-N 3.43Å; I125-T129 PolarHBondContact O-OG1 2.93Å; I125-I448 HydrophobicContact CD1-CB 3.71Å; I125-I448 HydrophobicContact CD1-CD1 4.09Å; I125-I448 HydrophobicContact CD1-CG2 3.65Å; I125-I448 HydrophobicContact CG1-CB 4.26Å; I125-I448 HydrophobicContact CG1-CD1 4.2Å; I125-I448 HydrophobicContact CG1-CG2 3.71Å |
| 126 | I | 91.6 | Very high | 93.1 | Very high | 3 Ų | 3 | 8.2 Ų | 8.2 | 2% | 0.015 | 4% | 0.039 | C | C | . | . | I | π-helix | trans | -63.1 | -55.1 | -163 | -56.1 | 175.7 | 0 | 0 | 0 | 111.4 | T121 S122 S130 Y384 Y388 F391 | T121-I126 PolarHBondContact O-N 3.28Å; T121-I126 VanDerWaalsContact O-N 3.15Å; S122-I126 PolarHBondContact O-N 3.28Å; I126-S130 WeakPolarHBondContact O-CB 3.32Å; I126-S130 PolarHBondContact O-N 3.48Å; I126-S130 VanDerWaalsContact O-N 3.14Å; I126-Y384 HydrophobicContact CB-CD2 4.44Å; I126-Y384 HydrophobicContact CG2-CD2 3.75Å; I126-Y384 HydrophobicContact CG2-CE2 3.44Å; I126-Y384 VanDerWaalsContact CG2-CE2 3.44Å; I126-Y384 WeakPolarHBondContact O-CD2 3.28Å; I126-Y388 HydrophobicContact CG2-CD2 4.06Å; I126-F391 HydrophobicContact CD1-CD2 4.46Å |
| 127 | E | 91.4 | Very high | 93.1 | Very high | 27 Ų | 27 | 8 Ų | 8 | 13% | 0.126 | 4% | 0.039 | C | C | . | . | H | α-helix | trans | -67.6 | -50.9 | -176.1 | -51.6 | -60.6 | 155.8 | 0 | 0 | 112.2 | S122 T129 S130 Q131 A330 | S122-E127 WeakPolarHBondContact O-CG 3.27Å; S122-E127 PolarHBondContact O-N 2.92Å; S122-E127 PolarHBondContact OG-OE1 3.11Å; E127-T129 PolarHBondContact O-N 3.41Å; E127-S130 PolarHBondContact O-N 3.43Å; E127-Q131 VanDerWaalsContact O-CG 3.26Å; E127-Q131 WeakPolarHBondContact O-CG 3.37Å; E127-Q131 PolarHBondContact O-N 2.93Å; E127-Q131 VanDerWaalsContact O-N 3.08Å; E127-Q131 PolarHBondContact O-NE2 2.92Å; E127-A330 HydrophobicContact CB-CB 3.94Å; E127-A330 HydrophobicContact CG-CB 3.86Å |
| 128 | P | 93.8 | Very high | 93.1 | Very high | 0 Ų | 0 | 8.7 Ų | 8.7 | 0% | 0 | 4% | 0.041 | C | C | . | . | H | α-helix | trans | -64.8 | -38 | -177.4 | -24.1 | 37.3 | 0 | 0 | 0 | 113.3 | L123 I125 Q131 A132 M367 A368 Y371 | L123-P128 WeakPolarHBondContact O-CD 3.26Å; L123-P128 WeakPolarHBondContact O-CG 3.49Å; I125-P128 WeakPolarHBondContact O-CD 3.49Å; P128-Q131 PolarHBondContact O-N 3.19Å; P128-A132 WeakPolarHBondContact O-CB 3.27Å; P128-A132 PolarHBondContact O-N 2.95Å; P128-M367 HydrophobicContact CB-CB 3.77Å; P128-M367 HydrophobicContact CG-CB 3.55Å; P128-M367 HydrophobicContact CG-CG 4.44Å; P128-A368 HydrophobicContact CB-CB 4.48Å; P128-Y371 HydrophobicContact CB-CD2 3.61Å; P128-Y371 HydrophobicContact CB-CE2 3.91Å |
| 129 | T | 93.7 | Very high | 93.2 | Very high | 0 Ų | 0 | 8.4 Ų | 8.4 | 0% | 0 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -67.7 | -44.2 | -179.8 | -58 | 0 | 0 | 0 | 0 | 110.9 | I125 E127 Q131 A132 V133 Y371 L380 | I125-T129 WeakPolarHBondContact O-CB 3.46Å; I125-T129 PolarHBondContact O-N 3.43Å; I125-T129 PolarHBondContact O-OG1 2.93Å; E127-T129 PolarHBondContact O-N 3.41Å; T129-Q131 PolarHBondContact O-N 2.99Å; T129-A132 PolarHBondContact O-N 2.95Å; T129-V133 WeakPolarHBondContact O-CG2 3.4Å; T129-V133 PolarHBondContact O-N 3.1Å; T129-Y371 WeakPolarHBondContact OG1-CE1 3.4Å; T129-L380 HydrophobicContact CG2-CB 3.67Å; T129-L380 HydrophobicContact CG2-CD2 3.94Å; T129-L380 HydrophobicContact CG2-CG 4.4Å; T129-L380 WeakPolarHBondContact CG2-O 3.27Å |
| 130 | S | 92.6 | Very high | 93.1 | Very high | 17 Ų | 17 | 9.6 Ų | 9.6 | 12% | 0.119 | 5% | 0.046 | C | C | . | . | H | α-helix | trans | -59.7 | -46.5 | 175.8 | -176.5 | 0 | 0 | 0 | 0 | 111.2 | I126 E127 A132 V133 I134 | I126-S130 WeakPolarHBondContact O-CB 3.32Å; I126-S130 PolarHBondContact O-N 3.48Å; I126-S130 VanDerWaalsContact O-N 3.14Å; E127-S130 PolarHBondContact O-N 3.43Å; S130-A132 PolarHBondContact O-N 3.38Å; S130-V133 PolarHBondContact O-N 3.38Å; S130-I134 WeakPolarHBondContact O-CD1 3.31Å; S130-I134 VanDerWaalsContact O-CG1 3.24Å; S130-I134 WeakPolarHBondContact O-CG1 3.14Å; S130-I134 PolarHBondContact O-N 3.46Å |
| 131 | Q | 94.5 | Very high | 93 | Very high | 0 Ų | 0 | 7 Ų | 7 | 0% | 0 | 4% | 0.037 | C | C | . | . | H | α-helix | trans | -62.1 | -41.6 | 177.8 | -69.3 | 166.1 | 31.4 | 0 | 0 | 112.5 | E127 P128 T129 I134 A135 L323 S326 I327 N364 A368 | E127-Q131 VanDerWaalsContact O-CG 3.26Å; E127-Q131 WeakPolarHBondContact O-CG 3.37Å; E127-Q131 PolarHBondContact O-N 2.93Å; E127-Q131 VanDerWaalsContact O-N 3.08Å; E127-Q131 PolarHBondContact O-NE2 2.92Å; P128-Q131 PolarHBondContact O-N 3.19Å; T129-Q131 PolarHBondContact O-N 2.99Å; Q131-I134 PolarHBondContact O-N 2.93Å; Q131-A135 VanDerWaalsContact O-CB 3.32Å; Q131-A135 WeakPolarHBondContact O-CB 3.15Å; Q131-A135 PolarHBondContact O-N 3.16Å; Q131-L323 HydrophobicContact CB-CD1 3.62Å; Q131-L323 HydrophobicContact CG-CD1 3.84Å; Q131-S326 WeakPolarHBondContact CG-OG 3.44Å; Q131-S326 PolarHBondContact NE2-OG 3.26Å; Q131-I327 HydrophobicContact CG-CG1 4.49Å; Q131-N364 VanDerWaalsContact CD-ND2 3.26Å; Q131-N364 PolarHBondContact NE2-ND2 3.31Å; Q131-N364 PolarHBondContact NE2-OD1 3.36Å; Q131-N364 VanDerWaalsContact NE2-OD1 3.14Å; Q131-N364 PolarHBondContact OE1-ND2 2.64Å; Q131-N364 PolarHBondContact OE1-OD1 2.96Å; Q131-A368 HydrophobicContact CB-CB 4.09Å |
| 132 | A | 95.8 | Very high | 92.9 | Very high | 0 Ų | 0 | 9.8 Ų | 9.8 | 0% | 0 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -61.5 | -46.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | P128 T129 S130 I134 A135 I136 L372 L380 | P128-A132 WeakPolarHBondContact O-CB 3.27Å; P128-A132 PolarHBondContact O-N 2.95Å; T129-A132 PolarHBondContact O-N 2.95Å; S130-A132 PolarHBondContact O-N 3.38Å; A132-I134 PolarHBondContact O-N 3.32Å; A132-A135 PolarHBondContact O-N 3.06Å; A132-I136 VanDerWaalsContact O-CD1 3.28Å; A132-I136 WeakPolarHBondContact O-CD1 3.46Å; A132-I136 WeakPolarHBondContact O-CG1 3.3Å; A132-I136 PolarHBondContact O-N 3.24Å; A132-L372 HydrophobicContact CB-CD2 4.07Å; A132-L380 HydrophobicContact CB-CD1 4.17Å |
| 133 | V | 94.6 | Very high | 92.9 | Very high | 0 Ų | 0 | 10.4 Ų | 10.4 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -59.6 | -46.2 | 176.6 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | T129 S130 A135 I136 T137 F236 V377 L380 I381 | T129-V133 WeakPolarHBondContact O-CG2 3.4Å; T129-V133 PolarHBondContact O-N 3.1Å; S130-V133 PolarHBondContact O-N 3.38Å; V133-A135 PolarHBondContact O-N 3.41Å; V133-I136 PolarHBondContact O-N 3.49Å; V133-T137 WeakPolarHBondContact O-CB 3.48Å; V133-T137 PolarHBondContact O-N 3.25Å; V133-T137 PolarHBondContact O-OG1 3.45Å; V133-F236 HydrophobicContact CB-CZ 3.99Å; V133-F236 HydrophobicContact CG1-CE1 3.67Å; V133-F236 HydrophobicContact CG1-CE2 4.43Å; V133-F236 HydrophobicContact CG1-CZ 3.48Å; V133-F236 VanDerWaalsContact CG1-CZ 3.48Å; V133-V377 HydrophobicContact CB-CG1 4.39Å; V133-V377 HydrophobicContact CG1-CG1 3.83Å; V133-V377 HydrophobicContact CG2-CG1 4.13Å; V133-L380 HydrophobicContact CG2-CB 3.5Å; V133-L380 VanDerWaalsContact CG2-CB 3.5Å; V133-L380 HydrophobicContact CG2-CD1 4.12Å; V133-L380 HydrophobicContact CG2-CG 4.46Å; V133-I381 HydrophobicContact CG1-CD1 4.32Å; V133-I381 HydrophobicContact CG1-CG1 4.09Å; V133-I381 HydrophobicContact CG2-CG1 4.06Å |
| 134 | I | 93.5 | Very high | 92.6 | Very high | 13 Ų | 13 | 11.9 Ų | 11.9 | 7% | 0.067 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -61.8 | -43.8 | 177.9 | -60.7 | 159.6 | 0 | 0 | 0 | 110.8 | S52 S130 Q131 A132 T137 F138 C319 L323 | S52-I134 VanDerWaalsContact OG-CG1 3.31Å; S52-I134 WeakPolarHBondContact OG-CG1 3.43Å; S130-I134 WeakPolarHBondContact O-CD1 3.31Å; S130-I134 VanDerWaalsContact O-CG1 3.24Å; S130-I134 WeakPolarHBondContact O-CG1 3.14Å; S130-I134 PolarHBondContact O-N 3.46Å; Q131-I134 PolarHBondContact O-N 2.93Å; A132-I134 PolarHBondContact O-N 3.32Å; I134-T137 WeakPolarHBondContact O-CB 3.4Å; I134-T137 PolarHBondContact O-N 3.39Å; I134-F138 PolarHBondContact O-N 3.02Å; I134-C319 HydrophobicContact CG2-CB 3.98Å; I134-C319 WeakPolarHBondContact CG2-O 3.24Å; I134-L323 HydrophobicContact CG2-CB 3.81Å |
| 135 | A | 95.5 | Very high | 92.2 | Very high | 0 Ų | 0 | 13.5 Ų | 13.5 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -66.7 | -39 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q131 A132 V133 T137 F138 S139 A161 I165 L323 L372 | Q131-A135 VanDerWaalsContact O-CB 3.32Å; Q131-A135 WeakPolarHBondContact O-CB 3.15Å; Q131-A135 PolarHBondContact O-N 3.16Å; A132-A135 PolarHBondContact O-N 3.06Å; V133-A135 PolarHBondContact O-N 3.41Å; A135-T137 VanDerWaalsContact C-N 3.34Å; A135-F138 WeakPolarHBondContact O-CB 3.47Å; A135-F138 PolarHBondContact O-N 3.25Å; A135-S139 PolarHBondContact O-N 3.29Å; A135-S139 VanDerWaalsContact O-N 3.08Å; A135-A161 HydrophobicContact CB-CB 4.04Å; A135-A161 WeakPolarHBondContact O-CB 3.28Å; A135-I165 HydrophobicContact CB-CD1 3.74Å; A135-I165 HydrophobicContact CB-CG1 3.67Å; A135-L323 HydrophobicContact CB-CD2 3.97Å; A135-L372 HydrophobicContact CB-CD2 4.5Å |
| 136 | I | 94.8 | Very high | 91.9 | Very high | 3 Ų | 3 | 19.3 Ų | 19.3 | 2% | 0.015 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -66.4 | -40.9 | 174.7 | -62.3 | 155.4 | 0 | 0 | 0 | 110 | A132 V133 S139 N140 L372 V377 L380 | A132-I136 VanDerWaalsContact O-CD1 3.28Å; A132-I136 WeakPolarHBondContact O-CD1 3.46Å; A132-I136 WeakPolarHBondContact O-CG1 3.3Å; A132-I136 PolarHBondContact O-N 3.24Å; V133-I136 PolarHBondContact O-N 3.49Å; I136-S139 PolarHBondContact O-N 3.13Å; I136-N140 PolarHBondContact O-N 3.24Å; I136-L372 HydrophobicContact CD1-CD2 3.96Å; I136-L372 HydrophobicContact CG1-CD2 3.6Å; I136-V377 HydrophobicContact CB-CG2 4.14Å; I136-V377 HydrophobicContact CD1-CG2 3.98Å; I136-V377 HydrophobicContact CG2-CG2 3.46Å; I136-V377 VanDerWaalsContact CG2-CG2 3.46Å; I136-L380 HydrophobicContact CD1-CD1 3.72Å |
| 137 | T | 92.8 | Very high | 91.6 | Very high | 1 Ų | 1 | 22.1 Ų | 22.1 | 1% | 0.006 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -60.2 | -48.2 | 175.3 | -48.7 | 0 | 0 | 0 | 0 | 110.9 | F55 V56 V133 I134 A135 S139 N140 Y141 | F55-T137 HydrophobicContact CB-CG2 4.46Å; V56-T137 HydrophobicContact CG2-CG2 3.48Å; V56-T137 VanDerWaalsContact CG2-CG2 3.48Å; V56-T137 WeakPolarHBondContact CG2-OG1 3.16Å; V133-T137 WeakPolarHBondContact O-CB 3.48Å; V133-T137 PolarHBondContact O-N 3.25Å; V133-T137 PolarHBondContact O-OG1 3.45Å; I134-T137 WeakPolarHBondContact O-CB 3.4Å; I134-T137 PolarHBondContact O-N 3.39Å; A135-T137 VanDerWaalsContact C-N 3.34Å; T137-S139 PolarHBondContact O-N 3.2Å; T137-N140 PolarHBondContact O-N 3.42Å; T137-Y141 HydrophobicContact CG2-CD2 3.82Å; T137-Y141 HydrophobicContact CG2-CE2 3.89Å; T137-Y141 VanDerWaalsContact O-CD2 3.26Å; T137-Y141 WeakPolarHBondContact O-CD2 3.15Å; T137-Y141 PolarHBondContact O-N 2.85Å; T137-Y141 VanDerWaalsContact O-N 3.1Å |
| 138 | F | 93.6 | Very high | 90.8 | Very high | 27 Ų | 27 | 24.7 Ų | 24.7 | 12% | 0.118 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -50.5 | -49 | 174.6 | 165.4 | -97.6 | 0 | 0 | 0 | 111.3 | I134 A135 Y141 M142 L160 C164 A316 C319 | I134-F138 PolarHBondContact O-N 3.02Å; A135-F138 WeakPolarHBondContact O-CB 3.47Å; A135-F138 PolarHBondContact O-N 3.25Å; F138-Y141 PolarHBondContact O-N 3.27Å; F138-M142 HydrophobicContact CD2-CG 4.34Å; F138-M142 HydrophobicContact CE1-CG 4.28Å; F138-M142 HydrophobicContact CE2-CG 3.94Å; F138-M142 HydrophobicContact CE2-SD 4.34Å; F138-M142 HydrophobicContact CZ-CG 3.9Å; F138-M142 HydrophobicContact CZ-SD 4.43Å; F138-M142 VanDerWaalsContact O-CG 3.29Å; F138-M142 WeakPolarHBondContact O-CG 3.43Å; F138-M142 PolarHBondContact O-N 3.32Å; F138-M142 VanDerWaalsContact O-N 3.11Å; F138-L160 HydrophobicContact CE1-CD1 4.34Å; F138-L160 HydrophobicContact CE1-CG 4.2Å; F138-C164 HydrophobicContact CD1-CB 3.76Å; F138-C164 HydrophobicContact CE1-CB 3.74Å; F138-A316 HydrophobicContact CD2-CB 3.84Å; F138-A316 WeakPolarHBondContact CD2-O 3.49Å; F138-A316 HydrophobicContact CE2-CB 3.89Å; F138-C319 HydrophobicContact CB-CB 3.66Å; F138-C319 HydrophobicContact CD2-CB 4.47Å |
| 139 | S | 94.3 | Very high | 90.1 | Very high | 0 Ų | 0 | 31.4 Ų | 31.4 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -70.5 | -43.2 | -176.1 | -176.2 | 0 | 0 | 0 | 0 | 112.9 | A135 I136 T137 Y141 M142 V143 N157 L160 | A135-S139 PolarHBondContact O-N 3.29Å; A135-S139 VanDerWaalsContact O-N 3.08Å; I136-S139 PolarHBondContact O-N 3.13Å; T137-S139 PolarHBondContact O-N 3.2Å; S139-Y141 VanDerWaalsContact C-N 3.25Å; S139-Y141 PolarHBondContact O-N 2.99Å; S139-M142 PolarHBondContact O-N 2.93Å; S139-M142 VanDerWaalsContact O-N 3.1Å; S139-V143 WeakPolarHBondContact O-CB 3.47Å; S139-V143 VanDerWaalsContact O-CG2 3.29Å; S139-V143 WeakPolarHBondContact O-CG2 3.47Å; S139-V143 PolarHBondContact O-N 2.69Å; S139-N157 VanDerWaalsContact C-OD1 3.28Å; S139-N157 WeakPolarHBondContact CB-O 3.12Å; S139-N157 WeakPolarHBondContact CB-OD1 3.45Å; S139-N157 WeakPolarHBondContact OG-CA 3.49Å; S139-N157 PolarHBondContact OG-O 3.4Å; S139-N157 PolarHBondContact OG-OD1 3.46Å; S139-L160 WeakPolarHBondContact OG-CB 3.3Å; S139-L160 WeakPolarHBondContact OG-CD2 3.45Å |
| 140 | N | 91.3 | Very high | 89.5 | Confident | 24 Ų | 24 | 34.7 Ų | 34.7 | 13% | 0.128 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -53.1 | -46.6 | 174.2 | -76.6 | -1.7 | 0 | 0 | 0 | 111.1 | I136 T137 M142 V143 Q144 N157 | I136-N140 PolarHBondContact O-N 3.24Å; T137-N140 PolarHBondContact O-N 3.42Å; N140-M142 VanDerWaalsContact C-N 3.35Å; N140-M142 PolarHBondContact O-N 3.44Å; N140-V143 PolarHBondContact O-N 2.96Å; N140-Q144 WeakPolarHBondContact O-CB 3.26Å; N140-Q144 PolarHBondContact O-N 3.47Å; N140-N157 PolarHBondContact N-OD1 2.95Å; N140-N157 PolarHBondContact OD1-ND2 2.98Å; N140-N157 PolarHBondContact OD1-OD1 3.45Å |
| 141 | Y | 90.8 | Very high | 88.9 | Confident | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -70.8 | -27.3 | -178.6 | -86.4 | -96.2 | 0 | 0 | 0 | 113.8 | F55 T137 F138 S139 P145 A294 V295 A296 V297 P312 V315 | F55-Y141 HydrophobicContact CB-CE2 3.87Å; F55-Y141 WeakPolarHBondContact CB-OH 3.41Å; F55-Y141 PolarHBondContact O-OH 3.25Å; F55-Y141 VanDerWaalsContact O-OH 3.08Å; T137-Y141 HydrophobicContact CG2-CD2 3.82Å; T137-Y141 HydrophobicContact CG2-CE2 3.89Å; T137-Y141 VanDerWaalsContact O-CD2 3.26Å; T137-Y141 WeakPolarHBondContact O-CD2 3.15Å; T137-Y141 PolarHBondContact O-N 2.85Å; T137-Y141 VanDerWaalsContact O-N 3.1Å; F138-Y141 PolarHBondContact O-N 3.27Å; S139-Y141 VanDerWaalsContact C-N 3.25Å; S139-Y141 PolarHBondContact O-N 2.99Å; Y141-P145 WeakPolarHBondContact O-CD 3.48Å; Y141-A294 HydrophobicContact CD1-CB 4.05Å; Y141-A294 HydrophobicContact CD2-CB 3.89Å; Y141-A294 HydrophobicContact CE1-CB 3.89Å; Y141-A294 HydrophobicContact CE2-CB 3.74Å; Y141-A294 HydrophobicContact CG-CB 4.06Å; Y141-V295 PolarHBondContact OH-N 3.26Å; Y141-A296 HydrophobicContact CE1-CB 3.93Å; Y141-A296 PolarHBondContact OH-N 3.45Å; Y141-V297 HydrophobicContact CD1-CG2 3.54Å; Y141-V297 HydrophobicContact CE1-CG2 3.71Å; Y141-P312 WeakPolarHBondContact O-CB 3.13Å; Y141-V315 HydrophobicContact CD1-CB 3.51Å; Y141-V315 HydrophobicContact CD1-CG1 3.4Å; Y141-V315 VanDerWaalsContact CD1-CG1 3.4Å; Y141-V315 HydrophobicContact CD1-CG2 3.96Å; Y141-V315 HydrophobicContact CD2-CG1 3.88Å; Y141-V315 HydrophobicContact CE1-CB 3.83Å; Y141-V315 HydrophobicContact CE1-CG1 3.58Å; Y141-V315 HydrophobicContact CE1-CG2 3.8Å; Y141-V315 HydrophobicContact CE2-CG1 4.04Å; Y141-V315 HydrophobicContact CG-CB 4.05Å; Y141-V315 HydrophobicContact CG-CG1 3.55Å |
| 142 | M | 90.9 | Very high | 88.4 | Confident | 58 Ų | 58 | 42.6 Ų | 42.6 | 29% | 0.286 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -79.5 | -32.3 | 174.7 | -70.2 | -78.9 | 75.4 | 0 | 0 | 113.1 | F138 S139 N140 L160 A316 | F138-M142 HydrophobicContact CD2-CG 4.34Å; F138-M142 HydrophobicContact CE1-CG 4.28Å; F138-M142 HydrophobicContact CE2-CG 3.94Å; F138-M142 HydrophobicContact CE2-SD 4.34Å; F138-M142 HydrophobicContact CZ-CG 3.9Å; F138-M142 HydrophobicContact CZ-SD 4.43Å; F138-M142 VanDerWaalsContact O-CG 3.29Å; F138-M142 WeakPolarHBondContact O-CG 3.43Å; F138-M142 PolarHBondContact O-N 3.32Å; F138-M142 VanDerWaalsContact O-N 3.11Å; S139-M142 PolarHBondContact O-N 2.93Å; S139-M142 VanDerWaalsContact O-N 3.1Å; N140-M142 VanDerWaalsContact C-N 3.35Å; N140-M142 PolarHBondContact O-N 3.44Å; M142-L160 HydrophobicContact CB-CD2 3.94Å; M142-A316 HydrophobicContact CE-CB 3.43Å; M142-A316 VanDerWaalsContact CE-CB 3.43Å; M142-A316 HydrophobicContact CG-CB 3.73Å; M142-A316 HydrophobicContact SD-CB 3.58Å; M142-A316 VanDerWaalsContact SD-CB 3.58Å |
| 143 | V | 90.5 | Very high | 88.1 | Confident | 12 Ų | 12 | 45.6 Ų | 45.6 | 7% | 0.073 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -87.6 | -32.1 | -176.3 | -178 | 0 | 0 | 0 | 0 | 111.7 | S139 N140 P145 I146 F147 A152 L160 | S139-V143 WeakPolarHBondContact O-CB 3.47Å; S139-V143 VanDerWaalsContact O-CG2 3.29Å; S139-V143 WeakPolarHBondContact O-CG2 3.47Å; S139-V143 PolarHBondContact O-N 2.69Å; N140-V143 PolarHBondContact O-N 2.96Å; V143-P145 VanDerWaalsContact C-CD 3.48Å; V143-I146 WeakPolarHBondContact O-CB 3.35Å; V143-I146 PolarHBondContact O-N 3.09Å; V143-F147 HydrophobicContact CG1-CD2 3.31Å; V143-F147 HydrophobicContact CG1-CE2 3.63Å; V143-F147 HydrophobicContact CG1-CG 4.33Å; V143-F147 PolarHBondContact O-N 3.24Å; V143-F147 VanDerWaalsContact O-N 3.13Å; V143-A152 HydrophobicContact CB-CB 4.43Å; V143-A152 HydrophobicContact CG1-CB 3.49Å; V143-A152 VanDerWaalsContact CG1-CB 3.49Å; V143-L160 HydrophobicContact CG2-CD2 3.82Å |
| 144 | Q | 84.9 | Confident | 87.8 | Confident | 36 Ų | 36 | 50 Ų | 50 | 17% | 0.168 | 28% | 0.277 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -50.7 | -44.9 | -178.5 | -169.3 | 70.9 | 15.2 | 0 | 0 | 114.1 | N140 I146 F147 A294 V297 | N140-Q144 WeakPolarHBondContact O-CB 3.26Å; N140-Q144 PolarHBondContact O-N 3.47Å; Q144-I146 PolarHBondContact O-N 2.9Å; Q144-F147 CarbonylContact O-C 3.32Å; Q144-F147 PolarHBondContact O-N 3.46Å; Q144-A294 HydrophobicContact CB-CB 4.11Å; Q144-A294 HydrophobicContact CG-CB 4.1Å; Q144-V297 HydrophobicContact CB-CG1 4.37Å; Q144-V297 HydrophobicContact CG-CB 4.15Å; Q144-V297 HydrophobicContact CG-CG1 3.85Å |
| 145 | P | 83.7 | Confident | 87.7 | Confident | 61 Ų | 61 | 54.1 Ų | 54.1 | 40% | 0.396 | 30% | 0.302 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.3 | -22.7 | 179.9 | -21.4 | 35.7 | 0 | 0 | 0 | 113.9 | Y141 V143 P312 | Y141-P145 WeakPolarHBondContact O-CD 3.48Å; V143-P145 VanDerWaalsContact C-CD 3.48Å; P145-P312 HydrophobicContact CG-CB 3.64Å; P145-P312 HydrophobicContact CG-CG 3.6Å |
| 146 | I | 86.3 | Confident | 87.4 | Confident | 123 Ų | 123 | 56.3 Ų | 56.3 | 63% | 0.631 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.3 | -30.8 | 178.8 | -55.4 | 172.1 | 0 | 0 | 0 | 110.4 | V143 Q144 P148 | V143-I146 WeakPolarHBondContact O-CB 3.35Å; V143-I146 PolarHBondContact O-N 3.09Å; Q144-I146 PolarHBondContact O-N 2.9Å; I146-P148 VanDerWaalsContact O-CD 3.28Å; I146-P148 WeakPolarHBondContact O-CD 3.44Å |
| 147 | F | 85.2 | Confident | 87.3 | Confident | 63 Ų | 63 | 56.9 Ų | 56.9 | 28% | 0.276 | 32% | 0.323 | S | S | . | . | S | Bend | trans | -119.4 | 61.5 | 180 | -61.3 | -95.6 | 0 | 0 | 0 | 111.1 | V143 Q144 T149 C150 P153 | V143-F147 HydrophobicContact CG1-CD2 3.31Å; V143-F147 HydrophobicContact CG1-CE2 3.63Å; V143-F147 HydrophobicContact CG1-CG 4.33Å; V143-F147 PolarHBondContact O-N 3.24Å; V143-F147 VanDerWaalsContact O-N 3.13Å; Q144-F147 CarbonylContact O-C 3.32Å; Q144-F147 PolarHBondContact O-N 3.46Å; F147-T149 VanDerWaalsContact C-N 3.3Å; F147-T149 PolarHBondContact O-N 2.93Å; F147-C150 VanDerWaalsContact O-O 3.05Å; F147-P153 HydrophobicContact CE1-CG 4.32Å; F147-P153 HydrophobicContact CZ-CG 4.38Å |
| 148 | P | 74.9 | Confident | 87.3 | Confident | 81 Ų | 81 | 57.9 Ų | 57.9 | 53% | 0.526 | 33% | 0.327 | S | S | . | . | S | Bend | trans | -69.8 | -24.6 | -172.3 | 27.9 | -35.8 | 0 | 0 | 0 | 113.9 | I146 | I146-P148 VanDerWaalsContact O-CD 3.28Å; I146-P148 WeakPolarHBondContact O-CD 3.44Å |
| 149 | T | 77.4 | Confident | 87.4 | Confident | 140 Ų | 140 | 62.1 Ų | 62.1 | 86% | 0.859 | 35% | 0.35 | S | S | * | . | S | Bend | trans | -118.1 | 0.1 | -174.3 | 54.3 | 0 | 0 | 0 | 0 | 113.7 | F147 | F147-T149 VanDerWaalsContact C-N 3.3Å; F147-T149 PolarHBondContact O-N 2.93Å |
| 150 | C | 82 | Confident | 87.4 | Confident | 70 Ų | 70 | 65 Ų | 65 | 47% | 0.473 | 37% | 0.365 | S | S | . | . | S | Bend | trans | -139.7 | 157.9 | -175.8 | 54.1 | 0 | 0 | 0 | 0 | 111.3 | F147 A152 | F147-C150 VanDerWaalsContact O-O 3.05Å; C150-A152 PolarHBondContact O-N 3.31Å |
| 151 | I | 79.6 | Confident | 87.7 | Confident | 158 Ų | 158 | 63.9 Ų | 63.9 | 81% | 0.81 | 36% | 0.359 | S | S | * | . | P | Polyproline II helix | trans | -72.2 | 123.2 | -178.4 | -57.4 | 171 | 0 | 0 | 0 | 108.5 | ||
| 152 | A | 83.9 | Confident | 88 | Confident | 24 Ų | 24 | 64.9 Ų | 64.9 | 20% | 0.198 | 37% | 0.368 | C | S | . | . | P | Polyproline II helix | trans | -57.3 | 135 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | V143 C150 Y154 | V143-A152 HydrophobicContact CB-CB 4.43Å; V143-A152 HydrophobicContact CG1-CB 3.49Å; V143-A152 VanDerWaalsContact CG1-CB 3.49Å; C150-A152 PolarHBondContact O-N 3.31Å; A152-Y154 PolarHBondContact O-N 3.21Å; A152-Y154 VanDerWaalsContact O-N 3.14Å |
| 153 | P | 89.5 | Confident | 88.2 | Confident | 63 Ų | 63 | 64.7 Ų | 64.7 | 41% | 0.409 | 38% | 0.375 | S | S | . | . | P | Polyproline II helix | trans | -59.5 | 121.3 | 177.8 | -23 | 32.3 | 0 | 0 | 0 | 111.4 | F147 V155 A156 N157 | F147-P153 HydrophobicContact CE1-CG 4.32Å; F147-P153 HydrophobicContact CZ-CG 4.38Å; P153-V155 VanDerWaalsContact C-N 3.27Å; P153-V155 PolarHBondContact O-N 3.46Å; P153-A156 HydrophobicContact CB-CB 4.1Å; P153-A156 PolarHBondContact O-N 3.36Å; P153-A156 VanDerWaalsContact O-N 3.08Å; P153-N157 PolarHBondContact O-N 3.28Å; P153-N157 VanDerWaalsContact O-N 3.09Å |
| 154 | Y | 89.2 | Confident | 88.5 | Confident | 94 Ų | 94 | 64.4 Ų | 64.4 | 37% | 0.369 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -51.2 | -45.7 | -177.5 | 173.1 | -94.8 | 0 | 0 | 0 | 112.5 | A152 A156 N157 R158 E375 | A152-Y154 PolarHBondContact O-N 3.21Å; A152-Y154 VanDerWaalsContact O-N 3.14Å; Y154-A156 PolarHBondContact O-N 3Å; Y154-N157 WeakPolarHBondContact O-CB 3.35Å; Y154-N157 PolarHBondContact O-N 2.83Å; Y154-R158 HydrophobicContact CD1-CG 4.21Å; Y154-R158 HydrophobicContact CD2-CG 4.31Å; Y154-R158 HydrophobicContact CE1-CG 3.75Å; Y154-R158 HydrophobicContact CE2-CG 3.87Å; Y154-R158 VanDerWaalsContact CE2-NE 3.32Å; Y154-R158 HydrophobicContact CG-CG 4.46Å; Y154-R158 WeakPolarHBondContact O-CG 3.44Å; Y154-R158 PolarHBondContact O-N 3.03Å; Y154-R158 PolarHBondContact OH-NE 2.92Å; Y154-E375 HydrophobicContact CE2-CB 4.33Å; Y154-E375 HydrophobicContact CE2-CG 4.28Å |
| 155 | V | 90.4 | Very high | 89 | Confident | 98 Ų | 98 | 62.8 Ų | 62.8 | 59% | 0.594 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -64.4 | -42.2 | -178.5 | -179.2 | 0 | 0 | 0 | 0 | 111.8 | P153 N157 R158 L159 | P153-V155 VanDerWaalsContact C-N 3.27Å; P153-V155 PolarHBondContact O-N 3.46Å; V155-N157 VanDerWaalsContact C-N 3.33Å; V155-N157 PolarHBondContact O-N 2.91Å; V155-R158 PolarHBondContact O-N 3.13Å; V155-L159 HydrophobicContact CG1-CD1 3.89Å; V155-L159 HydrophobicContact CG1-CG 4.24Å; V155-L159 WeakPolarHBondContact O-CB 3.44Å; V155-L159 VanDerWaalsContact O-CG 3.27Å; V155-L159 WeakPolarHBondContact O-CG 3.24Å; V155-L159 PolarHBondContact O-N 3.3Å |
| 156 | A | 90.1 | Very high | 89.6 | Confident | 47 Ų | 47 | 62.9 Ų | 62.9 | 39% | 0.388 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -63.5 | -42.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | P153 Y154 L159 L160 | P153-A156 HydrophobicContact CB-CB 4.1Å; P153-A156 PolarHBondContact O-N 3.36Å; P153-A156 VanDerWaalsContact O-N 3.08Å; Y154-A156 PolarHBondContact O-N 3Å; A156-L159 PolarHBondContact O-N 3.24Å; A156-L160 WeakPolarHBondContact O-CB 3.45Å; A156-L160 PolarHBondContact O-N 3.43Å |
| 157 | N | 91.1 | Very high | 89.9 | Confident | 15 Ų | 15 | 61.3 Ų | 61.3 | 8% | 0.08 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -61.2 | -45.2 | 175.8 | -173.3 | 30.5 | 0 | 0 | 0 | 111.8 | S139 N140 P153 Y154 V155 L160 A161 | S139-N157 VanDerWaalsContact C-OD1 3.28Å; S139-N157 WeakPolarHBondContact CB-O 3.12Å; S139-N157 WeakPolarHBondContact CB-OD1 3.45Å; S139-N157 WeakPolarHBondContact OG-CA 3.49Å; S139-N157 PolarHBondContact OG-O 3.4Å; S139-N157 PolarHBondContact OG-OD1 3.46Å; N140-N157 PolarHBondContact N-OD1 2.95Å; N140-N157 PolarHBondContact OD1-ND2 2.98Å; N140-N157 PolarHBondContact OD1-OD1 3.45Å; P153-N157 PolarHBondContact O-N 3.28Å; P153-N157 VanDerWaalsContact O-N 3.09Å; Y154-N157 WeakPolarHBondContact O-CB 3.35Å; Y154-N157 PolarHBondContact O-N 2.83Å; V155-N157 VanDerWaalsContact C-N 3.33Å; V155-N157 PolarHBondContact O-N 2.91Å; N157-L160 PolarHBondContact O-N 3.49Å; N157-A161 PolarHBondContact O-N 3.35Å |
| 158 | R | 93.8 | Very high | 90.2 | Very high | 22 Ų | 22 | 58.4 Ų | 58.4 | 8% | 0.083 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -68.4 | -37.6 | 177.9 | -65.9 | -61.2 | 174.6 | 147.4 | -8.9 | 113.4 | Y154 V155 A161 A162 L372 V374 E375 | Y154-R158 HydrophobicContact CD1-CG 4.21Å; Y154-R158 HydrophobicContact CD2-CG 4.31Å; Y154-R158 HydrophobicContact CE1-CG 3.75Å; Y154-R158 HydrophobicContact CE2-CG 3.87Å; Y154-R158 VanDerWaalsContact CE2-NE 3.32Å; Y154-R158 HydrophobicContact CG-CG 4.46Å; Y154-R158 WeakPolarHBondContact O-CG 3.44Å; Y154-R158 PolarHBondContact O-N 3.03Å; Y154-R158 PolarHBondContact OH-NE 2.92Å; V155-R158 PolarHBondContact O-N 3.13Å; R158-A161 PolarHBondContact O-N 2.98Å; R158-A162 WeakPolarHBondContact O-CB 2.86Å; R158-A162 PolarHBondContact O-N 2.81Å; R158-L372 PolarHBondContact NH1-O 2.81Å; R158-V374 PolarHBondContact NH1-O 3.1Å; R158-V374 PolarHBondContact NH2-O 3.39Å; R158-E375 VanDerWaalsContact NH2-C 3.35Å; R158-E375 PolarHBondContact NH2-O 2.8Å |
| 159 | L | 95 | Very high | 91 | Very high | 115 Ų | 115 | 55 Ų | 55 | 60% | 0.602 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -66.3 | -37.8 | 175.7 | -72.7 | 174.7 | 0 | 0 | 0 | 112 | V155 A156 A162 A163 | V155-L159 HydrophobicContact CG1-CD1 3.89Å; V155-L159 HydrophobicContact CG1-CG 4.24Å; V155-L159 WeakPolarHBondContact O-CB 3.44Å; V155-L159 VanDerWaalsContact O-CG 3.27Å; V155-L159 WeakPolarHBondContact O-CG 3.24Å; V155-L159 PolarHBondContact O-N 3.3Å; A156-L159 PolarHBondContact O-N 3.24Å; L159-A162 PolarHBondContact O-N 2.65Å; L159-A163 WeakPolarHBondContact O-CB 3.34Å; L159-A163 PolarHBondContact O-N 3.44Å |
| 160 | L | 95.4 | Very high | 91.7 | Very high | 62 Ų | 62 | 55 Ų | 55 | 33% | 0.325 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -68 | -41.1 | 175.3 | 179.5 | 62.7 | 0 | 0 | 0 | 111.7 | F138 S139 M142 V143 A156 N157 A163 C164 | F138-L160 HydrophobicContact CE1-CD1 4.34Å; F138-L160 HydrophobicContact CE1-CG 4.2Å; S139-L160 WeakPolarHBondContact OG-CB 3.3Å; S139-L160 WeakPolarHBondContact OG-CD2 3.45Å; M142-L160 HydrophobicContact CB-CD2 3.94Å; V143-L160 HydrophobicContact CG2-CD2 3.82Å; A156-L160 WeakPolarHBondContact O-CB 3.45Å; A156-L160 PolarHBondContact O-N 3.43Å; N157-L160 PolarHBondContact O-N 3.49Å; L160-A163 PolarHBondContact O-N 3.26Å; L160-C164 PolarHBondContact O-N 2.87Å |
| 161 | A | 96.2 | Very high | 91.9 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -59.5 | -45.6 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | A135 N157 R158 C164 I165 L372 | A135-A161 HydrophobicContact CB-CB 4.04Å; A135-A161 WeakPolarHBondContact O-CB 3.28Å; N157-A161 PolarHBondContact O-N 3.35Å; R158-A161 PolarHBondContact O-N 2.98Å; A161-C164 WeakPolarHBondContact O-CB 3.33Å; A161-C164 PolarHBondContact O-N 2.96Å; A161-I165 PolarHBondContact O-N 3.15Å; A161-L372 HydrophobicContact CB-CD1 4.17Å; A161-L372 HydrophobicContact CB-CD2 4.03Å |
| 162 | A | 97 | Very high | 92.3 | Very high | 21 Ų | 21 | 46.2 Ų | 46.2 | 17% | 0.174 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.9 | -42.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | R158 L159 C164 I165 C166 L369 L372 | R158-A162 WeakPolarHBondContact O-CB 2.86Å; R158-A162 PolarHBondContact O-N 2.81Å; L159-A162 PolarHBondContact O-N 2.65Å; A162-C164 VanDerWaalsContact C-N 3.29Å; A162-C164 PolarHBondContact O-N 2.92Å; A162-I165 PolarHBondContact O-N 3.23Å; A162-C166 WeakPolarHBondContact O-CB 3.15Å; A162-C166 PolarHBondContact O-N 3.44Å; A162-C166 PolarHBondContact O-SG 2.77Å; A162-C166 VanDerWaalsContact O-SG 3.4Å; A162-L369 HydrophobicContact CB-CD2 3.72Å; A162-L372 HydrophobicContact CB-CD1 3.72Å |
| 163 | A | 96.9 | Very high | 92.4 | Very high | 54 Ų | 54 | 45.7 Ų | 45.7 | 45% | 0.446 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -60.8 | -40 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L159 L160 C166 L167 | L159-A163 WeakPolarHBondContact O-CB 3.34Å; L159-A163 PolarHBondContact O-N 3.44Å; L160-A163 PolarHBondContact O-N 3.26Å; A163-C166 PolarHBondContact O-N 2.95Å; A163-L167 WeakPolarHBondContact O-CB 3.36Å; A163-L167 PolarHBondContact O-N 3.45Å |
| 164 | C | 95.1 | Very high | 92.1 | Very high | 6 Ų | 6 | 44 Ų | 44 | 4% | 0.041 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -63 | -47.2 | 176.1 | -170.4 | 0 | 0 | 0 | 0 | 112 | F138 L160 A161 A162 L167 L168 | F138-C164 HydrophobicContact CD1-CB 3.76Å; F138-C164 HydrophobicContact CE1-CB 3.74Å; L160-C164 PolarHBondContact O-N 2.87Å; A161-C164 WeakPolarHBondContact O-CB 3.33Å; A161-C164 PolarHBondContact O-N 2.96Å; A162-C164 VanDerWaalsContact C-N 3.29Å; A162-C164 PolarHBondContact O-N 2.92Å; C164-L167 PolarHBondContact O-N 2.8Å; C164-L168 WeakPolarHBondContact O-CB 3.47Å; C164-L168 PolarHBondContact O-N 3.38Å |
| 165 | I | 95.8 | Very high | 91.4 | Very high | 1 Ų | 1 | 44.7 Ų | 44.7 | 1% | 0.005 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -59.1 | -53 | 175 | -65.4 | 175.6 | 0 | 0 | 0 | 110.2 | A135 A161 A162 L167 L168 T169 L323 A368 L369 L372 | A135-I165 HydrophobicContact CB-CD1 3.74Å; A135-I165 HydrophobicContact CB-CG1 3.67Å; A161-I165 PolarHBondContact O-N 3.15Å; A162-I165 PolarHBondContact O-N 3.23Å; I165-L167 VanDerWaalsContact C-N 3.31Å; I165-L167 PolarHBondContact O-N 3.07Å; I165-L168 PolarHBondContact O-N 2.85Å; I165-T169 WeakPolarHBondContact O-CB 3.38Å; I165-T169 PolarHBondContact O-N 3.35Å; I165-T169 PolarHBondContact O-OG1 3.46Å; I165-L323 HydrophobicContact CG1-CD2 3.99Å; I165-A368 HydrophobicContact CD1-CB 3.96Å; I165-A368 HydrophobicContact CG2-CB 4.32Å; I165-L369 HydrophobicContact CB-CD2 4.47Å; I165-L369 HydrophobicContact CG2-CD2 4.46Å; I165-L372 HydrophobicContact CD1-CD1 3.83Å; I165-L372 HydrophobicContact CD1-CD2 4.39Å; I165-L372 HydrophobicContact CD1-CG 4.12Å |
| 166 | C | 96 | Very high | 90.2 | Very high | 64 Ų | 64 | 42.4 Ų | 42.4 | 43% | 0.432 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -59.8 | -41 | -178.8 | -72.2 | 0 | 0 | 0 | 0 | 112.5 | A162 A163 F170 | A162-C166 WeakPolarHBondContact O-CB 3.15Å; A162-C166 PolarHBondContact O-N 3.44Å; A162-C166 PolarHBondContact O-SG 2.77Å; A162-C166 VanDerWaalsContact O-SG 3.4Å; A163-C166 PolarHBondContact O-N 2.95Å; C166-F170 VanDerWaalsContact O-CB 3.27Å; C166-F170 WeakPolarHBondContact O-CB 3.29Å; C166-F170 PolarHBondContact O-N 2.96Å |
| 167 | L | 93.4 | Very high | 88.9 | Confident | 90 Ų | 90 | 46.3 Ų | 46.3 | 47% | 0.471 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -62.3 | -49 | 177.1 | 177.5 | 63.4 | 0 | 0 | 0 | 110.9 | A163 C164 I165 F170 V171 F320 | A163-L167 WeakPolarHBondContact O-CB 3.36Å; A163-L167 PolarHBondContact O-N 3.45Å; C164-L167 PolarHBondContact O-N 2.8Å; I165-L167 VanDerWaalsContact C-N 3.31Å; I165-L167 PolarHBondContact O-N 3.07Å; L167-F170 WeakPolarHBondContact O-CB 3.39Å; L167-F170 PolarHBondContact O-N 3.21Å; L167-V171 HydrophobicContact CD1-CG2 4.42Å; L167-V171 VanDerWaalsContact O-CG2 3.3Å; L167-V171 WeakPolarHBondContact O-CG2 3.27Å; L167-V171 PolarHBondContact O-N 3.27Å; L167-F320 HydrophobicContact CD2-CE2 4.27Å |
| 168 | L | 91.3 | Very high | 87.5 | Confident | 2 Ų | 2 | 54 Ų | 54 | 1% | 0.01 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -67.8 | -40 | 179.9 | -77.8 | 175.6 | 0 | 0 | 0 | 112.4 | C164 I165 F170 V171 N172 F320 L323 N324 I327 | C164-L168 WeakPolarHBondContact O-CB 3.47Å; C164-L168 PolarHBondContact O-N 3.38Å; I165-L168 PolarHBondContact O-N 2.85Å; L168-F170 VanDerWaalsContact C-N 3.31Å; L168-F170 PolarHBondContact O-N 3.04Å; L168-V171 PolarHBondContact O-N 2.9Å; L168-N172 WeakPolarHBondContact O-CB 3.1Å; L168-N172 PolarHBondContact O-N 3.41Å; L168-N172 PolarHBondContact O-ND2 3.27Å; L168-F320 HydrophobicContact CD1-CD2 4.1Å; L168-F320 HydrophobicContact CD1-CE2 4.12Å; L168-F320 HydrophobicContact CD1-CG 4.36Å; L168-F320 HydrophobicContact CD1-CZ 4.41Å; L168-F320 HydrophobicContact CD2-CD1 4.1Å; L168-F320 HydrophobicContact CD2-CD2 4.39Å; L168-F320 HydrophobicContact CD2-CE1 3.46Å; L168-F320 VanDerWaalsContact CD2-CE1 3.46Å; L168-F320 HydrophobicContact CD2-CE2 3.78Å; L168-F320 HydrophobicContact CD2-CZ 3.27Å; L168-F320 HydrophobicContact CG-CD2 4.31Å; L168-F320 HydrophobicContact CG-CE1 4.36Å; L168-F320 HydrophobicContact CG-CE2 3.82Å; L168-F320 HydrophobicContact CG-CZ 3.86Å; L168-L323 HydrophobicContact CD1-CB 3.75Å; L168-L323 HydrophobicContact CD1-CD2 3.66Å; L168-L323 HydrophobicContact CD1-CG 3.58Å; L168-N324 HydrophobicContact CD1-CB 4.36Å; L168-N324 HydrophobicContact CD2-CB 3.98Å; L168-I327 HydrophobicContact CB-CD1 3.82Å |
| 169 | T | 91.7 | Very high | 85.7 | Confident | 10 Ų | 10 | 53.2 Ų | 53.2 | 6% | 0.061 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -59.3 | -44.9 | 172.2 | -58.3 | 0 | 0 | 0 | 0 | 110.4 | I165 N172 C173 L361 L362 | I165-T169 WeakPolarHBondContact O-CB 3.38Å; I165-T169 PolarHBondContact O-N 3.35Å; I165-T169 PolarHBondContact O-OG1 3.46Å; T169-N172 PolarHBondContact O-N 2.9Å; T169-C173 WeakPolarHBondContact O-CB 3.26Å; T169-C173 PolarHBondContact O-N 3.33Å; T169-C173 PolarHBondContact O-SG 3.24Å; T169-L361 HydrophobicContact CG2-CB 4.3Å; T169-L361 WeakPolarHBondContact CG2-O 3.44Å; T169-L362 HydrophobicContact CG2-CD2 4.4Å |
| 170 | F | 91.4 | Very high | 83.9 | Confident | 138 Ų | 138 | 50.8 Ų | 50.8 | 61% | 0.605 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -60.8 | -46.6 | 176.5 | 175.1 | -98.3 | 0 | 0 | 0 | 112.5 | C166 L167 L168 N172 C173 A174 | C166-F170 VanDerWaalsContact O-CB 3.27Å; C166-F170 WeakPolarHBondContact O-CB 3.29Å; C166-F170 PolarHBondContact O-N 2.96Å; L167-F170 WeakPolarHBondContact O-CB 3.39Å; L167-F170 PolarHBondContact O-N 3.21Å; L168-F170 VanDerWaalsContact C-N 3.31Å; L168-F170 PolarHBondContact O-N 3.04Å; F170-N172 VanDerWaalsContact C-N 3.34Å; F170-N172 PolarHBondContact O-N 3.23Å; F170-C173 PolarHBondContact O-N 3.25Å; F170-A174 WeakPolarHBondContact O-CB 3.39Å; F170-A174 PolarHBondContact O-N 2.68Å |
| 171 | V | 88.1 | Confident | 82.3 | Confident | 44 Ų | 44 | 56.8 Ų | 56.8 | 27% | 0.267 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -59.9 | -44.4 | 178.1 | 170 | 0 | 0 | 0 | 0 | 111 | L167 L168 A174 Y175 | L167-V171 HydrophobicContact CD1-CG2 4.42Å; L167-V171 VanDerWaalsContact O-CG2 3.3Å; L167-V171 WeakPolarHBondContact O-CG2 3.27Å; L167-V171 PolarHBondContact O-N 3.27Å; L168-V171 PolarHBondContact O-N 2.9Å; V171-A174 PolarHBondContact O-N 2.61Å; V171-A174 VanDerWaalsContact O-N 3.15Å; V171-Y175 PolarHBondContact O-N 3.44Å |
| 172 | N | 86.3 | Confident | 80.7 | Confident | 1 Ų | 1 | 59.8 Ų | 59.8 | 1% | 0.005 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -68.9 | -32.3 | 178.2 | -77 | -71.5 | 0 | 0 | 0 | 113 | L168 T169 F170 A174 N324 I327 V328 L361 | L168-N172 WeakPolarHBondContact O-CB 3.1Å; L168-N172 PolarHBondContact O-N 3.41Å; L168-N172 PolarHBondContact O-ND2 3.27Å; T169-N172 PolarHBondContact O-N 2.9Å; F170-N172 VanDerWaalsContact C-N 3.34Å; F170-N172 PolarHBondContact O-N 3.23Å; N172-A174 VanDerWaalsContact C-N 3.32Å; N172-N324 PolarHBondContact ND2-OD1 3.11Å; N172-N324 PolarHBondContact OD1-OD1 3.37Å; N172-I327 HydrophobicContact CB-CG2 4.45Å; N172-V328 WeakPolarHBondContact OD1-CG2 3.35Å; N172-L361 HydrophobicContact CB-CD1 4.01Å; N172-L361 HydrophobicContact CB-CD2 4.13Å |
| 173 | C | 86 | Confident | 79 | Confident | 12 Ų | 12 | 60.7 Ų | 60.7 | 8% | 0.081 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -67.8 | -34 | 170.7 | -71.3 | 0 | 0 | 0 | 0 | 111.9 | T169 F170 T356 I358 | T169-C173 WeakPolarHBondContact O-CB 3.26Å; T169-C173 PolarHBondContact O-N 3.33Å; T169-C173 PolarHBondContact O-SG 3.24Å; F170-C173 PolarHBondContact O-N 3.25Å; C173-T356 PolarHBondContact O-OG1 3.26Å; C173-I358 HydrophobicContact CB-CG1 4.18Å |
| 174 | A | 83.8 | Confident | 77.4 | Confident | 28 Ų | 28 | 63 Ų | 63 | 23% | 0.231 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -76.4 | -55.2 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | F170 V171 N172 R354 | F170-A174 WeakPolarHBondContact O-CB 3.39Å; F170-A174 PolarHBondContact O-N 2.68Å; V171-A174 PolarHBondContact O-N 2.61Å; V171-A174 VanDerWaalsContact O-N 3.15Å; N172-A174 VanDerWaalsContact C-N 3.32Å; A174-R354 WeakPolarHBondContact O-CD 3.38Å |
| 175 | Y | 75.4 | Confident | 76.2 | Confident | 108 Ų | 108 | 69.4 Ų | 69.4 | 42% | 0.424 | 33% | 0.334 | S | S | . | . | trans | -160.5 | 106.6 | -178.2 | -163.3 | -100.9 | 0 | 0 | 0 | 112.9 | V171 K177 W178 | V171-Y175 PolarHBondContact O-N 3.44Å; Y175-K177 VanDerWaalsContact C-N 3.32Å; Y175-K177 HydrophobicContact CD1-CB 4.03Å; Y175-K177 HydrophobicContact CE1-CB 3.55Å; Y175-K177 HydrophobicContact CE1-CD 4.21Å; Y175-K177 HydrophobicContact CE1-CG 4.05Å; Y175-K177 PolarHBondContact O-N 2.66Å; Y175-W178 AromaticContact CD1-CD1 3.17Å; Y175-W178 HydrophobicContact CD1-CG 4Å; Y175-W178 AromaticContact CD1-NE1 3.63Å; Y175-W178 AromaticContact CE1-CD1 3.57Å; Y175-W178 AromaticContact CE1-NE1 3.85Å; Y175-W178 PolarHBondContact O-N 3.36Å | ||
| 176 | V | 63.6 | Low | 75 | Confident | 50 Ų | 50 | 70.6 Ų | 70.6 | 30% | 0.303 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -61.2 | -31.9 | -173.4 | 167.5 | 0 | 0 | 0 | 0 | 113.8 | W178 G179 T356 | V176-W178 PolarHBondContact O-N 3.38Å; V176-G179 PolarHBondContact O-N 3.42Å; V176-T356 HydrophobicContact CB-CG2 4.34Å; V176-T356 HydrophobicContact CG2-CG2 3.46Å; V176-T356 VanDerWaalsContact CG2-CG2 3.46Å |
| 177 | K | 64.4 | Low | 73.8 | Confident | 130 Ų | 130 | 68.6 Ų | 68.6 | 57% | 0.565 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -72.9 | -12.4 | -176.5 | -52.5 | -177.9 | 178.2 | 176.9 | 0 | 114.2 | Y175 T180 | Y175-K177 VanDerWaalsContact C-N 3.32Å; Y175-K177 HydrophobicContact CD1-CB 4.03Å; Y175-K177 HydrophobicContact CE1-CB 3.55Å; Y175-K177 HydrophobicContact CE1-CD 4.21Å; Y175-K177 HydrophobicContact CE1-CG 4.05Å; Y175-K177 PolarHBondContact O-N 2.66Å; K177-T180 PolarHBondContact O-OG1 2.86Å |
| 178 | W | 61.3 | Low | 72.9 | Confident | 177 Ų | 177 | 71.5 Ų | 71.5 | 67% | 0.67 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -77.6 | -36.8 | 173.3 | -77.1 | 32.7 | 0 | 0 | 0 | 110.9 | Y175 V176 T180 V182 | Y175-W178 AromaticContact CD1-CD1 3.17Å; Y175-W178 HydrophobicContact CD1-CG 4Å; Y175-W178 AromaticContact CD1-NE1 3.63Å; Y175-W178 AromaticContact CE1-CD1 3.57Å; Y175-W178 AromaticContact CE1-NE1 3.85Å; Y175-W178 PolarHBondContact O-N 3.36Å; V176-W178 PolarHBondContact O-N 3.38Å; W178-T180 VanDerWaalsContact C-N 3.34Å; W178-T180 PolarHBondContact O-N 3.31Å; W178-V182 VanDerWaalsContact O-CG2 3.29Å; W178-V182 WeakPolarHBondContact O-CG2 3.36Å; W178-V182 PolarHBondContact O-N 2.9Å |
| 179 | G | 55.2 | Low | 72.1 | Confident | 4 Ų | 4 | 72.7 Ų | 72.7 | 4% | 0.041 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -61.7 | -39.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | V176 Q183 N324 | V176-G179 PolarHBondContact O-N 3.42Å; G179-Q183 WeakPolarHBondContact O-CB 3.13Å; G179-Q183 PolarHBondContact O-N 3.34Å; G179-N324 PolarHBondContact O-ND2 2.57Å |
| 180 | T | 57 | Low | 71.3 | Confident | 65 Ų | 65 | 72.6 Ų | 72.6 | 40% | 0.399 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -71.7 | -41.1 | -177.2 | 53.2 | 0 | 0 | 0 | 0 | 113.6 | K177 W178 V182 Q183 D184 | K177-T180 PolarHBondContact O-OG1 2.86Å; W178-T180 VanDerWaalsContact C-N 3.34Å; W178-T180 PolarHBondContact O-N 3.31Å; T180-V182 PolarHBondContact O-N 3.47Å; T180-Q183 PolarHBondContact O-N 3.4Å; T180-D184 PolarHBondContact O-N 3.49Å |
| 181 | R | 62.2 | Low | 70.8 | Confident | 187 Ų | 187 | 67.8 Ų | 67.8 | 71% | 0.706 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -68.4 | -34.8 | 178.2 | -72.4 | -173.2 | -174.9 | 141.4 | -1.1 | 113.3 | Q183 | R181-Q183 VanDerWaalsContact C-N 3.33Å |
| 182 | V | 62.1 | Low | 70.5 | Confident | 63 Ų | 63 | 71.1 Ų | 71.1 | 38% | 0.382 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -70.3 | -33.7 | 179.1 | 170.3 | 0 | 0 | 0 | 0 | 110.8 | W178 T180 F186 | W178-V182 VanDerWaalsContact O-CG2 3.29Å; W178-V182 WeakPolarHBondContact O-CG2 3.36Å; W178-V182 PolarHBondContact O-N 2.9Å; T180-V182 PolarHBondContact O-N 3.47Å; V182-F186 HydrophobicContact CG1-CD2 3.8Å; V182-F186 HydrophobicContact CG1-CE2 3.12Å; V182-F186 HydrophobicContact CG1-CZ 3.7Å; V182-F186 WeakPolarHBondContact O-CD2 3.34Å; V182-F186 WeakPolarHBondContact O-CG 2.99Å; V182-F186 PolarHBondContact O-N 3.29Å |
| 183 | Q | 61.6 | Low | 70.3 | Confident | 40 Ų | 40 | 71.7 Ų | 71.7 | 19% | 0.187 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -65.3 | -40.6 | 178 | -179 | 178.8 | -19.8 | 0 | 0 | 113.6 | G179 T180 R181 F185 F186 T187 | G179-Q183 WeakPolarHBondContact O-CB 3.13Å; G179-Q183 PolarHBondContact O-N 3.34Å; T180-Q183 PolarHBondContact O-N 3.4Å; R181-Q183 VanDerWaalsContact C-N 3.33Å; Q183-F185 PolarHBondContact O-N 3.19Å; Q183-F186 PolarHBondContact O-N 2.98Å; Q183-T187 PolarHBondContact O-N 2.83Å; Q183-T187 PolarHBondContact O-OG1 3.28Å |
| 184 | D | 64.2 | Low | 70.4 | Confident | 102 Ų | 102 | 71.2 Ų | 71.2 | 55% | 0.545 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -62 | -45.1 | -178.4 | -71.3 | -18.7 | 0 | 0 | 0 | 111.4 | T180 F186 T187 Y188 | T180-D184 PolarHBondContact O-N 3.49Å; D184-F186 PolarHBondContact O-N 2.81Å; D184-T187 WeakPolarHBondContact O-CB 3.47Å; D184-T187 PolarHBondContact O-N 3.29Å; D184-Y188 WeakPolarHBondContact O-CD2 3.43Å; D184-Y188 PolarHBondContact O-N 2.9Å |
| 185 | F | 69.8 | Low | 70.6 | Confident | 141 Ų | 141 | 73.6 Ų | 73.6 | 62% | 0.618 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -59.9 | -44.9 | 177.2 | 176.5 | -102.1 | 0 | 0 | 0 | 112.3 | Q183 T187 Y188 A189 | Q183-F185 PolarHBondContact O-N 3.19Å; F185-T187 PolarHBondContact O-N 3.07Å; F185-Y188 PolarHBondContact O-N 3.47Å; F185-A189 PolarHBondContact O-N 3.48Å |
| 186 | F | 70.6 | Confident | 71.2 | Confident | 26 Ų | 26 | 70 Ų | 70 | 11% | 0.114 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -68.1 | -24.4 | 179.3 | -62.8 | -33.8 | 0 | 0 | 0 | 113.5 | V182 Q183 D184 A189 K190 L317 F320 | V182-F186 HydrophobicContact CG1-CD2 3.8Å; V182-F186 HydrophobicContact CG1-CE2 3.12Å; V182-F186 HydrophobicContact CG1-CZ 3.7Å; V182-F186 WeakPolarHBondContact O-CD2 3.34Å; V182-F186 WeakPolarHBondContact O-CG 2.99Å; V182-F186 PolarHBondContact O-N 3.29Å; Q183-F186 PolarHBondContact O-N 2.98Å; D184-F186 PolarHBondContact O-N 2.81Å; F186-A189 PolarHBondContact O-N 3.25Å; F186-K190 WeakPolarHBondContact O-CG 3.17Å; F186-K190 PolarHBondContact O-N 3.27Å; F186-K190 VanDerWaalsContact O-N 3.12Å; F186-L317 HydrophobicContact CD1-CB 3.76Å; F186-L317 HydrophobicContact CD1-CD1 4.16Å; F186-L317 HydrophobicContact CD1-CD2 4.31Å; F186-L317 HydrophobicContact CD1-CG 4.28Å; F186-L317 HydrophobicContact CE1-CB 3.96Å; F186-L317 HydrophobicContact CE1-CD1 3.87Å; F186-L317 HydrophobicContact CE1-CD2 3.61Å; F186-L317 HydrophobicContact CE1-CG 4Å; F186-L317 HydrophobicContact CE2-CD2 4.44Å; F186-L317 HydrophobicContact CG-CB 4.2Å; F186-L317 HydrophobicContact CZ-CD2 3.69Å; F186-F320 AromaticContact CE2-CD1 3.93Å; F186-F320 HydrophobicContact CE2-CD1 3.93Å |
| 187 | T | 69.8 | Low | 72.5 | Confident | 23 Ų | 23 | 67.8 Ų | 67.8 | 14% | 0.141 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -67.9 | -40.7 | 177.1 | -58.7 | 0 | 0 | 0 | 0 | 112.1 | Q183 D184 F185 K190 V191 | Q183-T187 PolarHBondContact O-N 2.83Å; Q183-T187 PolarHBondContact O-OG1 3.28Å; D184-T187 WeakPolarHBondContact O-CB 3.47Å; D184-T187 PolarHBondContact O-N 3.29Å; F185-T187 PolarHBondContact O-N 3.07Å; T187-K190 VanDerWaalsContact O-CG 3.3Å; T187-K190 WeakPolarHBondContact O-CG 3.32Å; T187-V191 WeakPolarHBondContact O-CG2 3.31Å |
| 188 | Y | 74.3 | Confident | 73.8 | Confident | 150 Ų | 150 | 62.3 Ų | 62.3 | 59% | 0.588 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -69.4 | -42.9 | 174.3 | -64.8 | -72.5 | 0 | 0 | 0 | 111.8 | D184 F185 K190 V191 I192 | D184-Y188 WeakPolarHBondContact O-CD2 3.43Å; D184-Y188 PolarHBondContact O-N 2.9Å; F185-Y188 PolarHBondContact O-N 3.47Å; Y188-K190 VanDerWaalsContact C-N 3.35Å; Y188-K190 PolarHBondContact O-N 3.34Å; Y188-V191 PolarHBondContact O-N 2.96Å; Y188-I192 WeakPolarHBondContact O-CG1 3.31Å; Y188-I192 PolarHBondContact O-N 2.94Å; Y188-I192 VanDerWaalsContact O-N 3.11Å |
| 189 | A | 74.6 | Confident | 75.4 | Confident | 27 Ų | 27 | 58.5 Ų | 58.5 | 22% | 0.223 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -59 | -42.7 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | F185 F186 I192 A193 | F185-A189 PolarHBondContact O-N 3.48Å; F186-A189 PolarHBondContact O-N 3.25Å; A189-I192 PolarHBondContact O-N 2.97Å; A189-A193 PolarHBondContact O-N 2.96Å |
| 190 | K | 76.3 | Confident | 77.1 | Confident | 9 Ų | 9 | 59.5 Ų | 59.5 | 4% | 0.039 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -70.8 | -35 | 179.8 | 70.6 | -175.9 | 176.9 | -171.7 | 0 | 113.7 | G47 I50 F186 T187 Y188 I192 A193 L194 S318 | G47-K190 WeakPolarHBondContact O-CE 3.24Å; G47-K190 PolarHBondContact O-NZ 3.48Å; I50-K190 VanDerWaalsContact O-CD 3.24Å; I50-K190 WeakPolarHBondContact O-CD 3.45Å; I50-K190 WeakPolarHBondContact O-CE 3.35Å; I50-K190 PolarHBondContact O-NZ 3.17Å; F186-K190 WeakPolarHBondContact O-CG 3.17Å; F186-K190 PolarHBondContact O-N 3.27Å; F186-K190 VanDerWaalsContact O-N 3.12Å; T187-K190 VanDerWaalsContact O-CG 3.3Å; T187-K190 WeakPolarHBondContact O-CG 3.32Å; Y188-K190 VanDerWaalsContact C-N 3.35Å; Y188-K190 PolarHBondContact O-N 3.34Å; K190-I192 VanDerWaalsContact C-N 3.32Å; K190-A193 PolarHBondContact O-N 3.37Å; K190-L194 PolarHBondContact O-N 3.25Å; K190-S318 WeakPolarHBondContact CD-OG 3.34Å |
| 191 | V | 79.4 | Confident | 78.7 | Confident | 37 Ų | 37 | 56.4 Ų | 56.4 | 22% | 0.224 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.7 | -41.1 | 176.6 | 173.4 | 0 | 0 | 0 | 0 | 109.6 | T187 Y188 A193 L194 I195 | T187-V191 WeakPolarHBondContact O-CG2 3.31Å; Y188-V191 PolarHBondContact O-N 2.96Å; V191-A193 VanDerWaalsContact C-N 3.35Å; V191-A193 PolarHBondContact O-N 2.89Å; V191-L194 PolarHBondContact O-N 3.31Å; V191-I195 HydrophobicContact CG1-CD1 3.83Å; V191-I195 HydrophobicContact CG1-CG1 4.44Å; V191-I195 VanDerWaalsContact O-CG1 3.26Å; V191-I195 WeakPolarHBondContact O-CG1 3.21Å; V191-I195 PolarHBondContact O-N 3.07Å |
| 192 | I | 82.9 | Confident | 80.2 | Confident | 113 Ų | 113 | 51.9 Ų | 51.9 | 58% | 0.579 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -61 | -43.8 | 174 | -66.2 | 166.4 | 0 | 0 | 0 | 111 | Y188 A189 K190 L194 I195 A196 | Y188-I192 WeakPolarHBondContact O-CG1 3.31Å; Y188-I192 PolarHBondContact O-N 2.94Å; Y188-I192 VanDerWaalsContact O-N 3.11Å; A189-I192 PolarHBondContact O-N 2.97Å; K190-I192 VanDerWaalsContact C-N 3.32Å; I192-L194 PolarHBondContact O-N 3.31Å; I192-I195 PolarHBondContact O-N 3.25Å; I192-A196 PolarHBondContact O-N 3.48Å |
| 193 | A | 82.6 | Confident | 81.7 | Confident | 13 Ų | 13 | 52.6 Ų | 52.6 | 11% | 0.107 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -60.9 | -42.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | A189 K190 V191 A196 V197 A314 | A189-A193 PolarHBondContact O-N 2.96Å; K190-A193 PolarHBondContact O-N 3.37Å; V191-A193 VanDerWaalsContact C-N 3.35Å; V191-A193 PolarHBondContact O-N 2.89Å; A193-A196 WeakPolarHBondContact O-CB 3.5Å; A193-A196 PolarHBondContact O-N 3.26Å; A193-V197 WeakPolarHBondContact O-CG2 3.32Å; A193-V197 PolarHBondContact O-N 3.37Å; A193-V197 VanDerWaalsContact O-N 3.09Å; A193-A314 HydrophobicContact CB-CB 3.74Å |
| 194 | L | 86.8 | Confident | 83.2 | Confident | 2 Ų | 2 | 52.7 Ų | 52.7 | 1% | 0.01 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -67.7 | -40.3 | 175.6 | -73.7 | 173 | 0 | 0 | 0 | 112.5 | I50 I54 F55 K190 V191 I192 A196 V197 I198 I272 T276 | I50-L194 HydrophobicContact CG2-CD1 3.21Å; I54-L194 HydrophobicContact CG2-CD1 4.35Å; I54-L194 HydrophobicContact CG2-CD2 4.26Å; F55-L194 HydrophobicContact CE1-CD2 3.84Å; F55-L194 HydrophobicContact CZ-CD2 3.76Å; F55-L194 HydrophobicContact CZ-CG 4.14Å; K190-L194 PolarHBondContact O-N 3.25Å; V191-L194 PolarHBondContact O-N 3.31Å; I192-L194 PolarHBondContact O-N 3.31Å; L194-A196 VanDerWaalsContact C-N 3.26Å; L194-A196 PolarHBondContact O-N 2.8Å; L194-V197 PolarHBondContact O-N 2.85Å; L194-I198 VanDerWaalsContact O-CG1 3.3Å; L194-I198 WeakPolarHBondContact O-CG1 3.49Å; L194-I198 PolarHBondContact O-N 3.3Å; L194-I272 HydrophobicContact CB-CG2 4.43Å; L194-I272 HydrophobicContact CD1-CG2 4.09Å; L194-T276 HydrophobicContact CD2-CG2 3.95Å |
| 195 | I | 88.7 | Confident | 84.6 | Confident | 79 Ų | 79 | 50.5 Ų | 50.5 | 41% | 0.405 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -59.8 | -41.2 | 174.5 | -70.5 | 167.8 | 0 | 0 | 0 | 110.2 | V191 I192 I198 I199 | V191-I195 HydrophobicContact CG1-CD1 3.83Å; V191-I195 HydrophobicContact CG1-CG1 4.44Å; V191-I195 VanDerWaalsContact O-CG1 3.26Å; V191-I195 WeakPolarHBondContact O-CG1 3.21Å; V191-I195 PolarHBondContact O-N 3.07Å; I192-I195 PolarHBondContact O-N 3.25Å; I195-I198 PolarHBondContact O-N 2.97Å; I195-I199 HydrophobicContact CG2-CD1 3.58Å; I195-I199 HydrophobicContact CG2-CG1 4.18Å; I195-I199 WeakPolarHBondContact O-CB 3.37Å; I195-I199 VanDerWaalsContact O-CG1 3.29Å; I195-I199 WeakPolarHBondContact O-CG1 3.42Å; I195-I199 PolarHBondContact O-N 3.37Å |
| 196 | A | 88 | Confident | 85.6 | Confident | 33 Ų | 33 | 47 Ų | 47 | 27% | 0.273 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -61.4 | -44.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | I192 A193 L194 I198 T200 F304 | I192-A196 PolarHBondContact O-N 3.48Å; A193-A196 WeakPolarHBondContact O-CB 3.5Å; A193-A196 PolarHBondContact O-N 3.26Å; L194-A196 VanDerWaalsContact C-N 3.26Å; L194-A196 PolarHBondContact O-N 2.8Å; A196-I198 PolarHBondContact O-N 3.4Å; A196-T200 VanDerWaalsContact O-CB 3.28Å; A196-T200 WeakPolarHBondContact O-CB 3.26Å; A196-T200 PolarHBondContact O-N 3.48Å; A196-T200 PolarHBondContact O-OG1 3.46Å; A196-F304 HydrophobicContact CB-CZ 4.28Å |
| 197 | V | 89.8 | Confident | 86.6 | Confident | 2 Ų | 2 | 51.2 Ų | 51.2 | 1% | 0.012 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -58.8 | -46.2 | 174.3 | 170.2 | 0 | 0 | 0 | 0 | 111.2 | A193 L194 T200 G201 T276 A279 Y280 F299 I311 | A193-V197 WeakPolarHBondContact O-CG2 3.32Å; A193-V197 PolarHBondContact O-N 3.37Å; A193-V197 VanDerWaalsContact O-N 3.09Å; L194-V197 PolarHBondContact O-N 2.85Å; V197-T200 PolarHBondContact O-N 3.47Å; V197-G201 PolarHBondContact O-N 2.97Å; V197-T276 HydrophobicContact CG1-CG2 4.24Å; V197-A279 HydrophobicContact CG1-CB 3.97Å; V197-A279 WeakPolarHBondContact O-CB 3.5Å; V197-Y280 HydrophobicContact CG1-CD1 4.28Å; V197-Y280 HydrophobicContact CG1-CE1 3.78Å; V197-F299 HydrophobicContact CB-CE1 4.26Å; V197-F299 HydrophobicContact CG1-CD1 4.24Å; V197-F299 HydrophobicContact CG1-CE1 3.88Å; V197-F299 HydrophobicContact CG1-CZ 4.17Å; V197-F299 HydrophobicContact CG2-CD1 4.27Å; V197-F299 HydrophobicContact CG2-CE1 4.16Å; V197-I311 HydrophobicContact CG2-CD1 4.3Å |
| 198 | I | 93.2 | Very high | 87.6 | Confident | 16 Ų | 16 | 52.3 Ų | 52.3 | 8% | 0.082 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -63.1 | -50.5 | -179.9 | -68.5 | 166.6 | 0 | 0 | 0 | 111.2 | L194 I195 A196 T200 G201 L202 I272 L275 | L194-I198 VanDerWaalsContact O-CG1 3.3Å; L194-I198 WeakPolarHBondContact O-CG1 3.49Å; L194-I198 PolarHBondContact O-N 3.3Å; I195-I198 PolarHBondContact O-N 2.97Å; A196-I198 PolarHBondContact O-N 3.4Å; I198-T200 VanDerWaalsContact C-N 3.31Å; I198-T200 PolarHBondContact O-N 3.47Å; I198-G201 PolarHBondContact O-N 3.37Å; I198-L202 HydrophobicContact CG2-CD1 4.08Å; I198-L202 HydrophobicContact CG2-CG 4.43Å; I198-L202 WeakPolarHBondContact O-CG 3.35Å; I198-L202 PolarHBondContact O-N 2.9Å; I198-I272 HydrophobicContact CD1-CG2 4.16Å; I198-L275 HydrophobicContact CD1-CB 3.96Å; I198-L275 HydrophobicContact CG1-CB 3.9Å; I198-L275 HydrophobicContact CG2-CB 3.93Å; I198-L275 HydrophobicContact CG2-CD1 4.05Å |
| 199 | I | 93.4 | Very high | 88.3 | Confident | 96 Ų | 96 | 50.9 Ų | 50.9 | 49% | 0.492 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -58.9 | -46.4 | 179.8 | -69.4 | 170.5 | 0 | 0 | 0 | 110 | I195 G201 L202 V203 | I195-I199 HydrophobicContact CG2-CD1 3.58Å; I195-I199 HydrophobicContact CG2-CG1 4.18Å; I195-I199 WeakPolarHBondContact O-CB 3.37Å; I195-I199 VanDerWaalsContact O-CG1 3.29Å; I195-I199 WeakPolarHBondContact O-CG1 3.42Å; I195-I199 PolarHBondContact O-N 3.37Å; I199-G201 VanDerWaalsContact C-N 3.33Å; I199-G201 PolarHBondContact O-N 2.89Å; I199-L202 PolarHBondContact O-N 2.94Å; I199-V203 HydrophobicContact CG2-CG2 4.43Å; I199-V203 WeakPolarHBondContact O-CG2 2.99Å; I199-V203 PolarHBondContact O-N 3.4Å |
| 200 | T | 91.1 | Very high | 89 | Confident | 25 Ų | 25 | 52.5 Ų | 52.5 | 15% | 0.153 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.9 | -42.1 | 178.1 | -67.7 | 0 | 0 | 0 | 0 | 111.9 | A196 V197 I198 V203 K204 F299 V303 F304 | A196-T200 VanDerWaalsContact O-CB 3.28Å; A196-T200 WeakPolarHBondContact O-CB 3.26Å; A196-T200 PolarHBondContact O-N 3.48Å; A196-T200 PolarHBondContact O-OG1 3.46Å; V197-T200 PolarHBondContact O-N 3.47Å; I198-T200 VanDerWaalsContact C-N 3.31Å; I198-T200 PolarHBondContact O-N 3.47Å; T200-V203 PolarHBondContact O-N 2.93Å; T200-K204 WeakPolarHBondContact O-CG 3.44Å; T200-K204 PolarHBondContact O-N 3.14Å; T200-F299 HydrophobicContact CG2-CE1 4.19Å; T200-F299 HydrophobicContact CG2-CZ 3.94Å; T200-V303 HydrophobicContact CG2-CB 3.92Å; T200-V303 HydrophobicContact CG2-CG1 3.16Å; T200-V303 HydrophobicContact CG2-CG2 4.33Å; T200-F304 HydrophobicContact CG2-CE2 4.5Å; T200-F304 HydrophobicContact CG2-CZ 4.31Å; T200-F304 VanDerWaalsContact OG1-CZ 3.26Å; T200-F304 WeakPolarHBondContact OG1-CZ 3.25Å |
| 201 | G | 92.1 | Very high | 89.5 | Confident | 1 Ų | 1 | 59.2 Ų | 59.2 | 1% | 0.01 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -60.1 | -47.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | V197 I198 I199 V203 K204 I205 | V197-G201 PolarHBondContact O-N 2.97Å; I198-G201 PolarHBondContact O-N 3.37Å; I199-G201 VanDerWaalsContact C-N 3.33Å; I199-G201 PolarHBondContact O-N 2.89Å; G201-V203 VanDerWaalsContact C-N 3.35Å; G201-V203 PolarHBondContact O-N 3.14Å; G201-K204 WeakPolarHBondContact O-CB 3.48Å; G201-K204 PolarHBondContact O-N 3.48Å; G201-K204 VanDerWaalsContact O-N 3.17Å; G201-I205 WeakPolarHBondContact O-CG1 3.36Å; G201-I205 PolarHBondContact O-N 2.91Å |
| 202 | L | 93.4 | Very high | 89.8 | Confident | 92 Ų | 92 | 59.7 Ų | 59.7 | 48% | 0.482 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.5 | -39.6 | 177.8 | -68.3 | 175.6 | 0 | 0 | 0 | 112.5 | I198 I199 I205 G206 | I198-L202 HydrophobicContact CG2-CD1 4.08Å; I198-L202 HydrophobicContact CG2-CG 4.43Å; I198-L202 WeakPolarHBondContact O-CG 3.35Å; I198-L202 PolarHBondContact O-N 2.9Å; I199-L202 PolarHBondContact O-N 2.94Å; L202-I205 PolarHBondContact O-N 3.46Å; L202-G206 PolarHBondContact O-N 3.08Å |
| 203 | V | 93.7 | Very high | 90 | Very high | 77 Ų | 77 | 56.4 Ų | 56.4 | 47% | 0.467 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -63.2 | -42.1 | 174.4 | 170.7 | 0 | 0 | 0 | 0 | 110.9 | I199 T200 G201 G206 Q207 | I199-V203 HydrophobicContact CG2-CG2 4.43Å; I199-V203 WeakPolarHBondContact O-CG2 2.99Å; I199-V203 PolarHBondContact O-N 3.4Å; T200-V203 PolarHBondContact O-N 2.93Å; G201-V203 VanDerWaalsContact C-N 3.35Å; G201-V203 PolarHBondContact O-N 3.14Å; V203-G206 CarbonylContact O-C 3.55Å; V203-G206 PolarHBondContact O-N 3.4Å; V203-G206 VanDerWaalsContact O-N 3.17Å; V203-Q207 WeakPolarHBondContact O-CG 3.33Å; V203-Q207 PolarHBondContact O-N 3.43Å |
| 204 | K | 92.4 | Very high | 90.3 | Very high | 43 Ų | 43 | 61.8 Ų | 61.8 | 19% | 0.187 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -64.1 | -39.7 | 176.7 | -74.9 | -73.5 | -178.6 | -177.8 | 0 | 112.5 | T200 G201 G206 Q207 G208 Y209 T282 V283 | T200-K204 WeakPolarHBondContact O-CG 3.44Å; T200-K204 PolarHBondContact O-N 3.14Å; G201-K204 WeakPolarHBondContact O-CB 3.48Å; G201-K204 PolarHBondContact O-N 3.48Å; G201-K204 VanDerWaalsContact O-N 3.17Å; K204-G206 VanDerWaalsContact C-N 3.34Å; K204-Q207 WeakPolarHBondContact O-CB 3.29Å; K204-Q207 PolarHBondContact O-N 3.39Å; K204-Q207 VanDerWaalsContact O-N 3.17Å; K204-G208 PolarHBondContact O-N 3.02Å; K204-Y209 HydrophobicContact CD-CD2 3.95Å; K204-Y209 HydrophobicContact CD-CE2 4.15Å; K204-Y209 HydrophobicContact CD-CG 4.38Å; K204-Y209 WeakPolarHBondContact O-CB 3.22Å; K204-Y209 WeakPolarHBondContact O-CD2 3.42Å; K204-Y209 PolarHBondContact O-N 2.83Å; K204-Y209 VanDerWaalsContact O-N 3.14Å; K204-T282 HydrophobicContact CB-CG2 3.75Å; K204-V283 HydrophobicContact CB-CG2 4.39Å; K204-V283 HydrophobicContact CG-CG2 4.09Å |
| 205 | I | 92.9 | Very high | 90.2 | Very high | 55 Ų | 55 | 63.6 Ų | 63.6 | 28% | 0.282 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -59.7 | -46.7 | 170.7 | -67 | 173.1 | 0 | 0 | 0 | 110.1 | G201 L202 Q207 G208 T210 V278 T282 | G201-I205 WeakPolarHBondContact O-CG1 3.36Å; G201-I205 PolarHBondContact O-N 2.91Å; L202-I205 PolarHBondContact O-N 3.46Å; I205-Q207 PolarHBondContact O-N 3.37Å; I205-G208 PolarHBondContact O-N 3.09Å; I205-T210 HydrophobicContact CG2-CG2 4.12Å; I205-V278 HydrophobicContact CD1-CG1 3.79Å; I205-T282 HydrophobicContact CG1-CG2 3.57Å; I205-T282 WeakPolarHBondContact CG1-OG1 3.44Å |
| 206 | G | 91.6 | Very high | 90.3 | Very high | 69 Ų | 69 | 62.6 Ų | 62.6 | 71% | 0.711 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -61.8 | -23.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | L202 V203 K204 G208 | L202-G206 PolarHBondContact O-N 3.08Å; V203-G206 CarbonylContact O-C 3.55Å; V203-G206 PolarHBondContact O-N 3.4Å; V203-G206 VanDerWaalsContact O-N 3.17Å; K204-G206 VanDerWaalsContact C-N 3.34Å; G206-G208 VanDerWaalsContact C-N 3.31Å |
| 207 | Q | 91.9 | Very high | 90.6 | Very high | 114 Ų | 114 | 66.4 Ų | 66.4 | 53% | 0.533 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.1 | -2.9 | 173.1 | -71.1 | 173.6 | -2.8 | 0 | 0 | 113.5 | V203 K204 I205 Y209 | V203-Q207 WeakPolarHBondContact O-CG 3.33Å; V203-Q207 PolarHBondContact O-N 3.43Å; K204-Q207 WeakPolarHBondContact O-CB 3.29Å; K204-Q207 PolarHBondContact O-N 3.39Å; K204-Q207 VanDerWaalsContact O-N 3.17Å; I205-Q207 PolarHBondContact O-N 3.37Å; Q207-Y209 HydrophobicContact CB-CD2 3.85Å; Q207-Y209 HydrophobicContact CB-CE2 4Å |
| 208 | G | 89.8 | Confident | 90.6 | Very high | 45 Ų | 45 | 72.2 Ų | 72.2 | 46% | 0.464 | 40% | 0.4 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 92.3 | 12.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | K204 I205 G206 T210 | K204-G208 PolarHBondContact O-N 3.02Å; I205-G208 PolarHBondContact O-N 3.09Å; G206-G208 VanDerWaalsContact C-N 3.31Å; G208-T210 PolarHBondContact O-N 3.14Å |
| 209 | Y | 89.4 | Confident | 90.4 | Very high | 121 Ų | 121 | 74.6 Ų | 74.6 | 48% | 0.475 | 43% | 0.428 | S | S | . | . | trans | -77.7 | 65 | 175.1 | -70.7 | -96.7 | 0 | 0 | 0 | 111.4 | K204 Q207 T282 | K204-Y209 HydrophobicContact CD-CD2 3.95Å; K204-Y209 HydrophobicContact CD-CE2 4.15Å; K204-Y209 HydrophobicContact CD-CG 4.38Å; K204-Y209 WeakPolarHBondContact O-CB 3.22Å; K204-Y209 WeakPolarHBondContact O-CD2 3.42Å; K204-Y209 PolarHBondContact O-N 2.83Å; K204-Y209 VanDerWaalsContact O-N 3.14Å; Q207-Y209 HydrophobicContact CB-CD2 3.85Å; Q207-Y209 HydrophobicContact CB-CE2 4Å; Y209-T282 VanDerWaalsContact O-CG2 3.26Å; Y209-T282 WeakPolarHBondContact O-CG2 3.19Å | ||
| 210 | T | 88.8 | Confident | 90.3 | Very high | 61 Ų | 61 | 71 Ų | 71 | 37% | 0.374 | 41% | 0.411 | S | S | . | . | trans | -110.9 | 1.9 | -178 | 57.4 | 0 | 0 | 0 | 0 | 114.2 | I205 G208 N212 F213 | I205-T210 HydrophobicContact CG2-CG2 4.12Å; G208-T210 PolarHBondContact O-N 3.14Å; T210-N212 PolarHBondContact O-N 2.96Å; T210-N212 VanDerWaalsContact O-N 3.17Å; T210-F213 WeakPolarHBondContact O-CB 3.25Å; T210-F213 PolarHBondContact O-N 2.67Å | ||
| 211 | Q | 88.1 | Confident | 90.4 | Very high | 150 Ų | 150 | 70.5 Ų | 70.5 | 70% | 0.701 | 41% | 0.409 | S | S | * | . | G | 310 helix | trans | -57 | -34.6 | -174.9 | -64.8 | 166 | 5.1 | 0 | 0 | 112.9 | F213 D214 | Q211-F213 PolarHBondContact O-N 2.83Å; Q211-D214 WeakPolarHBondContact O-CB 3.29Å; Q211-D214 PolarHBondContact O-N 2.92Å; Q211-D214 VanDerWaalsContact O-N 3.13Å |
| 212 | N | 85.9 | Confident | 90.3 | Very high | 47 Ų | 47 | 78.1 Ų | 78.1 | 25% | 0.251 | 44% | 0.444 | S | S | . | . | G | 310 helix | trans | -66.1 | -16.9 | 176.9 | -71 | -15 | 0 | 0 | 0 | 113.3 | Y68 T210 Y281 L284 | Y68-N212 WeakPolarHBondContact CD2-O 3.41Å; Y68-N212 HydrophobicContact CE2-CB 3.92Å; Y68-N212 VanDerWaalsContact CE2-O 3.24Å; Y68-N212 WeakPolarHBondContact CE2-O 3.49Å; T210-N212 PolarHBondContact O-N 2.96Å; T210-N212 VanDerWaalsContact O-N 3.17Å; N212-Y281 WeakPolarHBondContact CB-O 3.31Å; N212-Y281 PolarHBondContact ND2-O 3.35Å; N212-L284 PolarHBondContact ND2-O 2.76Å |
| 213 | F | 87.4 | Confident | 90.2 | Very high | 44 Ų | 44 | 77 Ų | 77 | 19% | 0.193 | 44% | 0.438 | C | S | . | . | G | 310 helix | trans | -92.9 | -7.1 | 176.6 | -60.6 | -71.8 | 0 | 0 | 0 | 113.1 | T210 Q211 G215 M216 V278 T282 | T210-F213 WeakPolarHBondContact O-CB 3.25Å; T210-F213 PolarHBondContact O-N 2.67Å; Q211-F213 PolarHBondContact O-N 2.83Å; F213-G215 PolarHBondContact O-N 2.6Å; F213-M216 WeakPolarHBondContact O-CB 3.22Å; F213-M216 PolarHBondContact O-N 3.13Å; F213-V278 HydrophobicContact CZ-CG1 4.12Å; F213-T282 WeakPolarHBondContact CE2-OG1 3.36Å |
| 214 | D | 87.6 | Confident | 90 | Very high | 125 Ų | 125 | 76.2 Ų | 76.2 | 67% | 0.668 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.2 | 123.7 | 171.9 | -63.8 | -30.2 | 0 | 0 | 0 | 108.5 | Q211 M216 | Q211-D214 WeakPolarHBondContact O-CB 3.29Å; Q211-D214 PolarHBondContact O-N 2.92Å; Q211-D214 VanDerWaalsContact O-N 3.13Å; D214-M216 PolarHBondContact O-N 3.47Å |
| 215 | G | 86.1 | Confident | 89.9 | Confident | 41 Ų | 41 | 74.1 Ų | 74.1 | 42% | 0.423 | 43% | 0.426 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 66.8 | 33 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | F213 F217 D218 | F213-G215 PolarHBondContact O-N 2.6Å; G215-F217 PolarHBondContact O-N 3.21Å; G215-D218 WeakPolarHBondContact CA-OD2 3.14Å; G215-D218 VanDerWaalsContact O-CB 3.27Å; G215-D218 WeakPolarHBondContact O-CB 3.36Å; G215-D218 VanDerWaalsContact O-CG 3.29Å; G215-D218 PolarHBondContact O-N 3.31Å |
| 216 | M | 90.6 | Very high | 89.8 | Confident | 58 Ų | 58 | 75.5 Ų | 75.5 | 29% | 0.286 | 43% | 0.431 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.4 | -18.4 | -173.8 | 67 | -174.2 | -71.8 | 0 | 0 | 116 | S67 Y68 G69 L72 F213 D214 | S67-M216 WeakPolarHBondContact CB-O 3.34Å; Y68-M216 PolarHBondContact N-O 3.34Å; G69-M216 VanDerWaalsContact CA-CE 3.44Å; G69-M216 WeakPolarHBondContact CA-O 3.46Å; G69-M216 PolarHBondContact N-O 2.84Å; L72-M216 HydrophobicContact CD1-CE 4.28Å; F213-M216 WeakPolarHBondContact O-CB 3.22Å; F213-M216 PolarHBondContact O-N 3.13Å; D214-M216 PolarHBondContact O-N 3.47Å |
| 217 | F | 93.4 | Very high | 89.9 | Confident | 113 Ų | 113 | 74.5 Ų | 74.5 | 50% | 0.496 | 41% | 0.409 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.9 | -0.3 | 177.4 | -67.6 | -79.4 | 0 | 0 | 0 | 113.8 | G69 V73 G215 G219 S220 | G69-F217 VanDerWaalsContact C-CE1 3.4Å; V73-F217 HydrophobicContact CG2-CE1 4.33Å; G215-F217 PolarHBondContact O-N 3.21Å; F217-G219 PolarHBondContact O-N 3.23Å; F217-S220 WeakPolarHBondContact O-CB 3.17Å; F217-S220 PolarHBondContact O-N 3.19Å; F217-S220 PolarHBondContact O-OG 3.19Å |
| 218 | D | 90.2 | Very high | 89.8 | Confident | 124 Ų | 124 | 69.1 Ų | 69.1 | 66% | 0.663 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.3 | 135.8 | -179.1 | -66.3 | -12.9 | 0 | 0 | 0 | 110.1 | S67 G215 S220 | S67-D218 WeakPolarHBondContact CB-O 3.45Å; G215-D218 WeakPolarHBondContact CA-OD2 3.14Å; G215-D218 VanDerWaalsContact O-CB 3.27Å; G215-D218 WeakPolarHBondContact O-CB 3.36Å; G215-D218 VanDerWaalsContact O-CG 3.29Å; G215-D218 PolarHBondContact O-N 3.31Å; D218-S220 PolarHBondContact O-N 3.05Å |
| 219 | G | 87.7 | Confident | 89.9 | Confident | 65 Ų | 65 | 67.6 Ų | 67.6 | 67% | 0.67 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 73.2 | 8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | A66 F217 S221 | A66-G219 VanDerWaalsContact CB-O 3.31Å; A66-G219 WeakPolarHBondContact CB-O 3.24Å; F217-G219 PolarHBondContact O-N 3.23Å; G219-S221 PolarHBondContact O-N 3.37Å |
| 220 | S | 93.3 | Very high | 90.2 | Very high | 20 Ų | 20 | 61.9 Ų | 61.9 | 14% | 0.14 | 34% | 0.343 | C | S | . | . | trans | -54.1 | 127.4 | 179.4 | -64.9 | 0 | 0 | 0 | 0 | 112.5 | S67 F217 D218 Q222 | S67-S220 WeakPolarHBondContact CB-OG 3.31Å; S67-S220 PolarHBondContact OG-OG 3.01Å; F217-S220 WeakPolarHBondContact O-CB 3.17Å; F217-S220 PolarHBondContact O-N 3.19Å; F217-S220 PolarHBondContact O-OG 3.19Å; D218-S220 PolarHBondContact O-N 3.05Å; S220-Q222 PolarHBondContact O-N 3.38Å; S220-Q222 PolarHBondContact O-NE2 2.8Å; S220-Q222 VanDerWaalsContact O-NE2 3.09Å | ||
| 221 | S | 91.5 | Very high | 90.4 | Very high | 16 Ų | 16 | 59.8 Ų | 59.8 | 11% | 0.112 | 33% | 0.329 | C | S | . | . | trans | -60.1 | 132.5 | 175.5 | -173.6 | 0 | 0 | 0 | 0 | 111.2 | H64 S65 L70 G219 D223 H226 | H64-S221 WeakPolarHBondContact O-CB 3.33Å; S65-S221 PolarHBondContact O-N 3.16Å; L70-S221 WeakPolarHBondContact CD2-O 3.23Å; G219-S221 PolarHBondContact O-N 3.37Å; S221-D223 PolarHBondContact OG-N 2.93Å; S221-H226 WeakPolarHBondContact OG-CB 3.35Å; S221-H226 PolarHBondContact OG-ND1 3.1Å | ||
| 222 | Q | 91.3 | Very high | 90.7 | Very high | 160 Ų | 160 | 52.8 Ų | 52.8 | 75% | 0.748 | 30% | 0.296 | S | S | * | . | trans | -103 | -4.5 | 174.9 | -57.1 | -57.3 | -50.2 | 0 | 0 | 112.3 | S220 P224 | S220-Q222 PolarHBondContact O-N 3.38Å; S220-Q222 PolarHBondContact O-NE2 2.8Å; S220-Q222 VanDerWaalsContact O-NE2 3.09Å; Q222-P224 WeakPolarHBondContact O-CD 3.36Å | ||
| 223 | D | 91.3 | Very high | 91.1 | Very high | 68 Ų | 68 | 50.5 Ų | 50.5 | 36% | 0.364 | 28% | 0.284 | S | S | . | . | trans | -75.8 | 121.4 | -179.4 | 176.4 | 49.3 | 0 | 0 | 0 | 110.7 | S221 G225 H226 I227 | S221-D223 PolarHBondContact OG-N 2.93Å; D223-G225 PolarHBondContact O-N 3.31Å; D223-G225 VanDerWaalsContact OD2-CA 3.31Å; D223-G225 WeakPolarHBondContact OD2-CA 3.41Å; D223-G225 PolarHBondContact OD2-N 2.76Å; D223-H226 HydrophobicContact CB-CB 4.24Å; D223-H226 PolarHBondContact O-N 2.6Å; D223-H226 IonicContact OD2-CD2 2.84Å; D223-H226 PolarHBondContact OD2-CD2 2.93Å; D223-H226 IonicContact OD2-CG 2.88Å; D223-H226 PolarHBondContact OD2-N 3.16Å; D223-I227 WeakPolarHBondContact O-CG1 3.44Å; D223-I227 PolarHBondContact O-N 3.36Å; D223-I227 VanDerWaalsContact O-N 3.12Å | ||
| 224 | P | 89 | Confident | 91.4 | Very high | 61 Ų | 61 | 48.4 Ų | 48.4 | 40% | 0.396 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -58.3 | -30.8 | 177.3 | -24.9 | 35.1 | 0 | 0 | 0 | 113.2 | Q222 I227 A228 | Q222-P224 WeakPolarHBondContact O-CD 3.36Å; P224-I227 PolarHBondContact O-N 3.37Å; P224-A228 PolarHBondContact O-N 3.5Å |
| 225 | G | 89.2 | Confident | 91.7 | Very high | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.3 | -52.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | D223 I227 A228 L229 S437 | D223-G225 PolarHBondContact O-N 3.31Å; D223-G225 VanDerWaalsContact OD2-CA 3.31Å; D223-G225 WeakPolarHBondContact OD2-CA 3.41Å; D223-G225 PolarHBondContact OD2-N 2.76Å; G225-I227 VanDerWaalsContact C-N 3.31Å; G225-I227 PolarHBondContact O-N 2.96Å; G225-A228 PolarHBondContact O-N 3.05Å; G225-L229 WeakPolarHBondContact O-CG 3.38Å; G225-L229 PolarHBondContact O-N 3.28Å; G225-S437 WeakPolarHBondContact CA-OG 3.42Å |
| 226 | H | 92.1 | Very high | 92.1 | Very high | 84 Ų | 84 | 40.9 Ų | 40.9 | 39% | 0.389 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -57.6 | -43 | 173.3 | -71.7 | -170.7 | 0 | 0 | 0 | 112.1 | H64 S221 D223 A228 L229 A230 | H64-H226 HydrophobicContact CB-CB 4.27Å; H64-H226 VanDerWaalsContact CB-O 3.31Å; H64-H226 WeakPolarHBondContact CB-O 3.39Å; S221-H226 WeakPolarHBondContact OG-CB 3.35Å; S221-H226 PolarHBondContact OG-ND1 3.1Å; D223-H226 HydrophobicContact CB-CB 4.24Å; D223-H226 PolarHBondContact O-N 2.6Å; D223-H226 IonicContact OD2-CD2 2.84Å; D223-H226 PolarHBondContact OD2-CD2 2.93Å; D223-H226 IonicContact OD2-CG 2.88Å; D223-H226 PolarHBondContact OD2-N 3.16Å; H226-A228 VanDerWaalsContact C-N 3.31Å; H226-A228 PolarHBondContact O-N 3.28Å; H226-L229 PolarHBondContact O-N 3.08Å; H226-A230 WeakPolarHBondContact O-CB 3.41Å; H226-A230 PolarHBondContact O-N 3.27Å |
| 227 | I | 92.9 | Very high | 92.2 | Very high | 48 Ų | 48 | 38.2 Ų | 38.2 | 25% | 0.246 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -61.8 | -39.9 | 178.3 | -64.7 | 168.3 | 0 | 0 | 0 | 111.2 | D223 P224 G225 A230 L231 | D223-I227 WeakPolarHBondContact O-CG1 3.44Å; D223-I227 PolarHBondContact O-N 3.36Å; D223-I227 VanDerWaalsContact O-N 3.12Å; P224-I227 PolarHBondContact O-N 3.37Å; G225-I227 VanDerWaalsContact C-N 3.31Å; G225-I227 PolarHBondContact O-N 2.96Å; I227-A230 PolarHBondContact O-N 3.1Å; I227-L231 HydrophobicContact CG2-CD1 4.28Å; I227-L231 WeakPolarHBondContact O-CB 3.38Å; I227-L231 WeakPolarHBondContact O-CG 3.49Å; I227-L231 PolarHBondContact O-N 3.22Å |
| 228 | A | 91.3 | Very high | 92.1 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.1 | -40.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | P224 G225 H226 L231 Y232 F429 V433 P434 | P224-A228 PolarHBondContact O-N 3.5Å; G225-A228 PolarHBondContact O-N 3.05Å; H226-A228 VanDerWaalsContact C-N 3.31Å; H226-A228 PolarHBondContact O-N 3.28Å; A228-L231 WeakPolarHBondContact O-CB 3.22Å; A228-L231 PolarHBondContact O-N 3.47Å; A228-Y232 WeakPolarHBondContact O-CD1 3.39Å; A228-Y232 PolarHBondContact O-N 3.5Å; A228-F429 HydrophobicContact CB-CE1 4.04Å; A228-F429 HydrophobicContact CB-CZ 4.26Å; A228-V433 HydrophobicContact CB-CB 3.94Å; A228-V433 HydrophobicContact CB-CG1 3.38Å; A228-P434 HydrophobicContact CB-CG 4.23Å |
| 229 | L | 91.3 | Very high | 92 | Very high | 14 Ų | 14 | 27.7 Ų | 27.7 | 7% | 0.073 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -69.1 | -35.1 | 175.8 | -64.6 | 176.6 | 0 | 0 | 0 | 112.3 | G225 H226 Y232 S233 D438 | G225-L229 WeakPolarHBondContact O-CG 3.38Å; G225-L229 PolarHBondContact O-N 3.28Å; H226-L229 PolarHBondContact O-N 3.08Å; L229-Y232 HydrophobicContact CD2-CD2 4.33Å; L229-Y232 WeakPolarHBondContact O-CB 3.26Å; L229-Y232 PolarHBondContact O-N 3.27Å; L229-S233 PolarHBondContact O-N 3.33Å; L229-S233 VanDerWaalsContact O-N 3.09Å; L229-S233 PolarHBondContact O-OG 3.09Å; L229-D438 HydrophobicContact CD2-CB 4.38Å |
| 230 | A | 94.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -61.7 | -45.7 | 170 | 0 | 0 | 0 | 0 | 0 | 110.6 | V61 H64 V74 H226 I227 Y232 S233 A234 | V61-A230 HydrophobicContact CG1-CB 4.41Å; H64-A230 HydrophobicContact CB-CB 3.8Å; V74-A230 HydrophobicContact CG1-CB 4.01Å; V74-A230 HydrophobicContact CG2-CB 4.2Å; H226-A230 WeakPolarHBondContact O-CB 3.41Å; H226-A230 PolarHBondContact O-N 3.27Å; I227-A230 PolarHBondContact O-N 3.1Å; A230-Y232 VanDerWaalsContact C-N 3.34Å; A230-Y232 PolarHBondContact O-N 3.17Å; A230-S233 WeakPolarHBondContact O-CB 3.18Å; A230-S233 PolarHBondContact O-N 3.4Å; A230-A234 PolarHBondContact O-N 2.75Å |
| 231 | L | 94.6 | Very high | 91.4 | Very high | 18 Ų | 18 | 24.3 Ų | 24.3 | 9% | 0.094 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -61.2 | -40.6 | 175 | -80 | 166.7 | 0 | 0 | 0 | 111.7 | V74 I77 I227 A228 S233 A234 L235 F429 L430 | V74-L231 HydrophobicContact CG1-CD2 3.97Å; V74-L231 HydrophobicContact CG1-CG 4.13Å; I77-L231 HydrophobicContact CB-CD2 4.35Å; I77-L231 HydrophobicContact CG2-CD2 3.94Å; I227-L231 HydrophobicContact CG2-CD1 4.28Å; I227-L231 WeakPolarHBondContact O-CB 3.38Å; I227-L231 WeakPolarHBondContact O-CG 3.49Å; I227-L231 PolarHBondContact O-N 3.22Å; A228-L231 WeakPolarHBondContact O-CB 3.22Å; A228-L231 PolarHBondContact O-N 3.47Å; L231-S233 VanDerWaalsContact C-N 3.32Å; L231-S233 PolarHBondContact O-N 3.4Å; L231-A234 PolarHBondContact O-N 3.37Å; L231-L235 HydrophobicContact CB-CD1 4.47Å; L231-L235 WeakPolarHBondContact O-CB 3.28Å; L231-L235 WeakPolarHBondContact O-CG 3.42Å; L231-L235 PolarHBondContact O-N 3.47Å; L231-F429 HydrophobicContact CD1-CE1 4.07Å; L231-L430 HydrophobicContact CB-CD2 4.05Å; L231-L430 HydrophobicContact CD1-CD2 4.35Å |
| 232 | Y | 93.1 | Very high | 91.1 | Very high | 2 Ų | 2 | 24 Ų | 24 | 1% | 0.008 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -56.4 | -47.2 | 173.6 | -83.3 | 12.6 | 0 | 0 | 0 | 112 | A228 L229 A230 A234 L235 F236 N382 F386 L430 P434 | A228-Y232 WeakPolarHBondContact O-CD1 3.39Å; A228-Y232 PolarHBondContact O-N 3.5Å; L229-Y232 HydrophobicContact CD2-CD2 4.33Å; L229-Y232 WeakPolarHBondContact O-CB 3.26Å; L229-Y232 PolarHBondContact O-N 3.27Å; A230-Y232 VanDerWaalsContact C-N 3.34Å; A230-Y232 PolarHBondContact O-N 3.17Å; Y232-A234 PolarHBondContact O-N 3.3Å; Y232-L235 PolarHBondContact O-N 3.29Å; Y232-F236 WeakPolarHBondContact O-CB 3.41Å; Y232-F236 PolarHBondContact O-N 2.9Å; Y232-N382 HydrophobicContact CD2-CB 4.45Å; Y232-F386 HydrophobicContact CE2-CB 4.2Å; Y232-F386 WeakPolarHBondContact OH-CA 3.19Å; Y232-L430 HydrophobicContact CD1-CD2 4.04Å; Y232-L430 HydrophobicContact CE1-CB 4.06Å; Y232-L430 HydrophobicContact CE1-CD2 3.95Å; Y232-L430 VanDerWaalsContact CE1-O 3.29Å; Y232-L430 WeakPolarHBondContact CE1-O 3.28Å; Y232-L430 VanDerWaalsContact CZ-O 3.24Å; Y232-L430 PolarHBondContact OH-O 2.87Å; Y232-P434 HydrophobicContact CE1-CG 4.07Å; Y232-P434 HydrophobicContact CE2-CB 4.07Å; Y232-P434 HydrophobicContact CE2-CG 3.85Å; Y232-P434 WeakPolarHBondContact OH-CG 3.27Å |
| 233 | S | 94 | Very high | 90.5 | Very high | 0 Ų | 0 | 17.8 Ų | 17.8 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -60.2 | -46 | 177.2 | -66.5 | 0 | 0 | 0 | 0 | 111.6 | S57 L229 A230 L231 | S57-S233 WeakPolarHBondContact CB-O 3.46Å; S57-S233 PolarHBondContact OG-O 3.49Å; L229-S233 PolarHBondContact O-N 3.33Å; L229-S233 VanDerWaalsContact O-N 3.09Å; L229-S233 PolarHBondContact O-OG 3.09Å; A230-S233 WeakPolarHBondContact O-CB 3.18Å; A230-S233 PolarHBondContact O-N 3.4Å; L231-S233 VanDerWaalsContact C-N 3.32Å; L231-S233 PolarHBondContact O-N 3.4Å |
| 234 | A | 95.4 | Very high | 89.8 | Confident | 0 Ų | 0 | 14.6 Ų | 14.6 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -65.7 | -44 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | V61 V74 W75 A230 L231 Y232 F236 S237 Y238 | V61-A234 HydrophobicContact CG2-CB 3.92Å; V74-A234 HydrophobicContact CG1-CB 4.01Å; W75-A234 HydrophobicContact CD2-CB 4.33Å; W75-A234 HydrophobicContact CE3-CB 4.31Å; A230-A234 PolarHBondContact O-N 2.75Å; L231-A234 PolarHBondContact O-N 3.37Å; Y232-A234 PolarHBondContact O-N 3.3Å; A234-F236 VanDerWaalsContact C-N 3.3Å; A234-F236 PolarHBondContact O-N 2.92Å; A234-S237 VanDerWaalsContact O-CB 3.3Å; A234-S237 WeakPolarHBondContact O-CB 3.25Å; A234-S237 PolarHBondContact O-N 3.33Å; A234-Y238 VanDerWaalsContact O-CD2 3.28Å; A234-Y238 WeakPolarHBondContact O-CD2 3.33Å; A234-Y238 PolarHBondContact O-N 2.99Å; A234-Y238 VanDerWaalsContact O-N 3.16Å |
| 235 | L | 93.7 | Very high | 89.5 | Confident | 1 Ų | 1 | 11.7 Ų | 11.7 | 1% | 0.005 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -68.7 | -27.3 | -177.6 | -74.8 | 178.3 | 0 | 0 | 0 | 113.2 | F81 L231 Y232 S237 Y238 S239 W389 L430 | F81-L235 HydrophobicContact CD1-CD1 3.98Å; F81-L235 HydrophobicContact CD1-CD2 3.42Å; F81-L235 VanDerWaalsContact CD1-CD2 3.42Å; F81-L235 HydrophobicContact CD1-CG 4.37Å; F81-L235 HydrophobicContact CE1-CD1 3.86Å; F81-L235 HydrophobicContact CE1-CD2 3.95Å; F81-L235 HydrophobicContact CG-CD2 4.37Å; L231-L235 HydrophobicContact CB-CD1 4.47Å; L231-L235 WeakPolarHBondContact O-CB 3.28Å; L231-L235 WeakPolarHBondContact O-CG 3.42Å; L231-L235 PolarHBondContact O-N 3.47Å; Y232-L235 PolarHBondContact O-N 3.29Å; L235-S237 VanDerWaalsContact C-N 3.31Å; L235-Y238 CarbonylContact O-C 3.22Å; L235-Y238 PolarHBondContact O-N 3.36Å; L235-S239 PolarHBondContact O-N 2.98Å; L235-W389 HydrophobicContact CB-CZ2 3.63Å; L235-W389 HydrophobicContact CD1-CZ2 4.1Å; L235-W389 HydrophobicContact CD2-CH2 4.37Å; L235-W389 HydrophobicContact CD2-CZ2 3.98Å; L235-W389 HydrophobicContact CG-CZ2 4.11Å; L235-L430 HydrophobicContact CD1-CD1 3.48Å; L235-L430 VanDerWaalsContact CD1-CD1 3.48Å; L235-L430 HydrophobicContact CD1-CD2 4.12Å; L235-L430 HydrophobicContact CD1-CG 4.47Å |
| 236 | F | 93.1 | Very high | 88.8 | Confident | 7 Ų | 7 | 14.2 Ų | 14.2 | 3% | 0.031 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -58.1 | -45 | 167.5 | 179.9 | -103.7 | 0 | 0 | 0 | 111.2 | V133 Y232 A234 Y238 S239 I381 Y384 | V133-F236 HydrophobicContact CB-CZ 3.99Å; V133-F236 HydrophobicContact CG1-CE1 3.67Å; V133-F236 HydrophobicContact CG1-CE2 4.43Å; V133-F236 HydrophobicContact CG1-CZ 3.48Å; V133-F236 VanDerWaalsContact CG1-CZ 3.48Å; Y232-F236 WeakPolarHBondContact O-CB 3.41Å; Y232-F236 PolarHBondContact O-N 2.9Å; A234-F236 VanDerWaalsContact C-N 3.3Å; A234-F236 PolarHBondContact O-N 2.92Å; F236-Y238 VanDerWaalsContact C-N 3.3Å; F236-Y238 PolarHBondContact O-N 3.49Å; F236-S239 WeakPolarHBondContact O-CB 3.44Å; F236-S239 PolarHBondContact O-N 3Å; F236-S239 PolarHBondContact O-OG 2.81Å; F236-I381 HydrophobicContact CB-CG2 3.84Å; F236-I381 HydrophobicContact CD1-CD1 4.22Å; F236-I381 HydrophobicContact CD1-CG1 4.23Å; F236-I381 HydrophobicContact CD2-CG1 4.39Å; F236-I381 HydrophobicContact CD2-CG2 4.38Å; F236-I381 HydrophobicContact CE1-CD1 4.49Å; F236-I381 HydrophobicContact CE1-CG1 4.4Å; F236-I381 HydrophobicContact CG-CG1 4.23Å; F236-I381 HydrophobicContact CG-CG2 4.05Å; F236-Y384 AromaticContact CD2-CD1 3.54Å; F236-Y384 HydrophobicContact CD2-CD1 3.54Å; F236-Y384 AromaticContact CD2-CE1 3.61Å; F236-Y384 HydrophobicContact CD2-CE1 3.61Å; F236-Y384 HydrophobicContact CD2-CG 4.35Å; F236-Y384 AromaticContact CE2-CD1 4Å; F236-Y384 HydrophobicContact CE2-CD1 4Å; F236-Y384 HydrophobicContact CE2-CE1 4.08Å; F236-Y384 HydrophobicContact CE2-CG 4.4Å |
| 237 | S | 93.1 | Very high | 87.9 | Confident | 1 Ų | 1 | 10.9 Ų | 10.9 | 1% | 0.007 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -66.4 | -30.5 | 175.5 | -72.3 | 0 | 0 | 0 | 0 | 113.7 | G53 I54 S57 W75 A234 L235 S239 Y273 | G53-S237 WeakPolarHBondContact CA-OG 3.29Å; G53-S237 PolarHBondContact O-OG 3.3Å; I54-S237 PolarHBondContact N-OG 2.77Å; I54-S237 VanDerWaalsContact N-OG 3.16Å; S57-S237 WeakPolarHBondContact CB-OG 3.16Å; S57-S237 PolarHBondContact OG-OG 2.79Å; W75-S237 WeakPolarHBondContact CH2-OG 3.26Å; A234-S237 VanDerWaalsContact O-CB 3.3Å; A234-S237 WeakPolarHBondContact O-CB 3.25Å; A234-S237 PolarHBondContact O-N 3.33Å; L235-S237 VanDerWaalsContact C-N 3.31Å; S237-S239 VanDerWaalsContact C-N 3.32Å; S237-Y273 VanDerWaalsContact O-CE2 3.26Å; S237-Y273 WeakPolarHBondContact O-CE2 3.49Å; S237-Y273 PolarHBondContact O-OH 3.01Å |
| 238 | Y | 91.9 | Very high | 87.1 | Confident | 0 Ų | 0 | 8.7 Ų | 8.7 | 0% | 0 | 5% | 0.05 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.9 | -1.2 | 175.5 | -73.8 | -71.6 | 0 | 0 | 0 | 113.5 | M49 W75 S82 A234 L235 F236 V269 Y273 | M49-Y238 HydrophobicContact CE-CD1 3.81Å; M49-Y238 VanDerWaalsContact CE-O 3.22Å; M49-Y238 WeakPolarHBondContact CE-O 3.45Å; W75-Y238 HydrophobicContact CE3-CD2 4.49Å; W75-Y238 AromaticContact CE3-CE2 3.69Å; W75-Y238 HydrophobicContact CE3-CE2 3.69Å; W75-Y238 HydrophobicContact CZ3-CE2 4.1Å; W75-Y238 WeakPolarHBondContact O-CE2 3.49Å; W75-Y238 PolarHBondContact O-OH 2.74Å; S82-Y238 VanDerWaalsContact OG-CB 3.31Å; S82-Y238 WeakPolarHBondContact OG-CB 3.39Å; A234-Y238 VanDerWaalsContact O-CD2 3.28Å; A234-Y238 WeakPolarHBondContact O-CD2 3.33Å; A234-Y238 PolarHBondContact O-N 2.99Å; A234-Y238 VanDerWaalsContact O-N 3.16Å; L235-Y238 CarbonylContact O-C 3.22Å; L235-Y238 PolarHBondContact O-N 3.36Å; F236-Y238 VanDerWaalsContact C-N 3.3Å; F236-Y238 PolarHBondContact O-N 3.49Å; Y238-V269 HydrophobicContact CD1-CG1 4.17Å; Y238-V269 HydrophobicContact CE1-CG1 4.15Å; Y238-Y273 AromaticContact CD1-CD2 3.86Å; Y238-Y273 HydrophobicContact CD1-CD2 3.86Å; Y238-Y273 AromaticContact CD1-CE2 3.84Å; Y238-Y273 HydrophobicContact CD1-CE2 3.84Å; Y238-Y273 HydrophobicContact CD2-CD2 4.42Å; Y238-Y273 AromaticContact CE1-CD2 3.45Å; Y238-Y273 HydrophobicContact CE1-CD2 3.45Å; Y238-Y273 VanDerWaalsContact CE1-CD2 3.45Å; Y238-Y273 AromaticContact CE1-CE2 3.91Å; Y238-Y273 HydrophobicContact CE1-CE2 3.91Å; Y238-Y273 HydrophobicContact CE1-CG 4.43Å; Y238-Y273 HydrophobicContact CE2-CD2 4.07Å; Y238-Y273 HydrophobicContact CG-CD2 4.34Å; Y238-Y273 HydrophobicContact CG-CE2 4.21Å; Y238-Y273 AromaticContact CZ-CD2 3.57Å |
| 239 | S | 87.1 | Confident | 86.4 | Confident | 16 Ų | 16 | 12.3 Ų | 12.3 | 11% | 0.112 | 7% | 0.067 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.1 | 156.5 | 179.1 | 70 | 0 | 0 | 0 | 0 | 112.3 | M49 L235 F236 S237 Y384 | M49-S239 WeakPolarHBondContact CA-O 3.31Å; L235-S239 PolarHBondContact O-N 2.98Å; F236-S239 WeakPolarHBondContact O-CB 3.44Å; F236-S239 PolarHBondContact O-N 3Å; F236-S239 PolarHBondContact O-OG 2.81Å; S237-S239 VanDerWaalsContact C-N 3.32Å; S239-Y384 WeakPolarHBondContact CB-OH 3.23Å; S239-Y384 PolarHBondContact OG-OH 2.89Å |
| 240 | G | 82.6 | Confident | 85.8 | Confident | 14 Ų | 14 | 13.7 Ų | 13.7 | 14% | 0.144 | 7% | 0.073 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 103.4 | -4.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | D242 T243 | G240-D242 WeakPolarHBondContact CA-OD1 3.29Å; G240-D242 PolarHBondContact O-N 3.19Å; G240-T243 WeakPolarHBondContact O-CB 3.38Å; G240-T243 PolarHBondContact O-N 3.24Å; G240-T243 VanDerWaalsContact O-N 3.11Å; G240-T243 PolarHBondContact O-OG1 3.49Å |
| 241 | W | 86.9 | Confident | 85.3 | Confident | 0 Ų | 0 | 13.9 Ų | 13.9 | 0% | 0 | 7% | 0.074 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -23.6 | 172.4 | 52.1 | -107.4 | 0 | 0 | 0 | 113.3 | I45 M49 A86 Y89 T243 M266 W389 V392 | I45-W241 HydrophobicContact CG2-CB 4.45Å; M49-W241 HydrophobicContact CE-CB 4.39Å; M49-W241 HydrophobicContact CG-CB 4.45Å; M49-W241 HydrophobicContact SD-CB 3.86Å; A86-W241 VanDerWaalsContact CA-CE3 3.46Å; A86-W241 HydrophobicContact CB-CB 4.24Å; A86-W241 HydrophobicContact CB-CD2 3.8Å; A86-W241 HydrophobicContact CB-CE3 3.63Å; A86-W241 HydrophobicContact CB-CG 4.07Å; A86-W241 HydrophobicContact CB-CZ3 4.3Å; Y89-W241 HydrophobicContact CD1-CH2 4.38Å; Y89-W241 AromaticContact CD1-CZ3 3.81Å; Y89-W241 HydrophobicContact CD1-CZ3 3.81Å; Y89-W241 AromaticContact CD2-CH2 3.64Å; Y89-W241 HydrophobicContact CD2-CH2 3.64Å; Y89-W241 AromaticContact CD2-CZ3 3.65Å; Y89-W241 HydrophobicContact CD2-CZ3 3.65Å; Y89-W241 HydrophobicContact CE1-CZ3 4.38Å; Y89-W241 AromaticContact CE2-CH2 3.91Å; Y89-W241 HydrophobicContact CE2-CH2 3.91Å; Y89-W241 HydrophobicContact CE2-CZ3 4.25Å; Y89-W241 AromaticContact CG-CH2 3.92Å; Y89-W241 HydrophobicContact CG-CH2 3.92Å; Y89-W241 AromaticContact CG-CZ3 3.42Å; Y89-W241 HydrophobicContact CG-CZ3 3.42Å; Y89-W241 VanDerWaalsContact CG-CZ3 3.42Å; W241-T243 VanDerWaalsContact C-N 3.27Å; W241-T243 PolarHBondContact O-N 2.92Å; W241-M266 HydrophobicContact CB-SD 3.64Å; W241-M266 HydrophobicContact CG-SD 4.19Å; W241-W389 HydrophobicContact CZ2-CH2 4.28Å; W241-W389 HydrophobicContact CZ2-CZ3 4.11Å; W241-V392 HydrophobicContact CH2-CG1 4.06Å; W241-V392 HydrophobicContact CZ2-CG1 4.27Å |
| 242 | D | 85.4 | Confident | 84.8 | Confident | 9 Ų | 9 | 17.9 Ų | 17.9 | 5% | 0.048 | 9% | 0.09 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78.8 | -5.7 | 176.5 | 63.2 | -35.5 | 0 | 0 | 0 | 112.9 | Y89 G240 L244 N245 F246 Y388 | Y89-D242 HydrophobicContact CD1-CB 4.05Å; Y89-D242 HydrophobicContact CE1-CB 4.16Å; G240-D242 WeakPolarHBondContact CA-OD1 3.29Å; G240-D242 PolarHBondContact O-N 3.19Å; D242-L244 VanDerWaalsContact C-N 3.3Å; D242-L244 PolarHBondContact O-N 3.29Å; D242-N245 VanDerWaalsContact O-CB 3.24Å; D242-N245 WeakPolarHBondContact O-CB 3.24Å; D242-N245 PolarHBondContact O-N 2.9Å; D242-F246 WeakPolarHBondContact O-CD2 3.46Å; D242-Y388 VanDerWaalsContact CG-OH 3.22Å; D242-Y388 PolarHBondContact OD1-OH 3.42Å; D242-Y388 PolarHBondContact OD2-OH 2.85Å |
| 243 | T | 78.2 | Confident | 84.5 | Confident | 31 Ų | 31 | 23.5 Ų | 23.5 | 19% | 0.19 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -58.6 | -40.6 | -179.2 | -45.5 | 0 | 0 | 0 | 0 | 112.1 | L44 N48 G240 W241 N245 F246 | L44-T243 HydrophobicContact CD2-CG2 3.83Å; N48-T243 WeakPolarHBondContact ND2-CB 3.48Å; N48-T243 WeakPolarHBondContact ND2-CG2 3.41Å; N48-T243 PolarHBondContact ND2-OG1 3.41Å; N48-T243 VanDerWaalsContact ND2-OG1 3.11Å; G240-T243 WeakPolarHBondContact O-CB 3.38Å; G240-T243 PolarHBondContact O-N 3.24Å; G240-T243 VanDerWaalsContact O-N 3.11Å; G240-T243 PolarHBondContact O-OG1 3.49Å; W241-T243 VanDerWaalsContact C-N 3.27Å; W241-T243 PolarHBondContact O-N 2.92Å; T243-N245 PolarHBondContact O-N 2.89Å; T243-N245 VanDerWaalsContact O-N 3.16Å; T243-F246 WeakPolarHBondContact O-CB 3.39Å; T243-F246 PolarHBondContact O-N 3.37Å |
| 244 | L | 77.4 | Confident | 84 | Confident | 1 Ų | 1 | 24.5 Ų | 24.5 | 1% | 0.005 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -61 | -27.9 | 179 | -79.9 | -171.5 | 0 | 0 | 0 | 112.6 | L44 I45 D242 F246 V247 T248 I251 L258 A261 | L44-L244 HydrophobicContact CB-CD2 4.26Å; L44-L244 HydrophobicContact CD1-CD2 4.01Å; L44-L244 HydrophobicContact CD2-CD2 3.85Å; L44-L244 HydrophobicContact CD2-CG 4.26Å; L44-L244 HydrophobicContact CG-CD2 4.27Å; I45-L244 HydrophobicContact CD1-CD1 3.34Å; I45-L244 HydrophobicContact CD1-CG 3.92Å; I45-L244 HydrophobicContact CG1-CD1 3.6Å; I45-L244 HydrophobicContact CG1-CG 3.66Å; D242-L244 VanDerWaalsContact C-N 3.3Å; D242-L244 PolarHBondContact O-N 3.29Å; L244-F246 PolarHBondContact O-N 2.78Å; L244-V247 HydrophobicContact CD2-CG2 4.13Å; L244-V247 CarbonylContact O-C 3.57Å; L244-V247 PolarHBondContact O-N 2.97Å; L244-T248 PolarHBondContact O-N 3.46Å; L244-T248 PolarHBondContact O-OG1 3.34Å; L244-I251 HydrophobicContact CB-CD1 4.31Å; L244-I251 HydrophobicContact CD2-CD1 4.2Å; L244-L258 HydrophobicContact CB-CD1 3.55Å; L244-L258 HydrophobicContact CD1-CD1 4.11Å; L244-L258 HydrophobicContact CG-CD1 4.49Å; L244-A261 HydrophobicContact CD1-CB 3.69Å |
| 245 | N | 82.4 | Confident | 83.5 | Confident | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -66.6 | -27.3 | 177 | -69.5 | 94.7 | 0 | 0 | 0 | 112.6 | Y89 A101 Y105 D242 T243 V247 T248 | Y89-N245 PolarHBondContact O-ND2 3.42Å; A101-N245 HydrophobicContact CB-CB 3.84Å; Y105-N245 WeakPolarHBondContact OH-CB 3.47Å; Y105-N245 PolarHBondContact OH-ND2 2.99Å; D242-N245 VanDerWaalsContact O-CB 3.24Å; D242-N245 WeakPolarHBondContact O-CB 3.24Å; D242-N245 PolarHBondContact O-N 2.9Å; T243-N245 PolarHBondContact O-N 2.89Å; T243-N245 VanDerWaalsContact O-N 3.16Å; N245-V247 VanDerWaalsContact C-N 3.32Å; N245-T248 VanDerWaalsContact CA-OG1 3.3Å; N245-T248 WeakPolarHBondContact CA-OG1 3.39Å; N245-T248 PolarHBondContact O-OG1 2.92Å |
| 246 | F | 74.2 | Confident | 83.3 | Confident | 53 Ų | 53 | 38.7 Ų | 38.7 | 23% | 0.232 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -71.9 | -28.1 | 175.9 | -70 | -89.1 | 0 | 0 | 0 | 112.9 | S99 G100 A101 D242 T243 L244 | S99-F246 PolarHBondContact OG-O 3.43Å; G100-F246 WeakPolarHBondContact O-CE1 3.42Å; A101-F246 HydrophobicContact CB-CD1 3.72Å; A101-F246 HydrophobicContact CB-CD2 3.61Å; A101-F246 HydrophobicContact CB-CE1 3.64Å; A101-F246 HydrophobicContact CB-CE2 3.55Å; A101-F246 HydrophobicContact CB-CG 3.72Å; A101-F246 HydrophobicContact CB-CZ 3.58Å; D242-F246 WeakPolarHBondContact O-CD2 3.46Å; T243-F246 WeakPolarHBondContact O-CB 3.39Å; T243-F246 PolarHBondContact O-N 3.37Å; L244-F246 PolarHBondContact O-N 2.78Å |
| 247 | V | 73.4 | Confident | 83.1 | Confident | 13 Ų | 13 | 39.5 Ų | 39.5 | 8% | 0.079 | 19% | 0.19 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -109.7 | 22.6 | -177.6 | -65.3 | 0 | 0 | 0 | 0 | 112.5 | I36 L244 N245 E249 E250 I251 | I36-V247 HydrophobicContact CD1-CB 4.04Å; I36-V247 HydrophobicContact CD1-CG2 3.85Å; L244-V247 HydrophobicContact CD2-CG2 4.13Å; L244-V247 CarbonylContact O-C 3.57Å; L244-V247 PolarHBondContact O-N 2.97Å; N245-V247 VanDerWaalsContact C-N 3.32Å; V247-E249 PolarHBondContact O-N 3.23Å; V247-E249 VanDerWaalsContact O-N 3.16Å; V247-E250 HydrophobicContact CB-CB 4.49Å; V247-E250 WeakPolarHBondContact O-CB 3.25Å; V247-E250 PolarHBondContact O-N 3.4Å; V247-I251 PolarHBondContact O-N 3.39Å |
| 248 | T | 76.3 | Confident | 82.8 | Confident | 3 Ų | 3 | 39.4 Ų | 39.4 | 2% | 0.018 | 19% | 0.19 | C | C | . | . | G | 310 helix | trans | -56 | -35.5 | -177.3 | -51.5 | 0 | 0 | 0 | 0 | 112.7 | L244 N245 E250 I251 P254 | L244-T248 PolarHBondContact O-N 3.46Å; L244-T248 PolarHBondContact O-OG1 3.34Å; N245-T248 VanDerWaalsContact CA-OG1 3.3Å; N245-T248 WeakPolarHBondContact CA-OG1 3.39Å; N245-T248 PolarHBondContact O-OG1 2.92Å; T248-E250 PolarHBondContact O-N 3.13Å; T248-I251 PolarHBondContact O-N 3.02Å; T248-P254 HydrophobicContact CG2-CB 3.88Å |
| 249 | E | 75.2 | Confident | 82.7 | Confident | 75 Ų | 75 | 40.3 Ų | 40.3 | 35% | 0.35 | 20% | 0.196 | S | C | . | . | G | 310 helix | trans | -62.8 | -27.2 | 177.5 | -63.1 | -176.2 | -171.2 | 0 | 0 | 113.1 | L32 K34 T97 K98 S99 V247 | L32-E249 HydrophobicContact CD1-CB 4.5Å; K34-E249 WeakPolarHBondContact CG-O 3.45Å; T97-E249 WeakPolarHBondContact O-CG 3.24Å; K98-E249 WeakPolarHBondContact CA-OE1 3.34Å; S99-E249 PolarHBondContact N-OE1 3.49Å; V247-E249 PolarHBondContact O-N 3.23Å; V247-E249 VanDerWaalsContact O-N 3.16Å |
| 250 | E | 80.2 | Confident | 82.9 | Confident | 43 Ų | 43 | 42.7 Ų | 42.7 | 20% | 0.201 | 21% | 0.207 | C | C | . | . | G | 310 helix | trans | -90.4 | -7.6 | -178.4 | -58.6 | 175.6 | -140.1 | 0 | 0 | 112.6 | L32 K34 E35 I36 V247 T248 R332 | L32-E250 HydrophobicContact CB-CG 4.2Å; L32-E250 HydrophobicContact CD1-CG 4.23Å; K34-E250 CarbonylContact C-O 3.29Å; K34-E250 VanDerWaalsContact CA-O 3.31Å; K34-E250 WeakPolarHBondContact CA-O 3.3Å; E35-E250 PolarHBondContact N-O 3.08Å; I36-E250 HydrophobicContact CD1-CB 3.78Å; I36-E250 HydrophobicContact CG1-CB 4.13Å; I36-E250 PolarHBondContact N-O 3.16Å; V247-E250 HydrophobicContact CB-CB 4.49Å; V247-E250 WeakPolarHBondContact O-CB 3.25Å; V247-E250 PolarHBondContact O-N 3.4Å; T248-E250 PolarHBondContact O-N 3.13Å; E250-R332 IonicContact OE1-NH1 3.85Å |
| 251 | I | 82.9 | Confident | 83.2 | Confident | 5 Ų | 5 | 42 Ų | 42 | 3% | 0.026 | 20% | 0.2 | C | C | . | . | B | Isolated β-bridge | trans | -80.9 | 132.3 | -177.9 | -61.8 | 174.9 | 0 | 0 | 0 | 111.1 | I36 L244 V247 T248 N253 P254 N257 L258 | I36-I251 HydrophobicContact CB-CG1 4.25Å; I36-I251 HydrophobicContact CG2-CG1 4.26Å; L244-I251 HydrophobicContact CB-CD1 4.31Å; L244-I251 HydrophobicContact CD2-CD1 4.2Å; V247-I251 PolarHBondContact O-N 3.39Å; T248-I251 PolarHBondContact O-N 3.02Å; I251-N253 PolarHBondContact O-N 3.03Å; I251-P254 HydrophobicContact CB-CB 4.36Å; I251-P254 HydrophobicContact CG2-CB 4.35Å; I251-N257 HydrophobicContact CG2-CB 4.06Å; I251-L258 HydrophobicContact CD1-CD1 4.07Å |
| 252 | K | 84.7 | Confident | 83.4 | Confident | 101 Ų | 101 | 42.1 Ų | 42.1 | 44% | 0.439 | 20% | 0.201 | S | C | . | . | S | Bend | trans | -69.2 | 125.8 | 168.3 | -66.6 | 179.3 | 179.3 | 177 | 0 | 109.1 | K34 I36 N257 | K34-K252 HydrophobicContact CB-CG 4.36Å; K34-K252 WeakPolarHBondContact O-CE 3.29Å; K34-K252 VanDerWaalsContact O-CG 3.31Å; K34-K252 WeakPolarHBondContact O-CG 3.28Å; I36-K252 PolarHBondContact O-N 3.09Å; K252-N257 WeakPolarHBondContact O-CB 3.43Å; K252-N257 PolarHBondContact O-ND2 3.37Å |
| 253 | N | 85.9 | Confident | 83.6 | Confident | 121 Ų | 121 | 44.3 Ų | 44.3 | 65% | 0.647 | 22% | 0.22 | S | C | * | . | S | Bend | trans | 48.5 | 64.3 | 179.8 | -61.8 | -20.1 | 0 | 0 | 0 | 113.1 | I251 E255 R256 N257 | I251-N253 PolarHBondContact O-N 3.03Å; N253-E255 PolarHBondContact O-N 3.34Å; N253-R256 PolarHBondContact O-N 3.07Å; N253-R256 VanDerWaalsContact O-N 3.14Å; N253-N257 WeakPolarHBondContact O-CB 3.35Å; N253-N257 PolarHBondContact O-N 2.92Å |
| 254 | P | 84.1 | Confident | 84.2 | Confident | 21 Ų | 21 | 46.4 Ų | 46.4 | 14% | 0.136 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -57.9 | -36 | -171.7 | 23.5 | -33.2 | 0 | 0 | 0 | 112.7 | T248 I251 R256 L258 | T248-P254 HydrophobicContact CG2-CB 3.88Å; I251-P254 HydrophobicContact CB-CB 4.36Å; I251-P254 HydrophobicContact CG2-CB 4.35Å; P254-R256 PolarHBondContact O-N 2.8Å; P254-L258 WeakPolarHBondContact O-CB 3.48Å; P254-L258 PolarHBondContact O-N 3.29Å |
| 255 | E | 85.6 | Confident | 84.9 | Confident | 122 Ų | 122 | 46.3 Ų | 46.3 | 57% | 0.57 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -56 | -34.8 | 179.6 | -58 | -179.2 | 179.2 | 0 | 0 | 113.9 | N253 P259 P412 | N253-E255 PolarHBondContact O-N 3.34Å; E255-P259 WeakPolarHBondContact O-CD 3.44Å; E255-P259 WeakPolarHBondContact O-CG 3.48Å; E255-P412 HydrophobicContact CB-CB 3.95Å; E255-P412 VanDerWaalsContact CD-CB 3.42Å; E255-P412 HydrophobicContact CG-CB 3.53Å; E255-P412 HydrophobicContact CG-CG 3.86Å; E255-P412 WeakPolarHBondContact OE1-CG 3.45Å |
| 256 | R | 88.3 | Confident | 85.3 | Confident | 176 Ų | 176 | 46.3 Ų | 46.3 | 66% | 0.664 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -100.6 | -43.4 | 180 | -179.7 | 177.7 | 174.4 | -170.9 | -0.4 | 111.9 | N253 P254 P259 L260 | N253-R256 PolarHBondContact O-N 3.07Å; N253-R256 VanDerWaalsContact O-N 3.14Å; P254-R256 PolarHBondContact O-N 2.8Å; R256-P259 WeakPolarHBondContact O-CD 3.47Å; R256-L260 HydrophobicContact CG-CD1 3.65Å; R256-L260 WeakPolarHBondContact O-CB 3.48Å; R256-L260 WeakPolarHBondContact O-CD1 3.18Å; R256-L260 WeakPolarHBondContact O-CG 3.49Å; R256-L260 PolarHBondContact O-N 3.21Å |
| 257 | N | 89.4 | Confident | 86.2 | Confident | 24 Ų | 24 | 47 Ų | 47 | 13% | 0.128 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -79.4 | -31.8 | -170.5 | -74.5 | -8.3 | 0 | 0 | 0 | 112.8 | L38 I251 K252 N253 A261 | L38-N257 HydrophobicContact CB-CB 4.43Å; L38-N257 HydrophobicContact CD1-CB 4.27Å; L38-N257 WeakPolarHBondContact CD1-O 3.49Å; I251-N257 HydrophobicContact CG2-CB 4.06Å; K252-N257 WeakPolarHBondContact O-CB 3.43Å; K252-N257 PolarHBondContact O-ND2 3.37Å; N253-N257 WeakPolarHBondContact O-CB 3.35Å; N253-N257 PolarHBondContact O-N 2.92Å; N257-A261 WeakPolarHBondContact O-CB 3.45Å; N257-A261 PolarHBondContact O-N 3.48Å |
| 258 | L | 87.5 | Confident | 87 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.8 | -51.2 | 177.2 | 179 | 70.7 | 0 | 0 | 0 | 111.4 | T94 L244 I251 P254 L260 A261 I262 | T94-L258 HydrophobicContact CG2-CD2 4.29Å; L244-L258 HydrophobicContact CB-CD1 3.55Å; L244-L258 HydrophobicContact CD1-CD1 4.11Å; L244-L258 HydrophobicContact CG-CD1 4.49Å; I251-L258 HydrophobicContact CD1-CD1 4.07Å; P254-L258 WeakPolarHBondContact O-CB 3.48Å; P254-L258 PolarHBondContact O-N 3.29Å; L258-L260 PolarHBondContact O-N 2.9Å; L258-A261 PolarHBondContact O-N 3.45Å; L258-I262 HydrophobicContact CD1-CD1 4.26Å; L258-I262 HydrophobicContact CG-CD1 4.32Å; L258-I262 PolarHBondContact O-N 2.92Å |
| 259 | P | 89.4 | Confident | 87.8 | Confident | 19 Ų | 19 | 49.6 Ų | 49.6 | 12% | 0.123 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -66.6 | -38.1 | 179.4 | -20.5 | 34.7 | 0 | 0 | 0 | 112.6 | A90 T94 E255 R256 I262 A263 L413 | A90-P259 HydrophobicContact CB-CB 4.42Å; A90-P259 HydrophobicContact CB-CG 4.32Å; T94-P259 HydrophobicContact CG2-CG 4.49Å; E255-P259 WeakPolarHBondContact O-CD 3.44Å; E255-P259 WeakPolarHBondContact O-CG 3.48Å; R256-P259 WeakPolarHBondContact O-CD 3.47Å; P259-I262 PolarHBondContact O-N 2.81Å; P259-A263 VanDerWaalsContact O-CB 3.32Å; P259-A263 WeakPolarHBondContact O-CB 3.2Å; P259-A263 PolarHBondContact O-N 2.91Å; P259-L413 HydrophobicContact CB-CD1 4.32Å; P259-L413 HydrophobicContact CB-CD2 4.19Å; P259-L413 HydrophobicContact CG-CD1 4.08Å; P259-L413 HydrophobicContact CG-CD2 3.82Å; P259-L413 HydrophobicContact CG-CG 4.42Å |
| 260 | L | 90.2 | Very high | 88.7 | Confident | 65 Ų | 65 | 47 Ų | 47 | 34% | 0.34 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -65.8 | -40.5 | 177.2 | -73.3 | 175.1 | 0 | 0 | 0 | 112.1 | L38 R256 L258 I262 A263 I264 | L38-L260 HydrophobicContact CD1-CB 3.7Å; L38-L260 HydrophobicContact CD2-CB 4.46Å; L38-L260 HydrophobicContact CD2-CD1 4.41Å; R256-L260 HydrophobicContact CG-CD1 3.65Å; R256-L260 WeakPolarHBondContact O-CB 3.48Å; R256-L260 WeakPolarHBondContact O-CD1 3.18Å; R256-L260 WeakPolarHBondContact O-CG 3.49Å; R256-L260 PolarHBondContact O-N 3.21Å; L258-L260 PolarHBondContact O-N 2.9Å; L260-I262 VanDerWaalsContact C-N 3.3Å; L260-I262 PolarHBondContact O-N 3.35Å; L260-A263 PolarHBondContact O-N 2.95Å; L260-I264 VanDerWaalsContact O-CG1 3.29Å; L260-I264 WeakPolarHBondContact O-CG1 2.96Å; L260-I264 PolarHBondContact O-N 3.03Å |
| 261 | A | 90.8 | Very high | 89.4 | Confident | 1 Ų | 1 | 48.9 Ų | 48.9 | 1% | 0.008 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.2 | -43.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111 | L38 V42 I45 L244 N257 L258 S265 | L38-A261 HydrophobicContact CD1-CB 4.04Å; V42-A261 HydrophobicContact CG2-CB 4.14Å; I45-A261 HydrophobicContact CD1-CB 4.17Å; L244-A261 HydrophobicContact CD1-CB 3.69Å; N257-A261 WeakPolarHBondContact O-CB 3.45Å; N257-A261 PolarHBondContact O-N 3.48Å; L258-A261 PolarHBondContact O-N 3.45Å; A261-S265 VanDerWaalsContact O-CB 3.24Å; A261-S265 WeakPolarHBondContact O-CB 3.5Å; A261-S265 PolarHBondContact O-N 3.47Å; A261-S265 PolarHBondContact O-OG 3.41Å |
| 262 | I | 90.2 | Very high | 89.9 | Confident | 1 Ų | 1 | 49.9 Ų | 49.9 | 1% | 0.005 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -65.6 | -47.7 | 176.3 | -70.8 | 166.8 | 0 | 0 | 0 | 111.2 | I45 A86 A90 L258 P259 L260 I264 S265 M266 | I45-I262 HydrophobicContact CD1-CG1 3.68Å; A86-I262 HydrophobicContact CB-CD1 4.48Å; A86-I262 HydrophobicContact CB-CG2 3.43Å; A86-I262 VanDerWaalsContact CB-CG2 3.43Å; A90-I262 HydrophobicContact CB-CD1 3.78Å; L258-I262 HydrophobicContact CD1-CD1 4.26Å; L258-I262 HydrophobicContact CG-CD1 4.32Å; L258-I262 PolarHBondContact O-N 2.92Å; P259-I262 PolarHBondContact O-N 2.81Å; L260-I262 VanDerWaalsContact C-N 3.3Å; L260-I262 PolarHBondContact O-N 3.35Å; I262-I264 PolarHBondContact O-N 2.85Å; I262-S265 WeakPolarHBondContact CA-OG 3.22Å; I262-S265 PolarHBondContact O-N 2.62Å; I262-S265 PolarHBondContact O-OG 2.96Å; I262-M266 HydrophobicContact CG2-CG 3.93Å; I262-M266 WeakPolarHBondContact O-CB 3.31Å; I262-M266 VanDerWaalsContact O-CG 3.27Å; I262-M266 WeakPolarHBondContact O-CG 3.42Å; I262-M266 PolarHBondContact O-N 3.31Å |
| 263 | A | 89.3 | Confident | 90.4 | Very high | 55 Ų | 55 | 45 Ų | 45 | 46% | 0.455 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.6 | -30.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | P259 L260 P267 | P259-A263 VanDerWaalsContact O-CB 3.32Å; P259-A263 WeakPolarHBondContact O-CB 3.2Å; P259-A263 PolarHBondContact O-N 2.91Å; L260-A263 PolarHBondContact O-N 2.95Å; A263-P267 WeakPolarHBondContact O-CD 3.27Å; A263-P267 VanDerWaalsContact O-CG 3.31Å; A263-P267 WeakPolarHBondContact O-CG 3.06Å |
| 264 | I | 91.6 | Very high | 90.8 | Very high | 75 Ų | 75 | 41.3 Ų | 41.3 | 39% | 0.385 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -84 | -47.1 | 176.9 | -65.3 | 167.1 | 0 | 0 | 0 | 111.2 | V42 L260 I262 I268 | V42-I264 HydrophobicContact CG1-CG2 4.1Å; V42-I264 HydrophobicContact CG2-CB 4.18Å; V42-I264 HydrophobicContact CG2-CD1 4.44Å; V42-I264 HydrophobicContact CG2-CG2 4.16Å; L260-I264 VanDerWaalsContact O-CG1 3.29Å; L260-I264 WeakPolarHBondContact O-CG1 2.96Å; L260-I264 PolarHBondContact O-N 3.03Å; I262-I264 PolarHBondContact O-N 2.85Å; I264-I268 HydrophobicContact CG2-CD1 3.71Å; I264-I268 VanDerWaalsContact O-CD1 3.27Å; I264-I268 WeakPolarHBondContact O-CD1 3.49Å; I264-I268 VanDerWaalsContact O-CG1 3.24Å; I264-I268 WeakPolarHBondContact O-CG1 3.44Å |
| 265 | S | 91.3 | Very high | 91.4 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -69.2 | -41.5 | -173.3 | 53.7 | 0 | 0 | 0 | 0 | 113.2 | I45 A261 I262 I268 V269 | I45-S265 WeakPolarHBondContact CD1-OG 3.32Å; I45-S265 VanDerWaalsContact CG2-OG 3.27Å; I45-S265 WeakPolarHBondContact CG2-OG 3.46Å; A261-S265 VanDerWaalsContact O-CB 3.24Å; A261-S265 WeakPolarHBondContact O-CB 3.5Å; A261-S265 PolarHBondContact O-N 3.47Å; A261-S265 PolarHBondContact O-OG 3.41Å; I262-S265 WeakPolarHBondContact CA-OG 3.22Å; I262-S265 PolarHBondContact O-N 2.62Å; I262-S265 PolarHBondContact O-OG 2.96Å; S265-I268 PolarHBondContact O-N 3.46Å; S265-V269 WeakPolarHBondContact O-CG2 3.5Å; S265-V269 PolarHBondContact O-N 3.03Å |
| 266 | M | 91.8 | Very high | 91.8 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -63.3 | -46.3 | -173.7 | -65.8 | -58.8 | -56.1 | 0 | 0 | 113.9 | M49 V83 A86 W241 I262 V269 T270 | M49-M266 HydrophobicContact CE-CE 3.59Å; M49-M266 HydrophobicContact CE-SD 3.6Å; M49-M266 VanDerWaalsContact CE-SD 3.6Å; M49-M266 HydrophobicContact SD-CE 4.41Å; M49-M266 HydrophobicContact SD-SD 3.6Å; M49-M266 VanDerWaalsContact SD-SD 3.6Å; V83-M266 HydrophobicContact CG2-CB 3.63Å; V83-M266 HydrophobicContact CG2-CE 4.34Å; V83-M266 HydrophobicContact CG2-CG 4.34Å; A86-M266 HydrophobicContact CB-CG 4.22Å; A86-M266 HydrophobicContact CB-SD 4.28Å; W241-M266 HydrophobicContact CB-SD 3.64Å; W241-M266 HydrophobicContact CG-SD 4.19Å; I262-M266 HydrophobicContact CG2-CG 3.93Å; I262-M266 WeakPolarHBondContact O-CB 3.31Å; I262-M266 VanDerWaalsContact O-CG 3.27Å; I262-M266 WeakPolarHBondContact O-CG 3.42Å; I262-M266 PolarHBondContact O-N 3.31Å; M266-V269 PolarHBondContact O-N 3.23Å; M266-T270 WeakPolarHBondContact O-CB 3.41Å; M266-T270 PolarHBondContact O-N 3.12Å; M266-T270 PolarHBondContact O-OG1 3.28Å |
| 267 | P | 91.8 | Very high | 92.2 | Very high | 66 Ų | 66 | 28.9 Ų | 28.9 | 43% | 0.429 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -63.3 | -39.9 | 174.4 | -23.5 | 35.5 | 0 | 0 | 0 | 112.7 | A263 V269 T270 V271 | A263-P267 WeakPolarHBondContact O-CD 3.27Å; A263-P267 VanDerWaalsContact O-CG 3.31Å; A263-P267 WeakPolarHBondContact O-CG 3.06Å; P267-V269 PolarHBondContact O-N 3.05Å; P267-T270 PolarHBondContact O-N 3.37Å; P267-V271 WeakPolarHBondContact O-CG2 3.38Å; P267-V271 PolarHBondContact O-N 3.19Å |
| 268 | I | 91.3 | Very high | 92.5 | Very high | 72 Ų | 72 | 29.1 Ų | 29.1 | 37% | 0.369 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -58.7 | -50.3 | 178.6 | -69.3 | 170.9 | 0 | 0 | 0 | 110.3 | I264 S265 T270 V271 I272 | I264-I268 HydrophobicContact CG2-CD1 3.71Å; I264-I268 VanDerWaalsContact O-CD1 3.27Å; I264-I268 WeakPolarHBondContact O-CD1 3.49Å; I264-I268 VanDerWaalsContact O-CG1 3.24Å; I264-I268 WeakPolarHBondContact O-CG1 3.44Å; S265-I268 PolarHBondContact O-N 3.46Å; I268-T270 VanDerWaalsContact C-N 3.35Å; I268-T270 PolarHBondContact O-N 2.85Å; I268-V271 PolarHBondContact O-N 3.21Å; I268-I272 HydrophobicContact CG2-CD1 3.72Å; I268-I272 VanDerWaalsContact O-CG1 3.28Å; I268-I272 WeakPolarHBondContact O-CG1 3.43Å; I268-I272 PolarHBondContact O-N 3.47Å |
| 269 | V | 92.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.8 | -43.3 | 179.7 | 175.7 | 0 | 0 | 0 | 0 | 111 | V46 M49 I50 Y238 S265 M266 P267 V271 I272 Y273 | V46-V269 HydrophobicContact CG1-CG2 4.48Å; V46-V269 HydrophobicContact CG2-CG2 4.21Å; M49-V269 HydrophobicContact CB-CG1 4.24Å; M49-V269 HydrophobicContact CB-CG2 4.27Å; M49-V269 HydrophobicContact CE-CB 4.25Å; M49-V269 HydrophobicContact CE-CG1 3.85Å; M49-V269 HydrophobicContact CE-CG2 4.48Å; M49-V269 HydrophobicContact SD-CB 4.48Å; M49-V269 HydrophobicContact SD-CG1 4.44Å; M49-V269 HydrophobicContact SD-CG2 4.08Å; I50-V269 HydrophobicContact CD1-CG2 4.28Å; I50-V269 HydrophobicContact CG1-CG1 4.29Å; I50-V269 HydrophobicContact CG1-CG2 4.05Å; Y238-V269 HydrophobicContact CD1-CG1 4.17Å; Y238-V269 HydrophobicContact CE1-CG1 4.15Å; S265-V269 WeakPolarHBondContact O-CG2 3.5Å; S265-V269 PolarHBondContact O-N 3.03Å; M266-V269 PolarHBondContact O-N 3.23Å; P267-V269 PolarHBondContact O-N 3.05Å; V269-V271 PolarHBondContact O-N 3.4Å; V269-I272 PolarHBondContact O-N 3.37Å; V269-Y273 HydrophobicContact CG1-CD1 4.29Å; V269-Y273 HydrophobicContact CG1-CD2 3.88Å; V269-Y273 HydrophobicContact CG1-CE1 3.96Å; V269-Y273 HydrophobicContact CG1-CE2 3.52Å; V269-Y273 HydrophobicContact CG1-CG 4.27Å; V269-Y273 WeakPolarHBondContact O-CB 3.12Å; V269-Y273 PolarHBondContact O-N 3.41Å |
| 270 | T | 93.8 | Very high | 93.1 | Very high | 19 Ų | 19 | 28.3 Ų | 28.3 | 12% | 0.117 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.8 | -46.8 | 178.6 | -55.6 | 0 | 0 | 0 | 0 | 111.6 | M266 P267 I268 Y273 I274 | M266-T270 WeakPolarHBondContact O-CB 3.41Å; M266-T270 PolarHBondContact O-N 3.12Å; M266-T270 PolarHBondContact O-OG1 3.28Å; P267-T270 PolarHBondContact O-N 3.37Å; I268-T270 VanDerWaalsContact C-N 3.35Å; I268-T270 PolarHBondContact O-N 2.85Å; T270-Y273 PolarHBondContact O-N 3.44Å; T270-I274 HydrophobicContact CG2-CD1 3.89Å; T270-I274 VanDerWaalsContact O-CG1 3.32Å; T270-I274 WeakPolarHBondContact O-CG1 3.3Å; T270-I274 PolarHBondContact O-N 3.37Å |
| 271 | V | 94 | Very high | 93.3 | Very high | 83 Ų | 83 | 25.2 Ų | 25.2 | 50% | 0.503 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -63.2 | -45.6 | 177.5 | 170.7 | 0 | 0 | 0 | 0 | 110.9 | P267 I268 V269 Y273 I274 L275 | P267-V271 WeakPolarHBondContact O-CG2 3.38Å; P267-V271 PolarHBondContact O-N 3.19Å; I268-V271 PolarHBondContact O-N 3.21Å; V269-V271 PolarHBondContact O-N 3.4Å; V271-Y273 VanDerWaalsContact C-N 3.32Å; V271-Y273 PolarHBondContact O-N 2.83Å; V271-I274 PolarHBondContact O-N 3.15Å; V271-L275 HydrophobicContact CG1-CD1 3.67Å; V271-L275 HydrophobicContact CG1-CG 4.2Å; V271-L275 WeakPolarHBondContact O-CB 3.12Å; V271-L275 VanDerWaalsContact O-CG 3.25Å; V271-L275 WeakPolarHBondContact O-CG 3.34Å; V271-L275 PolarHBondContact O-N 2.86Å |
| 272 | I | 93.5 | Very high | 93.4 | Very high | 26 Ų | 26 | 25.3 Ų | 25.3 | 13% | 0.133 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -59.2 | -44.8 | 177.9 | -71.2 | 169.6 | 0 | 0 | 0 | 110.7 | I50 L194 I198 I268 V269 L275 T276 | I50-I272 HydrophobicContact CD1-CD1 3.81Å; I50-I272 HydrophobicContact CD1-CG2 4.33Å; L194-I272 HydrophobicContact CB-CG2 4.43Å; L194-I272 HydrophobicContact CD1-CG2 4.09Å; I198-I272 HydrophobicContact CD1-CG2 4.16Å; I268-I272 HydrophobicContact CG2-CD1 3.72Å; I268-I272 VanDerWaalsContact O-CG1 3.28Å; I268-I272 WeakPolarHBondContact O-CG1 3.43Å; I268-I272 PolarHBondContact O-N 3.47Å; V269-I272 PolarHBondContact O-N 3.37Å; I272-L275 PolarHBondContact O-N 3.09Å; I272-T276 VanDerWaalsContact O-CB 3.28Å; I272-T276 WeakPolarHBondContact O-CB 3.32Å; I272-T276 PolarHBondContact O-N 2.89Å; I272-T276 PolarHBondContact O-OG1 3.09Å |
| 273 | Y | 95 | Very high | 93.5 | Very high | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -67.2 | -44 | -179.1 | -72.9 | -2.4 | 0 | 0 | 0 | 112.8 | M49 I50 I54 W75 S237 Y238 V269 T270 V271 T276 N277 | M49-Y273 VanDerWaalsContact C-OH 3.25Å; M49-Y273 PolarHBondContact O-OH 3.36Å; I50-Y273 WeakPolarHBondContact CA-OH 3.28Å; I50-Y273 HydrophobicContact CG1-CE1 4.09Å; I54-Y273 HydrophobicContact CB-CD1 4.14Å; I54-Y273 HydrophobicContact CB-CE1 3.75Å; I54-Y273 HydrophobicContact CD1-CD1 3.61Å; I54-Y273 HydrophobicContact CD1-CD2 4.47Å; I54-Y273 HydrophobicContact CD1-CE1 4.1Å; I54-Y273 HydrophobicContact CD1-CG 3.8Å; I54-Y273 HydrophobicContact CG1-CD1 3.71Å; I54-Y273 HydrophobicContact CG1-CE1 3.86Å; I54-Y273 HydrophobicContact CG1-CG 4.42Å; I54-Y273 HydrophobicContact CG2-CE1 4.32Å; W75-Y273 AromaticContact CE3-CD2 4Å; W75-Y273 HydrophobicContact CE3-CD2 4Å; W75-Y273 HydrophobicContact CE3-CG 4.33Å; W75-Y273 AromaticContact CZ3-CD2 3.48Å; W75-Y273 HydrophobicContact CZ3-CD2 3.48Å; W75-Y273 VanDerWaalsContact CZ3-CD2 3.48Å; W75-Y273 HydrophobicContact CZ3-CE2 4.14Å; W75-Y273 AromaticContact CZ3-CG 3.93Å; W75-Y273 HydrophobicContact CZ3-CG 3.93Å; S237-Y273 VanDerWaalsContact O-CE2 3.26Å; S237-Y273 WeakPolarHBondContact O-CE2 3.49Å; S237-Y273 PolarHBondContact O-OH 3.01Å; Y238-Y273 AromaticContact CD1-CD2 3.86Å; Y238-Y273 HydrophobicContact CD1-CD2 3.86Å; Y238-Y273 AromaticContact CD1-CE2 3.84Å; Y238-Y273 HydrophobicContact CD1-CE2 3.84Å; Y238-Y273 HydrophobicContact CD2-CD2 4.42Å; Y238-Y273 AromaticContact CE1-CD2 3.45Å; Y238-Y273 HydrophobicContact CE1-CD2 3.45Å; Y238-Y273 VanDerWaalsContact CE1-CD2 3.45Å; Y238-Y273 AromaticContact CE1-CE2 3.91Å; Y238-Y273 HydrophobicContact CE1-CE2 3.91Å; Y238-Y273 HydrophobicContact CE1-CG 4.43Å; Y238-Y273 HydrophobicContact CE2-CD2 4.07Å; Y238-Y273 HydrophobicContact CG-CD2 4.34Å; Y238-Y273 HydrophobicContact CG-CE2 4.21Å; Y238-Y273 AromaticContact CZ-CD2 3.57Å; V269-Y273 HydrophobicContact CG1-CD1 4.29Å; V269-Y273 HydrophobicContact CG1-CD2 3.88Å; V269-Y273 HydrophobicContact CG1-CE1 3.96Å; V269-Y273 HydrophobicContact CG1-CE2 3.52Å; V269-Y273 HydrophobicContact CG1-CG 4.27Å; V269-Y273 WeakPolarHBondContact O-CB 3.12Å; V269-Y273 PolarHBondContact O-N 3.41Å; T270-Y273 PolarHBondContact O-N 3.44Å; V271-Y273 VanDerWaalsContact C-N 3.32Å; V271-Y273 PolarHBondContact O-N 2.83Å; Y273-T276 PolarHBondContact O-N 3.33Å; Y273-N277 PolarHBondContact O-N 3.42Å; Y273-N277 PolarHBondContact O-ND2 2.87Å |
| 274 | I | 95.6 | Very high | 93.7 | Very high | 42 Ų | 42 | 23.6 Ų | 23.6 | 22% | 0.215 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -61.4 | -49.5 | 176 | -67.9 | 169.9 | 0 | 0 | 0 | 109.9 | W75 T76 T270 V271 T276 N277 V278 | W75-I274 HydrophobicContact CB-CG1 4.45Å; T76-I274 HydrophobicContact CG2-CD1 4.5Å; T76-I274 WeakPolarHBondContact OG1-CD1 3.24Å; T270-I274 HydrophobicContact CG2-CD1 3.89Å; T270-I274 VanDerWaalsContact O-CG1 3.32Å; T270-I274 WeakPolarHBondContact O-CG1 3.3Å; T270-I274 PolarHBondContact O-N 3.37Å; V271-I274 PolarHBondContact O-N 3.15Å; I274-T276 VanDerWaalsContact C-N 3.3Å; I274-T276 PolarHBondContact O-N 3.47Å; I274-N277 PolarHBondContact O-N 3.46Å; I274-V278 HydrophobicContact CG2-CG2 4.4Å; I274-V278 WeakPolarHBondContact O-CG2 3.48Å; I274-V278 PolarHBondContact O-N 3Å |
| 275 | L | 95.8 | Very high | 93.8 | Very high | 59 Ų | 59 | 23 Ų | 23 | 31% | 0.309 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -63.8 | -35 | -179.8 | -69.9 | 178.5 | 0 | 0 | 0 | 112.7 | I198 V271 I272 V278 A279 | I198-L275 HydrophobicContact CD1-CB 3.96Å; I198-L275 HydrophobicContact CG1-CB 3.9Å; I198-L275 HydrophobicContact CG2-CB 3.93Å; I198-L275 HydrophobicContact CG2-CD1 4.05Å; V271-L275 HydrophobicContact CG1-CD1 3.67Å; V271-L275 HydrophobicContact CG1-CG 4.2Å; V271-L275 WeakPolarHBondContact O-CB 3.12Å; V271-L275 VanDerWaalsContact O-CG 3.25Å; V271-L275 WeakPolarHBondContact O-CG 3.34Å; V271-L275 PolarHBondContact O-N 2.86Å; I272-L275 PolarHBondContact O-N 3.09Å; L275-V278 PolarHBondContact O-N 3.27Å; L275-A279 WeakPolarHBondContact O-CB 3.49Å; L275-A279 PolarHBondContact O-N 2.72Å |
| 276 | T | 94.9 | Very high | 93.8 | Very high | 0 Ų | 0 | 25.4 Ų | 25.4 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -65.2 | -43.7 | 175.5 | -58.2 | 0 | 0 | 0 | 0 | 111 | I54 L194 V197 I272 Y273 I274 A279 Y280 | I54-T276 HydrophobicContact CG1-CG2 4.16Å; L194-T276 HydrophobicContact CD2-CG2 3.95Å; V197-T276 HydrophobicContact CG1-CG2 4.24Å; I272-T276 VanDerWaalsContact O-CB 3.28Å; I272-T276 WeakPolarHBondContact O-CB 3.32Å; I272-T276 PolarHBondContact O-N 2.89Å; I272-T276 PolarHBondContact O-OG1 3.09Å; Y273-T276 PolarHBondContact O-N 3.33Å; I274-T276 VanDerWaalsContact C-N 3.3Å; I274-T276 PolarHBondContact O-N 3.47Å; T276-A279 WeakPolarHBondContact O-CB 3.33Å; T276-A279 PolarHBondContact O-N 3.22Å; T276-Y280 HydrophobicContact CG2-CD2 4.27Å; T276-Y280 HydrophobicContact CG2-CE1 4.39Å; T276-Y280 HydrophobicContact CG2-CE2 3.64Å; T276-Y280 PolarHBondContact O-N 2.91Å |
| 277 | N | 95.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -66.9 | -40.3 | 176.2 | -77 | -80.1 | 0 | 0 | 0 | 111.8 | P58 L72 W75 Y273 I274 A279 Y280 Y281 | P58-N277 WeakPolarHBondContact CB-OD1 3.21Å; L72-N277 HydrophobicContact CD2-CB 3.85Å; W75-N277 PolarHBondContact NE1-ND2 3.39Å; W75-N277 PolarHBondContact NE1-OD1 2.91Å; Y273-N277 PolarHBondContact O-N 3.42Å; Y273-N277 PolarHBondContact O-ND2 2.87Å; I274-N277 PolarHBondContact O-N 3.46Å; N277-A279 VanDerWaalsContact C-N 3.29Å; N277-A279 PolarHBondContact O-N 3.33Å; N277-Y280 PolarHBondContact O-N 3.42Å; N277-Y281 HydrophobicContact CB-CE2 4.03Å; N277-Y281 WeakPolarHBondContact O-CD2 3.34Å; N277-Y281 PolarHBondContact O-N 2.83Å; N277-Y281 PolarHBondContact OD1-OH 3.2Å |
| 278 | V | 95.6 | Very high | 93.7 | Very high | 28 Ų | 28 | 28.8 Ų | 28.8 | 17% | 0.17 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -57.8 | -43.8 | 172.4 | 170.2 | 0 | 0 | 0 | 0 | 110.6 | L72 I205 F213 I274 L275 Y281 T282 | L72-V278 HydrophobicContact CD1-CG2 4.06Å; L72-V278 HydrophobicContact CD2-CG2 3.92Å; I205-V278 HydrophobicContact CD1-CG1 3.79Å; F213-V278 HydrophobicContact CZ-CG1 4.12Å; I274-V278 HydrophobicContact CG2-CG2 4.4Å; I274-V278 WeakPolarHBondContact O-CG2 3.48Å; I274-V278 PolarHBondContact O-N 3Å; L275-V278 PolarHBondContact O-N 3.27Å; V278-Y281 PolarHBondContact O-N 3.3Å; V278-T282 WeakPolarHBondContact O-CB 3.47Å; V278-T282 PolarHBondContact O-N 3.31Å; V278-T282 PolarHBondContact O-OG1 3.17Å |
| 279 | A | 95.1 | Very high | 93.8 | Very high | 2 Ų | 2 | 25.3 Ų | 25.3 | 2% | 0.017 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -60.5 | -46.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V197 L275 T276 N277 Y281 T282 F299 | V197-A279 HydrophobicContact CG1-CB 3.97Å; V197-A279 WeakPolarHBondContact O-CB 3.5Å; L275-A279 WeakPolarHBondContact O-CB 3.49Å; L275-A279 PolarHBondContact O-N 2.72Å; T276-A279 WeakPolarHBondContact O-CB 3.33Å; T276-A279 PolarHBondContact O-N 3.22Å; N277-A279 VanDerWaalsContact C-N 3.29Å; N277-A279 PolarHBondContact O-N 3.33Å; A279-Y281 PolarHBondContact O-N 3.21Å; A279-T282 WeakPolarHBondContact O-CB 3.49Å; A279-T282 PolarHBondContact O-N 3.23Å; A279-F299 HydrophobicContact CB-CE2 4.47Å; A279-F299 HydrophobicContact CB-CZ 4.48Å; A279-F299 WeakPolarHBondContact O-CE2 3.22Å |
| 280 | Y | 94.6 | Very high | 93.7 | Very high | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -59.1 | -46.7 | 175.8 | -66.3 | -28.6 | 0 | 0 | 0 | 112.3 | P58 V197 T276 N277 T282 V283 L284 V295 A296 F299 | P58-Y280 HydrophobicContact CB-CD2 4.34Å; P58-Y280 HydrophobicContact CG-CD2 4.23Å; P58-Y280 HydrophobicContact CG-CE2 4.05Å; V197-Y280 HydrophobicContact CG1-CD1 4.28Å; V197-Y280 HydrophobicContact CG1-CE1 3.78Å; T276-Y280 HydrophobicContact CG2-CD2 4.27Å; T276-Y280 HydrophobicContact CG2-CE1 4.39Å; T276-Y280 HydrophobicContact CG2-CE2 3.64Å; T276-Y280 PolarHBondContact O-N 2.91Å; N277-Y280 PolarHBondContact O-N 3.42Å; Y280-T282 VanDerWaalsContact C-N 3.29Å; Y280-T282 PolarHBondContact O-N 2.73Å; Y280-V283 PolarHBondContact O-N 3.42Å; Y280-L284 WeakPolarHBondContact O-CB 3.42Å; Y280-L284 PolarHBondContact O-N 3.03Å; Y280-V295 HydrophobicContact CD1-CG1 4.38Å; Y280-V295 HydrophobicContact CD2-CG1 3.95Å; Y280-V295 HydrophobicContact CE2-CG1 4.17Å; Y280-V295 HydrophobicContact CG-CG1 4.07Å; Y280-A296 HydrophobicContact CE1-CB 4.24Å; Y280-A296 VanDerWaalsContact OH-CB 3.24Å; Y280-A296 WeakPolarHBondContact OH-CB 3.33Å; Y280-F299 HydrophobicContact CD1-CB 3.86Å; Y280-F299 AromaticContact CD1-CD2 3.8Å; Y280-F299 HydrophobicContact CD1-CD2 3.8Å; Y280-F299 HydrophobicContact CD1-CE2 4.48Å; Y280-F299 AromaticContact CD1-CG 3.83Å; Y280-F299 HydrophobicContact CD1-CG 3.83Å; Y280-F299 HydrophobicContact CE1-CB 3.96Å; Y280-F299 HydrophobicContact CE1-CD1 4.45Å; Y280-F299 HydrophobicContact CE1-CD2 4.45Å; Y280-F299 HydrophobicContact CE1-CG 4.04Å |
| 281 | Y | 94.5 | Very high | 93.5 | Very high | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -70.7 | -24.9 | -177.4 | -56.8 | -20.7 | 0 | 0 | 0 | 113.2 | L62 Y68 S71 L72 N212 N277 V278 A279 V283 I289 | L62-Y281 HydrophobicContact CD2-CE1 4.4Å; Y68-Y281 AromaticContact CD1-CD1 3.52Å; Y68-Y281 HydrophobicContact CD1-CD1 3.52Å; Y68-Y281 AromaticContact CD1-CD2 3.75Å; Y68-Y281 HydrophobicContact CD1-CD2 3.75Å; Y68-Y281 AromaticContact CD1-CE1 3.85Å; Y68-Y281 HydrophobicContact CD1-CE1 3.85Å; Y68-Y281 HydrophobicContact CD1-CE2 4.04Å; Y68-Y281 AromaticContact CD1-CG 3.48Å; Y68-Y281 HydrophobicContact CD1-CG 3.48Å; Y68-Y281 VanDerWaalsContact CD1-CG 3.48Å; Y68-Y281 AromaticContact CE1-CD1 3.54Å; Y68-Y281 HydrophobicContact CE1-CD1 3.54Å; Y68-Y281 HydrophobicContact CE1-CE1 4.06Å; Y68-Y281 AromaticContact CE1-CG 3.84Å; Y68-Y281 HydrophobicContact CE1-CG 3.84Å; Y68-Y281 HydrophobicContact CG-CD1 4.43Å; Y68-Y281 HydrophobicContact CG-CD2 4.01Å; Y68-Y281 AromaticContact CG-CG 3.96Å; Y68-Y281 HydrophobicContact CG-CG 3.96Å; S71-Y281 WeakPolarHBondContact CB-OH 3.43Å; S71-Y281 PolarHBondContact OG-OH 3.12Å; L72-Y281 HydrophobicContact CD2-CD2 4.23Å; L72-Y281 HydrophobicContact CD2-CE2 3.94Å; L72-Y281 HydrophobicContact CG-CD2 4.27Å; L72-Y281 HydrophobicContact CG-CE2 4.03Å; N212-Y281 WeakPolarHBondContact CB-O 3.31Å; N212-Y281 PolarHBondContact ND2-O 3.35Å; N277-Y281 HydrophobicContact CB-CE2 4.03Å; N277-Y281 WeakPolarHBondContact O-CD2 3.34Å; N277-Y281 PolarHBondContact O-N 2.83Å; N277-Y281 PolarHBondContact OD1-OH 3.2Å; V278-Y281 PolarHBondContact O-N 3.3Å; A279-Y281 PolarHBondContact O-N 3.21Å; Y281-V283 VanDerWaalsContact C-N 3.28Å; Y281-V283 PolarHBondContact O-N 3.39Å; Y281-I289 HydrophobicContact CD1-CD1 3.48Å; Y281-I289 VanDerWaalsContact CD1-CD1 3.48Å; Y281-I289 HydrophobicContact CE1-CD1 3.6Å |
| 282 | T | 94 | Very high | 93.3 | Very high | 4 Ų | 4 | 29.5 Ų | 29.5 | 3% | 0.025 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -63.3 | -37.3 | 173.5 | -56.9 | 0 | 0 | 0 | 0 | 111.5 | K204 I205 Y209 F213 V278 A279 Y280 | K204-T282 HydrophobicContact CB-CG2 3.75Å; I205-T282 HydrophobicContact CG1-CG2 3.57Å; I205-T282 WeakPolarHBondContact CG1-OG1 3.44Å; Y209-T282 VanDerWaalsContact O-CG2 3.26Å; Y209-T282 WeakPolarHBondContact O-CG2 3.19Å; F213-T282 WeakPolarHBondContact CE2-OG1 3.36Å; V278-T282 WeakPolarHBondContact O-CB 3.47Å; V278-T282 PolarHBondContact O-N 3.31Å; V278-T282 PolarHBondContact O-OG1 3.17Å; A279-T282 WeakPolarHBondContact O-CB 3.49Å; A279-T282 PolarHBondContact O-N 3.23Å; Y280-T282 VanDerWaalsContact C-N 3.29Å; Y280-T282 PolarHBondContact O-N 2.73Å |
| 283 | V | 92.4 | Very high | 92.9 | Very high | 20 Ų | 20 | 32.1 Ų | 32.1 | 12% | 0.121 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -103.3 | -42.5 | -170.3 | 174.5 | 0 | 0 | 0 | 0 | 111.9 | K204 Y280 Y281 F299 Q302 V303 | K204-V283 HydrophobicContact CB-CG2 4.39Å; K204-V283 HydrophobicContact CG-CG2 4.09Å; Y280-V283 PolarHBondContact O-N 3.42Å; Y281-V283 VanDerWaalsContact C-N 3.28Å; Y281-V283 PolarHBondContact O-N 3.39Å; V283-F299 HydrophobicContact CB-CD2 3.81Å; V283-F299 HydrophobicContact CB-CE2 3.72Å; V283-F299 HydrophobicContact CG1-CD2 4.09Å; V283-F299 HydrophobicContact CG1-CE2 4.27Å; V283-F299 HydrophobicContact CG2-CD2 4.09Å; V283-F299 HydrophobicContact CG2-CE2 3.46Å; V283-F299 VanDerWaalsContact CG2-CE2 3.46Å; V283-F299 HydrophobicContact CG2-CZ 4.29Å; V283-Q302 HydrophobicContact CG1-CB 3.84Å; V283-Q302 VanDerWaalsContact CG1-OE1 3.27Å; V283-Q302 PolarHBondContact O-OE1 3.31Å; V283-V303 HydrophobicContact CB-CG2 4.48Å; V283-V303 HydrophobicContact CG1-CG2 3.71Å; V283-V303 HydrophobicContact CG2-CG2 3.99Å |
| 284 | L | 92.7 | Very high | 92.6 | Very high | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 18% | 0.18 | C | C | . | . | S | Bend | trans | -99.9 | 130.7 | -171.7 | -58.5 | 179.1 | 0 | 0 | 0 | 111.3 | Y68 N212 Y280 I289 V295 T298 F299 Q302 | Y68-L284 PolarHBondContact OH-O 3.23Å; N212-L284 PolarHBondContact ND2-O 2.76Å; Y280-L284 WeakPolarHBondContact O-CB 3.42Å; Y280-L284 PolarHBondContact O-N 3.03Å; L284-I289 HydrophobicContact CB-CD1 4.02Å; L284-I289 HydrophobicContact CB-CG1 3.67Å; L284-I289 HydrophobicContact CD1-CG1 4Å; L284-V295 HydrophobicContact CD1-CG1 3.98Å; L284-T298 HydrophobicContact CD1-CG2 4.41Å; L284-T298 HydrophobicContact CD2-CG2 3.99Å; L284-F299 HydrophobicContact CD1-CB 4.05Å; L284-Q302 VanDerWaalsContact CD2-CD 3.5Å; L284-Q302 HydrophobicContact CD2-CG 4.29Å |
| 285 | P | 92.8 | Very high | 92.4 | Very high | 61 Ų | 61 | 30.2 Ų | 30.2 | 40% | 0.396 | 17% | 0.17 | S | C | . | . | trans | -71.5 | 161 | 167.6 | 30.8 | -34.7 | 0 | 0 | 0 | 111.5 | Y68 N287 A288 I289 | Y68-P285 WeakPolarHBondContact OH-CA 3.34Å; P285-N287 VanDerWaalsContact C-N 3.31Å; P285-N287 PolarHBondContact O-N 3.25Å; P285-A288 HydrophobicContact CG-CB 3.81Å; P285-A288 WeakPolarHBondContact O-CB 3.37Å; P285-A288 PolarHBondContact O-N 3.43Å; P285-I289 PolarHBondContact O-N 2.89Å | ||
| 286 | I | 91.3 | Very high | 92.1 | Very high | 52 Ų | 52 | 27.4 Ų | 27.4 | 27% | 0.267 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -52.7 | -50.7 | -173.4 | -67.6 | 179.1 | 0 | 0 | 0 | 110.3 | L62 Y68 A288 I289 L290 | L62-I286 HydrophobicContact CD2-CB 4.45Å; L62-I286 HydrophobicContact CD2-CG1 4.43Å; L62-I286 HydrophobicContact CD2-CG2 4.05Å; L62-I286 HydrophobicContact CG-CG2 4.39Å; Y68-I286 HydrophobicContact CD1-CG1 4.11Å; Y68-I286 HydrophobicContact CE1-CB 4.41Å; Y68-I286 HydrophobicContact CE1-CD1 4.29Å; Y68-I286 HydrophobicContact CE1-CG1 3.37Å; Y68-I286 HydrophobicContact CE2-CD1 4.4Å; Y68-I286 HydrophobicContact CE2-CG1 3.9Å; Y68-I286 WeakPolarHBondContact OH-CG1 3.44Å; Y68-I286 PolarHBondContact OH-N 3.16Å; I286-A288 VanDerWaalsContact C-N 3.28Å; I286-A288 PolarHBondContact O-N 3.43Å; I286-I289 WeakPolarHBondContact O-CB 3.27Å; I286-I289 PolarHBondContact O-N 2.84Å; I286-L290 HydrophobicContact CG2-CD1 3.63Å; I286-L290 HydrophobicContact CG2-CG 4.02Å; I286-L290 WeakPolarHBondContact O-CG 3.4Å; I286-L290 PolarHBondContact O-N 3.16Å |
| 287 | N | 91.3 | Very high | 91.8 | Very high | 112 Ų | 112 | 27.5 Ų | 27.5 | 60% | 0.599 | 16% | 0.155 | S | C | * | . | H | α-helix | trans | -59.4 | -37.9 | -177.9 | -61.6 | -20.6 | 0 | 0 | 0 | 112.4 | P285 I289 L290 D291 | P285-N287 VanDerWaalsContact C-N 3.31Å; P285-N287 PolarHBondContact O-N 3.25Å; N287-I289 VanDerWaalsContact C-N 3.29Å; N287-I289 PolarHBondContact O-N 3.44Å; N287-L290 PolarHBondContact O-N 3.45Å; N287-D291 WeakPolarHBondContact O-CB 3.37Å; N287-D291 VanDerWaalsContact O-CG 3.27Å; N287-D291 PolarHBondContact O-N 2.84Å |
| 288 | A | 91.5 | Very high | 91.6 | Very high | 24 Ų | 24 | 28.7 Ų | 28.7 | 20% | 0.198 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -66.7 | -31.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | P285 I286 S292 | P285-A288 HydrophobicContact CG-CB 3.81Å; P285-A288 WeakPolarHBondContact O-CB 3.37Å; P285-A288 PolarHBondContact O-N 3.43Å; I286-A288 VanDerWaalsContact C-N 3.28Å; I286-A288 PolarHBondContact O-N 3.43Å; A288-S292 WeakPolarHBondContact O-CB 3.45Å; A288-S292 PolarHBondContact O-N 3.28Å |
| 289 | I | 92.5 | Very high | 91.4 | Very high | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -74.2 | -41.1 | 174.8 | -60 | 179.1 | 0 | 0 | 0 | 110.4 | L62 Y68 Y281 L284 P285 I286 N287 S292 V295 | L62-I289 HydrophobicContact CD2-CB 3.94Å; L62-I289 HydrophobicContact CD2-CD1 4.04Å; L62-I289 HydrophobicContact CD2-CG2 3.86Å; Y68-I289 HydrophobicContact CE1-CD1 4.29Å; Y281-I289 HydrophobicContact CD1-CD1 3.48Å; Y281-I289 VanDerWaalsContact CD1-CD1 3.48Å; Y281-I289 HydrophobicContact CE1-CD1 3.6Å; L284-I289 HydrophobicContact CB-CD1 4.02Å; L284-I289 HydrophobicContact CB-CG1 3.67Å; L284-I289 HydrophobicContact CD1-CG1 4Å; P285-I289 PolarHBondContact O-N 2.89Å; I286-I289 WeakPolarHBondContact O-CB 3.27Å; I286-I289 PolarHBondContact O-N 2.84Å; N287-I289 VanDerWaalsContact C-N 3.29Å; N287-I289 PolarHBondContact O-N 3.44Å; I289-S292 PolarHBondContact O-N 2.83Å; I289-V295 HydrophobicContact CG1-CG1 4.49Å; I289-V295 HydrophobicContact CG2-CG1 4.23Å; I289-V295 HydrophobicContact CG2-CG2 4.08Å |
| 290 | L | 91.8 | Very high | 91.1 | Very high | 49 Ų | 49 | 27.3 Ų | 27.3 | 26% | 0.257 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -69.3 | -38.3 | -179 | -63.3 | -177.9 | 0 | 0 | 0 | 112.4 | K59 L62 I63 I286 N287 S292 | K59-L290 WeakPolarHBondContact CE-O 3.45Å; K59-L290 PolarHBondContact NZ-O 3.27Å; L62-L290 HydrophobicContact CB-CD2 4.28Å; L62-L290 HydrophobicContact CD2-CD2 4.4Å; L62-L290 HydrophobicContact CG-CD2 4.34Å; I63-L290 HydrophobicContact CB-CD2 4.38Å; I63-L290 HydrophobicContact CG1-CD2 3.5Å; I286-L290 HydrophobicContact CG2-CD1 3.63Å; I286-L290 HydrophobicContact CG2-CG 4.02Å; I286-L290 WeakPolarHBondContact O-CG 3.4Å; I286-L290 PolarHBondContact O-N 3.16Å; N287-L290 PolarHBondContact O-N 3.45Å; L290-S292 VanDerWaalsContact C-N 3.32Å |
| 291 | D | 89.6 | Confident | 90.8 | Very high | 135 Ų | 135 | 30.7 Ų | 30.7 | 72% | 0.722 | 17% | 0.172 | S | C | * | . | H | α-helix | trans | -78.4 | -18 | 179.6 | -67.2 | -21.5 | 0 | 0 | 0 | 112.7 | N287 | N287-D291 WeakPolarHBondContact O-CB 3.37Å; N287-D291 VanDerWaalsContact O-CG 3.27Å; N287-D291 PolarHBondContact O-N 2.84Å |
| 292 | S | 88.4 | Confident | 90.5 | Very high | 6 Ų | 6 | 35.5 Ų | 35.5 | 4% | 0.042 | 20% | 0.195 | C | C | . | . | trans | -88.2 | 124.6 | -174.8 | 168.4 | 0 | 0 | 0 | 0 | 112.6 | K59 A288 I289 L290 A294 V295 T298 | K59-S292 VanDerWaalsContact CD-O 3.24Å; K59-S292 WeakPolarHBondContact CD-O 3.25Å; K59-S292 PolarHBondContact NZ-O 3.29Å; A288-S292 WeakPolarHBondContact O-CB 3.45Å; A288-S292 PolarHBondContact O-N 3.28Å; I289-S292 PolarHBondContact O-N 2.83Å; L290-S292 VanDerWaalsContact C-N 3.32Å; S292-A294 VanDerWaalsContact C-N 3.33Å; S292-A294 PolarHBondContact OG-N 2.9Å; S292-A294 PolarHBondContact OG-O 3.14Å; S292-V295 WeakPolarHBondContact OG-CA 3.29Å; S292-V295 PolarHBondContact OG-N 3.14Å; S292-T298 WeakPolarHBondContact CB-OG1 3.32Å; S292-T298 PolarHBondContact OG-OG1 3.11Å | ||
| 293 | D | 84.8 | Confident | 90.2 | Very high | 81 Ų | 81 | 37.2 Ų | 37.2 | 43% | 0.433 | 21% | 0.205 | S | C | . | . | S | Bend | trans | -82.4 | -11.2 | 171.9 | -69.4 | -29.1 | 0 | 0 | 0 | 113.9 | K59 | K59-D293 IonicContact NZ-OD1 2.83Å; K59-D293 PolarHBondContact NZ-OD1 2.68Å |
| 294 | A | 89.3 | Confident | 89.8 | Confident | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 21% | 0.207 | C | C | . | . | S | Bend | trans | -137.9 | 76.6 | 177 | 0 | 0 | 0 | 0 | 0 | 110.9 | Y141 Q144 S292 A296 V297 T298 | Y141-A294 HydrophobicContact CD1-CB 4.05Å; Y141-A294 HydrophobicContact CD2-CB 3.89Å; Y141-A294 HydrophobicContact CE1-CB 3.89Å; Y141-A294 HydrophobicContact CE2-CB 3.74Å; Y141-A294 HydrophobicContact CG-CB 4.06Å; Q144-A294 HydrophobicContact CB-CB 4.11Å; Q144-A294 HydrophobicContact CG-CB 4.1Å; S292-A294 VanDerWaalsContact C-N 3.33Å; S292-A294 PolarHBondContact OG-N 2.9Å; S292-A294 PolarHBondContact OG-O 3.14Å; A294-A296 PolarHBondContact O-N 3.23Å; A294-A296 VanDerWaalsContact O-N 3.1Å; A294-V297 HydrophobicContact CB-CB 4.14Å; A294-V297 HydrophobicContact CB-CG2 3.9Å; A294-V297 WeakPolarHBondContact O-CB 3.4Å; A294-V297 PolarHBondContact O-N 2.9Å; A294-T298 PolarHBondContact O-N 3.11Å; A294-T298 PolarHBondContact O-OG1 2.87Å |
| 295 | V | 91.1 | Very high | 89.4 | Confident | 1 Ų | 1 | 40.2 Ų | 40.2 | 1% | 0.006 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -53 | -39 | -170.6 | -178.6 | 0 | 0 | 0 | 0 | 112.9 | K59 Y141 Y280 L284 I289 S292 V297 T298 F299 | K59-V295 HydrophobicContact CB-CG2 4.29Å; Y141-V295 PolarHBondContact OH-N 3.26Å; Y280-V295 HydrophobicContact CD1-CG1 4.38Å; Y280-V295 HydrophobicContact CD2-CG1 3.95Å; Y280-V295 HydrophobicContact CE2-CG1 4.17Å; Y280-V295 HydrophobicContact CG-CG1 4.07Å; L284-V295 HydrophobicContact CD1-CG1 3.98Å; I289-V295 HydrophobicContact CG1-CG1 4.49Å; I289-V295 HydrophobicContact CG2-CG1 4.23Å; I289-V295 HydrophobicContact CG2-CG2 4.08Å; S292-V295 WeakPolarHBondContact OG-CA 3.29Å; S292-V295 PolarHBondContact OG-N 3.14Å; V295-V297 VanDerWaalsContact C-N 3.34Å; V295-V297 PolarHBondContact O-N 3.1Å; V295-T298 PolarHBondContact O-N 2.69Å; V295-F299 WeakPolarHBondContact O-CB 3.24Å; V295-F299 PolarHBondContact O-N 3Å |
| 296 | A | 90.1 | Very high | 88.8 | Confident | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -70.2 | -29.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | F55 Y141 Y280 A294 A300 I311 | F55-A296 HydrophobicContact CD1-CB 3.82Å; F55-A296 HydrophobicContact CE1-CB 4.09Å; Y141-A296 HydrophobicContact CE1-CB 3.93Å; Y141-A296 PolarHBondContact OH-N 3.45Å; Y280-A296 HydrophobicContact CE1-CB 4.24Å; Y280-A296 VanDerWaalsContact OH-CB 3.24Å; Y280-A296 WeakPolarHBondContact OH-CB 3.33Å; A294-A296 PolarHBondContact O-N 3.23Å; A294-A296 VanDerWaalsContact O-N 3.1Å; A296-A300 WeakPolarHBondContact O-CB 3.29Å; A296-A300 PolarHBondContact O-N 2.78Å; A296-I311 HydrophobicContact CB-CG2 3.83Å |
| 297 | V | 89.4 | Confident | 88.2 | Confident | 2 Ų | 2 | 46.6 Ų | 46.6 | 1% | 0.012 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -70.1 | -46.2 | 174.4 | -178.8 | 0 | 0 | 0 | 0 | 109.4 | Y141 Q144 A294 V295 F299 A300 D301 P312 | Y141-V297 HydrophobicContact CD1-CG2 3.54Å; Y141-V297 HydrophobicContact CE1-CG2 3.71Å; Q144-V297 HydrophobicContact CB-CG1 4.37Å; Q144-V297 HydrophobicContact CG-CB 4.15Å; Q144-V297 HydrophobicContact CG-CG1 3.85Å; A294-V297 HydrophobicContact CB-CB 4.14Å; A294-V297 HydrophobicContact CB-CG2 3.9Å; A294-V297 WeakPolarHBondContact O-CB 3.4Å; A294-V297 PolarHBondContact O-N 2.9Å; V295-V297 VanDerWaalsContact C-N 3.34Å; V295-V297 PolarHBondContact O-N 3.1Å; V297-F299 VanDerWaalsContact C-N 3.29Å; V297-F299 PolarHBondContact O-N 2.8Å; V297-A300 CarbonylContact O-C 3.48Å; V297-A300 WeakPolarHBondContact O-CA 3.29Å; V297-A300 WeakPolarHBondContact O-CB 3.2Å; V297-A300 PolarHBondContact O-N 3.05Å; V297-D301 PolarHBondContact O-N 3.49Å; V297-P312 HydrophobicContact CG2-CB 3.76Å; V297-P312 HydrophobicContact CG2-CG 4.29Å |
| 298 | T | 90.3 | Very high | 87.7 | Confident | 26 Ų | 26 | 43.9 Ų | 43.9 | 16% | 0.16 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -59.3 | -40.3 | 176.3 | -52.6 | 0 | 0 | 0 | 0 | 112 | L284 S292 A294 V295 A300 | L284-T298 HydrophobicContact CD1-CG2 4.41Å; L284-T298 HydrophobicContact CD2-CG2 3.99Å; S292-T298 WeakPolarHBondContact CB-OG1 3.32Å; S292-T298 PolarHBondContact OG-OG1 3.11Å; A294-T298 PolarHBondContact O-N 3.11Å; A294-T298 PolarHBondContact O-OG1 2.87Å; V295-T298 PolarHBondContact O-N 2.69Å; T298-A300 VanDerWaalsContact C-N 3.34Å |
| 299 | F | 91.6 | Very high | 87.3 | Confident | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -60.7 | -44.5 | 170.2 | 176 | -93.7 | 0 | 0 | 0 | 111.5 | V197 T200 A279 Y280 V283 L284 V295 V297 D301 Q302 V303 F304 | V197-F299 HydrophobicContact CB-CE1 4.26Å; V197-F299 HydrophobicContact CG1-CD1 4.24Å; V197-F299 HydrophobicContact CG1-CE1 3.88Å; V197-F299 HydrophobicContact CG1-CZ 4.17Å; V197-F299 HydrophobicContact CG2-CD1 4.27Å; V197-F299 HydrophobicContact CG2-CE1 4.16Å; T200-F299 HydrophobicContact CG2-CE1 4.19Å; T200-F299 HydrophobicContact CG2-CZ 3.94Å; A279-F299 HydrophobicContact CB-CE2 4.47Å; A279-F299 HydrophobicContact CB-CZ 4.48Å; A279-F299 WeakPolarHBondContact O-CE2 3.22Å; Y280-F299 HydrophobicContact CD1-CB 3.86Å; Y280-F299 AromaticContact CD1-CD2 3.8Å; Y280-F299 HydrophobicContact CD1-CD2 3.8Å; Y280-F299 HydrophobicContact CD1-CE2 4.48Å; Y280-F299 AromaticContact CD1-CG 3.83Å; Y280-F299 HydrophobicContact CD1-CG 3.83Å; Y280-F299 HydrophobicContact CE1-CB 3.96Å; Y280-F299 HydrophobicContact CE1-CD1 4.45Å; Y280-F299 HydrophobicContact CE1-CD2 4.45Å; Y280-F299 HydrophobicContact CE1-CG 4.04Å; V283-F299 HydrophobicContact CB-CD2 3.81Å; V283-F299 HydrophobicContact CB-CE2 3.72Å; V283-F299 HydrophobicContact CG1-CD2 4.09Å; V283-F299 HydrophobicContact CG1-CE2 4.27Å; V283-F299 HydrophobicContact CG2-CD2 4.09Å; V283-F299 HydrophobicContact CG2-CE2 3.46Å; V283-F299 VanDerWaalsContact CG2-CE2 3.46Å; V283-F299 HydrophobicContact CG2-CZ 4.29Å; L284-F299 HydrophobicContact CD1-CB 4.05Å; V295-F299 WeakPolarHBondContact O-CB 3.24Å; V295-F299 PolarHBondContact O-N 3Å; V297-F299 VanDerWaalsContact C-N 3.29Å; V297-F299 PolarHBondContact O-N 2.8Å; F299-D301 PolarHBondContact O-N 2.92Å; F299-Q302 PolarHBondContact O-N 3.38Å; F299-V303 HydrophobicContact CE2-CG2 4.43Å; F299-V303 HydrophobicContact CZ-CG2 4.35Å; F299-V303 PolarHBondContact O-N 3.35Å; F299-F304 HydrophobicContact CD1-CE2 4.37Å; F299-F304 AromaticContact CE1-CE2 3.95Å; F299-F304 HydrophobicContact CE1-CE2 3.95Å |
| 300 | A | 89.5 | Confident | 87 | Confident | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -67.3 | -37.6 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | A296 V297 T298 Q302 V303 F304 N308 I311 | A296-A300 WeakPolarHBondContact O-CB 3.29Å; A296-A300 PolarHBondContact O-N 2.78Å; V297-A300 CarbonylContact O-C 3.48Å; V297-A300 WeakPolarHBondContact O-CA 3.29Å; V297-A300 WeakPolarHBondContact O-CB 3.2Å; V297-A300 PolarHBondContact O-N 3.05Å; T298-A300 VanDerWaalsContact C-N 3.34Å; A300-Q302 PolarHBondContact O-N 2.91Å; A300-V303 PolarHBondContact O-N 3.31Å; A300-F304 HydrophobicContact CB-CD2 3.96Å; A300-F304 PolarHBondContact O-N 3.47Å; A300-N308 HydrophobicContact CB-CB 4.49Å; A300-I311 HydrophobicContact CB-CB 3.86Å; A300-I311 HydrophobicContact CB-CG1 3.67Å; A300-I311 HydrophobicContact CB-CG2 4.27Å |
| 301 | D | 88.4 | Confident | 86.7 | Confident | 71 Ų | 71 | 50.4 Ų | 50.4 | 38% | 0.38 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -62 | -32.2 | 176.9 | -72.1 | -28.7 | 0 | 0 | 0 | 112.2 | V297 F299 N308 | V297-D301 PolarHBondContact O-N 3.49Å; F299-D301 PolarHBondContact O-N 2.92Å; D301-N308 WeakPolarHBondContact OD1-CB 3.39Å; D301-N308 PolarHBondContact OD1-ND2 3.25Å |
| 302 | Q | 87.8 | Confident | 86.6 | Confident | 101 Ų | 101 | 44.2 Ų | 44.2 | 47% | 0.472 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -80.1 | -19.6 | 178 | -66.6 | -166.3 | 11.9 | 0 | 0 | 114.1 | V283 L284 F299 A300 | V283-Q302 HydrophobicContact CG1-CB 3.84Å; V283-Q302 VanDerWaalsContact CG1-OE1 3.27Å; V283-Q302 PolarHBondContact O-OE1 3.31Å; L284-Q302 VanDerWaalsContact CD2-CD 3.5Å; L284-Q302 HydrophobicContact CD2-CG 4.29Å; F299-Q302 PolarHBondContact O-N 3.38Å; A300-Q302 PolarHBondContact O-N 2.91Å |
| 303 | V | 88.5 | Confident | 86.6 | Confident | 40 Ų | 40 | 47.5 Ų | 47.5 | 24% | 0.242 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -126.9 | -40.5 | -169.6 | -162.8 | 0 | 0 | 0 | 0 | 115.3 | T200 V283 F299 A300 | T200-V303 HydrophobicContact CG2-CB 3.92Å; T200-V303 HydrophobicContact CG2-CG1 3.16Å; T200-V303 HydrophobicContact CG2-CG2 4.33Å; V283-V303 HydrophobicContact CB-CG2 4.48Å; V283-V303 HydrophobicContact CG1-CG2 3.71Å; V283-V303 HydrophobicContact CG2-CG2 3.99Å; F299-V303 HydrophobicContact CE2-CG2 4.43Å; F299-V303 HydrophobicContact CZ-CG2 4.35Å; F299-V303 PolarHBondContact O-N 3.35Å; A300-V303 PolarHBondContact O-N 3.31Å |
| 304 | F | 83 | Confident | 86.7 | Confident | 38 Ų | 38 | 44.4 Ų | 44.4 | 17% | 0.167 | 24% | 0.241 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.1 | -8.5 | -172.5 | -74.4 | -74.3 | 0 | 0 | 0 | 113.9 | A196 T200 F299 A300 V306 M307 I311 | A196-F304 HydrophobicContact CB-CZ 4.28Å; T200-F304 HydrophobicContact CG2-CE2 4.5Å; T200-F304 HydrophobicContact CG2-CZ 4.31Å; T200-F304 VanDerWaalsContact OG1-CZ 3.26Å; T200-F304 WeakPolarHBondContact OG1-CZ 3.25Å; F299-F304 HydrophobicContact CD1-CE2 4.37Å; F299-F304 AromaticContact CE1-CE2 3.95Å; F299-F304 HydrophobicContact CE1-CE2 3.95Å; A300-F304 HydrophobicContact CB-CD2 3.96Å; A300-F304 PolarHBondContact O-N 3.47Å; F304-V306 PolarHBondContact O-N 3.35Å; F304-V306 VanDerWaalsContact O-N 3.1Å; F304-M307 HydrophobicContact CB-CB 4.26Å; F304-M307 PolarHBondContact O-N 3.3Å; F304-I311 HydrophobicContact CD2-CG1 4.34Å; F304-I311 HydrophobicContact CE2-CD1 4.44Å; F304-I311 HydrophobicContact CE2-CG1 4.43Å |
| 305 | G | 83.7 | Confident | 86.6 | Confident | 45 Ų | 45 | 44.5 Ų | 44.5 | 46% | 0.464 | 24% | 0.241 | S | C | . | . | G | 310 helix | trans | 52.3 | -116.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | M307 N308 | G305-M307 PolarHBondContact O-N 2.88Å; G305-M307 VanDerWaalsContact O-N 3.17Å; G305-N308 VanDerWaalsContact O-CB 3.28Å; G305-N308 WeakPolarHBondContact O-CB 3.28Å; G305-N308 VanDerWaalsContact O-CG 3.23Å; G305-N308 PolarHBondContact O-N 3.01Å; G305-N308 VanDerWaalsContact O-N 3.07Å; G305-N308 PolarHBondContact O-OD1 3.48Å |
| 306 | V | 80.7 | Confident | 86.5 | Confident | 135 Ų | 135 | 44.5 Ų | 44.5 | 82% | 0.818 | 24% | 0.242 | S | C | * | . | G | 310 helix | trans | -62.3 | -22.4 | -179.2 | -173.5 | 0 | 0 | 0 | 0 | 113.3 | F304 W309 | F304-V306 PolarHBondContact O-N 3.35Å; F304-V306 VanDerWaalsContact O-N 3.1Å; V306-W309 VanDerWaalsContact O-CD1 3.24Å |
| 307 | M | 79.2 | Confident | 86.3 | Confident | 113 Ų | 113 | 47 Ų | 47 | 56% | 0.557 | 25% | 0.254 | S | S | * | . | G | 310 helix | trans | -91.3 | 8.1 | 178 | -65.7 | -170.2 | -67.9 | 0 | 0 | 113.5 | F304 G305 W309 T310 | F304-M307 HydrophobicContact CB-CB 4.26Å; F304-M307 PolarHBondContact O-N 3.3Å; G305-M307 PolarHBondContact O-N 2.88Å; G305-M307 VanDerWaalsContact O-N 3.17Å; M307-W309 PolarHBondContact O-N 2.88Å; M307-T310 HydrophobicContact CB-CG2 4.45Å; M307-T310 WeakPolarHBondContact O-CB 3.34Å; M307-T310 WeakPolarHBondContact O-CG2 3.3Å; M307-T310 PolarHBondContact O-N 3.15Å; M307-T310 VanDerWaalsContact O-N 3.12Å; M307-T310 PolarHBondContact O-OG1 3.44Å |
| 308 | N | 81.4 | Confident | 86.2 | Confident | 55 Ų | 55 | 47 Ų | 47 | 29% | 0.294 | 25% | 0.254 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56 | -35 | -178.5 | 66.4 | -12.8 | 0 | 0 | 0 | 113.5 | A300 D301 G305 T310 I311 P312 | A300-N308 HydrophobicContact CB-CB 4.49Å; D301-N308 WeakPolarHBondContact OD1-CB 3.39Å; D301-N308 PolarHBondContact OD1-ND2 3.25Å; G305-N308 VanDerWaalsContact O-CB 3.28Å; G305-N308 WeakPolarHBondContact O-CB 3.28Å; G305-N308 VanDerWaalsContact O-CG 3.23Å; G305-N308 PolarHBondContact O-N 3.01Å; G305-N308 VanDerWaalsContact O-N 3.07Å; G305-N308 PolarHBondContact O-OD1 3.48Å; N308-T310 PolarHBondContact O-N 3.36Å; N308-T310 VanDerWaalsContact O-N 3.14Å; N308-I311 PolarHBondContact O-N 2.99Å; N308-P312 WeakPolarHBondContact O-CD 3.49Å |
| 309 | W | 82.8 | Confident | 86.1 | Confident | 152 Ų | 152 | 45.7 Ų | 45.7 | 58% | 0.576 | 25% | 0.247 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -63.1 | -18.6 | 180 | 69.8 | -90.8 | 0 | 0 | 0 | 114.3 | V306 M307 P312 L313 | V306-W309 VanDerWaalsContact O-CD1 3.24Å; M307-W309 PolarHBondContact O-N 2.88Å; W309-P312 WeakPolarHBondContact O-CD 3.37Å; W309-P312 WeakPolarHBondContact O-CG 3.42Å; W309-L313 HydrophobicContact CE3-CD2 4.32Å; W309-L313 HydrophobicContact CZ3-CD2 3.83Å |
| 310 | T | 84.6 | Confident | 85.9 | Confident | 50 Ų | 50 | 47.9 Ų | 47.9 | 31% | 0.307 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -70 | -37.1 | -178.5 | 61.3 | 0 | 0 | 0 | 0 | 112.3 | M307 N308 A314 | M307-T310 HydrophobicContact CB-CG2 4.45Å; M307-T310 WeakPolarHBondContact O-CB 3.34Å; M307-T310 WeakPolarHBondContact O-CG2 3.3Å; M307-T310 PolarHBondContact O-N 3.15Å; M307-T310 VanDerWaalsContact O-N 3.12Å; M307-T310 PolarHBondContact O-OG1 3.44Å; N308-T310 PolarHBondContact O-N 3.36Å; N308-T310 VanDerWaalsContact O-N 3.14Å; T310-A314 WeakPolarHBondContact O-CB 3.39Å; T310-A314 PolarHBondContact O-N 3.11Å |
| 311 | I | 86.8 | Confident | 85.6 | Confident | 8 Ų | 8 | 48.2 Ų | 48.2 | 4% | 0.041 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -66.2 | -53.5 | -179.8 | -62.4 | -62.2 | 0 | 0 | 0 | 112.9 | V197 A296 A300 F304 N308 L313 A314 V315 | V197-I311 HydrophobicContact CG2-CD1 4.3Å; A296-I311 HydrophobicContact CB-CG2 3.83Å; A300-I311 HydrophobicContact CB-CB 3.86Å; A300-I311 HydrophobicContact CB-CG1 3.67Å; A300-I311 HydrophobicContact CB-CG2 4.27Å; F304-I311 HydrophobicContact CD2-CG1 4.34Å; F304-I311 HydrophobicContact CE2-CD1 4.44Å; F304-I311 HydrophobicContact CE2-CG1 4.43Å; N308-I311 PolarHBondContact O-N 2.99Å; I311-L313 PolarHBondContact O-N 2.92Å; I311-A314 PolarHBondContact O-N 3.36Å; I311-A314 VanDerWaalsContact O-N 3.16Å; I311-V315 HydrophobicContact CG2-CG2 4.26Å; I311-V315 WeakPolarHBondContact O-CG2 3.31Å; I311-V315 PolarHBondContact O-N 3.31Å |
| 312 | P | 88.1 | Confident | 85.4 | Confident | 5 Ų | 5 | 45.8 Ų | 45.8 | 3% | 0.032 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -58.7 | -38.1 | 177.9 | 19.6 | -28.9 | 0 | 0 | 0 | 112.1 | Y141 P145 V297 N308 W309 A316 | Y141-P312 WeakPolarHBondContact O-CB 3.13Å; P145-P312 HydrophobicContact CG-CB 3.64Å; P145-P312 HydrophobicContact CG-CG 3.6Å; V297-P312 HydrophobicContact CG2-CB 3.76Å; V297-P312 HydrophobicContact CG2-CG 4.29Å; N308-P312 WeakPolarHBondContact O-CD 3.49Å; W309-P312 WeakPolarHBondContact O-CD 3.37Å; W309-P312 WeakPolarHBondContact O-CG 3.42Å; P312-A316 WeakPolarHBondContact O-CB 3.5Å; P312-A316 PolarHBondContact O-N 3.2Å |
| 313 | L | 87.3 | Confident | 85.4 | Confident | 74 Ų | 74 | 41 Ų | 41 | 39% | 0.387 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -64 | -49.2 | 174.8 | -177.2 | 63.2 | 0 | 0 | 0 | 111.6 | W309 I311 V315 A316 L317 | W309-L313 HydrophobicContact CE3-CD2 4.32Å; W309-L313 HydrophobicContact CZ3-CD2 3.83Å; I311-L313 PolarHBondContact O-N 2.92Å; L313-V315 VanDerWaalsContact C-N 3.32Å; L313-V315 PolarHBondContact O-N 3.26Å; L313-A316 PolarHBondContact O-N 3.42Å; L313-L317 HydrophobicContact CD1-CD1 4.3Å; L313-L317 HydrophobicContact CD1-CG 4.29Å; L313-L317 HydrophobicContact CG-CD1 4.15Å; L313-L317 WeakPolarHBondContact O-CB 3.42Å; L313-L317 VanDerWaalsContact O-CG 3.24Å; L313-L317 WeakPolarHBondContact O-CG 3.39Å; L313-L317 PolarHBondContact O-N 2.93Å |
| 314 | A | 86.7 | Confident | 85.3 | Confident | 17 Ų | 17 | 39.3 Ų | 39.3 | 14% | 0.14 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -60.8 | -40.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | A193 T310 I311 S318 | A193-A314 HydrophobicContact CB-CB 3.74Å; T310-A314 WeakPolarHBondContact O-CB 3.39Å; T310-A314 PolarHBondContact O-N 3.11Å; I311-A314 PolarHBondContact O-N 3.36Å; I311-A314 VanDerWaalsContact O-N 3.16Å; A314-S318 WeakPolarHBondContact O-CB 3.22Å; A314-S318 PolarHBondContact O-N 3.49Å |
| 315 | V | 87.6 | Confident | 85.2 | Confident | 1 Ų | 1 | 38.2 Ų | 38.2 | 1% | 0.006 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -69 | -42.2 | 177.2 | 178.1 | 0 | 0 | 0 | 0 | 111.5 | F55 Y141 I311 L313 L317 S318 C319 | F55-V315 HydrophobicContact CB-CG1 4.06Å; F55-V315 HydrophobicContact CD1-CG1 4.19Å; F55-V315 HydrophobicContact CD1-CG2 3.74Å; F55-V315 HydrophobicContact CD2-CB 4.42Å; F55-V315 HydrophobicContact CD2-CG1 3.56Å; F55-V315 HydrophobicContact CD2-CG2 4.14Å; F55-V315 HydrophobicContact CE1-CG2 3.52Å; F55-V315 HydrophobicContact CE2-CB 4.44Å; F55-V315 HydrophobicContact CE2-CG1 4.03Å; F55-V315 HydrophobicContact CE2-CG2 3.93Å; F55-V315 HydrophobicContact CG-CG1 3.65Å; F55-V315 HydrophobicContact CG-CG2 4.05Å; F55-V315 HydrophobicContact CZ-CG2 3.62Å; Y141-V315 HydrophobicContact CD1-CB 3.51Å; Y141-V315 HydrophobicContact CD1-CG1 3.4Å; Y141-V315 VanDerWaalsContact CD1-CG1 3.4Å; Y141-V315 HydrophobicContact CD1-CG2 3.96Å; Y141-V315 HydrophobicContact CD2-CG1 3.88Å; Y141-V315 HydrophobicContact CE1-CB 3.83Å; Y141-V315 HydrophobicContact CE1-CG1 3.58Å; Y141-V315 HydrophobicContact CE1-CG2 3.8Å; Y141-V315 HydrophobicContact CE2-CG1 4.04Å; Y141-V315 HydrophobicContact CG-CB 4.05Å; Y141-V315 HydrophobicContact CG-CG1 3.55Å; I311-V315 HydrophobicContact CG2-CG2 4.26Å; I311-V315 WeakPolarHBondContact O-CG2 3.31Å; I311-V315 PolarHBondContact O-N 3.31Å; L313-V315 VanDerWaalsContact C-N 3.32Å; L313-V315 PolarHBondContact O-N 3.26Å; V315-L317 PolarHBondContact O-N 2.83Å; V315-S318 VanDerWaalsContact O-CB 3.28Å; V315-S318 WeakPolarHBondContact O-CB 3.04Å; V315-S318 PolarHBondContact O-N 3.49Å; V315-C319 PolarHBondContact O-N 3.44Å; V315-C319 PolarHBondContact O-SG 2.69Å |
| 316 | A | 89.3 | Confident | 85.2 | Confident | 2 Ų | 2 | 36.9 Ų | 36.9 | 2% | 0.017 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.7 | -44.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | F138 M142 P312 L313 S318 C319 F320 | F138-A316 HydrophobicContact CD2-CB 3.84Å; F138-A316 WeakPolarHBondContact CD2-O 3.49Å; F138-A316 HydrophobicContact CE2-CB 3.89Å; M142-A316 HydrophobicContact CE-CB 3.43Å; M142-A316 VanDerWaalsContact CE-CB 3.43Å; M142-A316 HydrophobicContact CG-CB 3.73Å; M142-A316 HydrophobicContact SD-CB 3.58Å; M142-A316 VanDerWaalsContact SD-CB 3.58Å; P312-A316 WeakPolarHBondContact O-CB 3.5Å; P312-A316 PolarHBondContact O-N 3.2Å; L313-A316 PolarHBondContact O-N 3.42Å; A316-S318 VanDerWaalsContact C-N 3.3Å; A316-S318 PolarHBondContact O-N 3.41Å; A316-C319 PolarHBondContact O-N 2.81Å; A316-F320 WeakPolarHBondContact O-CB 3.36Å; A316-F320 PolarHBondContact O-N 3.41Å |
| 317 | L | 86 | Confident | 85.6 | Confident | 52 Ų | 52 | 30.4 Ų | 30.4 | 27% | 0.272 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -62.3 | -37.1 | 174.5 | -66.4 | 177.2 | 0 | 0 | 0 | 112.1 | F186 L313 V315 F320 G321 | F186-L317 HydrophobicContact CD1-CB 3.76Å; F186-L317 HydrophobicContact CD1-CD1 4.16Å; F186-L317 HydrophobicContact CD1-CD2 4.31Å; F186-L317 HydrophobicContact CD1-CG 4.28Å; F186-L317 HydrophobicContact CE1-CB 3.96Å; F186-L317 HydrophobicContact CE1-CD1 3.87Å; F186-L317 HydrophobicContact CE1-CD2 3.61Å; F186-L317 HydrophobicContact CE1-CG 4Å; F186-L317 HydrophobicContact CE2-CD2 4.44Å; F186-L317 HydrophobicContact CG-CB 4.2Å; F186-L317 HydrophobicContact CZ-CD2 3.69Å; L313-L317 HydrophobicContact CD1-CD1 4.3Å; L313-L317 HydrophobicContact CD1-CG 4.29Å; L313-L317 HydrophobicContact CG-CD1 4.15Å; L313-L317 WeakPolarHBondContact O-CB 3.42Å; L313-L317 VanDerWaalsContact O-CG 3.24Å; L313-L317 WeakPolarHBondContact O-CG 3.39Å; L313-L317 PolarHBondContact O-N 2.93Å; V315-L317 PolarHBondContact O-N 2.83Å; L317-F320 PolarHBondContact O-N 2.91Å; L317-G321 PolarHBondContact O-N 3.49Å |
| 318 | S | 86.5 | Confident | 85.7 | Confident | 1 Ų | 1 | 26.1 Ų | 26.1 | 1% | 0.007 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -60.7 | -48.2 | 172.6 | -178.1 | 0 | 0 | 0 | 0 | 112 | K190 A314 V315 A316 F320 G321 G322 | K190-S318 WeakPolarHBondContact CD-OG 3.34Å; A314-S318 WeakPolarHBondContact O-CB 3.22Å; A314-S318 PolarHBondContact O-N 3.49Å; V315-S318 VanDerWaalsContact O-CB 3.28Å; V315-S318 WeakPolarHBondContact O-CB 3.04Å; V315-S318 PolarHBondContact O-N 3.49Å; A316-S318 VanDerWaalsContact C-N 3.3Å; A316-S318 PolarHBondContact O-N 3.41Å; S318-F320 VanDerWaalsContact C-N 3.34Å; S318-F320 PolarHBondContact O-N 3.22Å; S318-G321 PolarHBondContact O-N 2.9Å; S318-G322 PolarHBondContact O-N 3.33Å |
| 319 | C | 88.9 | Confident | 85.6 | Confident | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64.3 | -40.2 | 178.5 | -61.7 | 0 | 0 | 0 | 0 | 111.3 | S52 I134 F138 V315 A316 G322 L323 | S52-C319 VanDerWaalsContact CB-SG 3.52Å; I134-C319 HydrophobicContact CG2-CB 3.98Å; I134-C319 WeakPolarHBondContact CG2-O 3.24Å; F138-C319 HydrophobicContact CB-CB 3.66Å; F138-C319 HydrophobicContact CD2-CB 4.47Å; V315-C319 PolarHBondContact O-N 3.44Å; V315-C319 PolarHBondContact O-SG 2.69Å; A316-C319 PolarHBondContact O-N 2.81Å; C319-G322 PolarHBondContact O-N 2.83Å; C319-L323 VanDerWaalsContact O-CB 3.26Å; C319-L323 WeakPolarHBondContact O-CB 3.4Å; C319-L323 PolarHBondContact O-N 3.42Å |
| 320 | F | 87.9 | Confident | 85.7 | Confident | 45 Ų | 45 | 18.4 Ų | 18.4 | 20% | 0.197 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -60.6 | -45.7 | 175.8 | -170.2 | -88 | 0 | 0 | 0 | 111.7 | L167 L168 F186 A316 L317 S318 N324 | L167-F320 HydrophobicContact CD2-CE2 4.27Å; L168-F320 HydrophobicContact CD1-CD2 4.1Å; L168-F320 HydrophobicContact CD1-CE2 4.12Å; L168-F320 HydrophobicContact CD1-CG 4.36Å; L168-F320 HydrophobicContact CD1-CZ 4.41Å; L168-F320 HydrophobicContact CD2-CD1 4.1Å; L168-F320 HydrophobicContact CD2-CD2 4.39Å; L168-F320 HydrophobicContact CD2-CE1 3.46Å; L168-F320 VanDerWaalsContact CD2-CE1 3.46Å; L168-F320 HydrophobicContact CD2-CE2 3.78Å; L168-F320 HydrophobicContact CD2-CZ 3.27Å; L168-F320 HydrophobicContact CG-CD2 4.31Å; L168-F320 HydrophobicContact CG-CE1 4.36Å; L168-F320 HydrophobicContact CG-CE2 3.82Å; L168-F320 HydrophobicContact CG-CZ 3.86Å; F186-F320 AromaticContact CE2-CD1 3.93Å; F186-F320 HydrophobicContact CE2-CD1 3.93Å; A316-F320 WeakPolarHBondContact O-CB 3.36Å; A316-F320 PolarHBondContact O-N 3.41Å; L317-F320 PolarHBondContact O-N 2.91Å; S318-F320 VanDerWaalsContact C-N 3.34Å; S318-F320 PolarHBondContact O-N 3.22Å; F320-N324 WeakPolarHBondContact O-CB 3.16Å; F320-N324 PolarHBondContact O-N 3.35Å |
| 321 | G | 82.8 | Confident | 85.5 | Confident | 7 Ų | 7 | 16.5 Ų | 16.5 | 7% | 0.072 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -63.8 | -44 | 175 | 0 | 0 | 0 | 0 | 0 | 113.1 | L317 S318 N324 A325 | L317-G321 PolarHBondContact O-N 3.49Å; S318-G321 PolarHBondContact O-N 2.9Å; G321-N324 PolarHBondContact O-N 2.94Å; G321-A325 PolarHBondContact O-N 3.25Å |
| 322 | G | 83.2 | Confident | 85.1 | Confident | 20 Ų | 20 | 22.1 Ų | 22.1 | 21% | 0.206 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -64.5 | -40.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | S318 C319 A325 S326 | S318-G322 PolarHBondContact O-N 3.33Å; C319-G322 PolarHBondContact O-N 2.83Å; G322-A325 PolarHBondContact O-N 3.46Å; G322-S326 PolarHBondContact O-N 3.44Å |
| 323 | L | 88.8 | Confident | 84.8 | Confident | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -64.2 | -43.4 | 176.3 | -177.9 | 54.2 | 0 | 0 | 0 | 111 | Q131 I134 A135 I165 L168 C319 A325 S326 I327 | Q131-L323 HydrophobicContact CB-CD1 3.62Å; Q131-L323 HydrophobicContact CG-CD1 3.84Å; I134-L323 HydrophobicContact CG2-CB 3.81Å; A135-L323 HydrophobicContact CB-CD2 3.97Å; I165-L323 HydrophobicContact CG1-CD2 3.99Å; L168-L323 HydrophobicContact CD1-CB 3.75Å; L168-L323 HydrophobicContact CD1-CD2 3.66Å; L168-L323 HydrophobicContact CD1-CG 3.58Å; C319-L323 VanDerWaalsContact O-CB 3.26Å; C319-L323 WeakPolarHBondContact O-CB 3.4Å; C319-L323 PolarHBondContact O-N 3.42Å; L323-A325 PolarHBondContact O-N 3Å; L323-S326 PolarHBondContact O-N 2.92Å; L323-I327 HydrophobicContact CD1-CD1 4.09Å; L323-I327 HydrophobicContact CD1-CG1 4.34Å; L323-I327 HydrophobicContact CG-CD1 4.03Å; L323-I327 VanDerWaalsContact O-CG1 3.29Å; L323-I327 WeakPolarHBondContact O-CG1 3.29Å; L323-I327 PolarHBondContact O-N 3.42Å |
| 324 | N | 85.9 | Confident | 84.5 | Confident | 6 Ų | 6 | 18.6 Ų | 18.6 | 3% | 0.032 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -60.2 | -45.5 | 174.9 | -175.4 | 73.4 | 0 | 0 | 0 | 112 | L168 N172 G179 F320 G321 S326 I327 V328 | L168-N324 HydrophobicContact CD1-CB 4.36Å; L168-N324 HydrophobicContact CD2-CB 3.98Å; N172-N324 PolarHBondContact ND2-OD1 3.11Å; N172-N324 PolarHBondContact OD1-OD1 3.37Å; G179-N324 PolarHBondContact O-ND2 2.57Å; F320-N324 WeakPolarHBondContact O-CB 3.16Å; F320-N324 PolarHBondContact O-N 3.35Å; G321-N324 PolarHBondContact O-N 2.94Å; N324-S326 PolarHBondContact O-N 3.44Å; N324-I327 PolarHBondContact O-N 2.86Å; N324-V328 WeakPolarHBondContact O-CG2 3.38Å; N324-V328 PolarHBondContact O-N 3.21Å; N324-V328 VanDerWaalsContact O-N 3.09Å |
| 325 | A | 80.2 | Confident | 83.9 | Confident | 15 Ų | 15 | 20.1 Ų | 20.1 | 12% | 0.124 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -60.4 | -44.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | G321 G322 L323 V328 A329 | G321-A325 PolarHBondContact O-N 3.25Å; G322-A325 PolarHBondContact O-N 3.46Å; L323-A325 PolarHBondContact O-N 3Å; A325-V328 PolarHBondContact O-N 3.46Å; A325-A329 WeakPolarHBondContact O-CB 3.3Å; A325-A329 PolarHBondContact O-N 3.22Å |
| 326 | S | 85.6 | Confident | 83.4 | Confident | 16 Ų | 16 | 21.6 Ų | 21.6 | 11% | 0.112 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -64.6 | -43.1 | 178 | 178.1 | 0 | 0 | 0 | 0 | 112.3 | Q131 G322 L323 N324 V328 A329 A330 | Q131-S326 WeakPolarHBondContact CG-OG 3.44Å; Q131-S326 PolarHBondContact NE2-OG 3.26Å; G322-S326 PolarHBondContact O-N 3.44Å; L323-S326 PolarHBondContact O-N 2.92Å; N324-S326 PolarHBondContact O-N 3.44Å; S326-V328 VanDerWaalsContact C-N 3.32Å; S326-V328 PolarHBondContact O-N 2.96Å; S326-A329 PolarHBondContact O-N 3.23Å; S326-A330 WeakPolarHBondContact O-CB 3.41Å; S326-A330 PolarHBondContact O-N 3.28Å |
| 327 | I | 87.6 | Confident | 83 | Confident | 0 Ų | 0 | 21.5 Ų | 21.5 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -59.8 | -43.6 | 177 | -71.4 | 167.3 | 0 | 0 | 0 | 111 | Q131 L168 N172 L323 N324 S331 L361 | Q131-I327 HydrophobicContact CG-CG1 4.49Å; L168-I327 HydrophobicContact CB-CD1 3.82Å; N172-I327 HydrophobicContact CB-CG2 4.45Å; L323-I327 HydrophobicContact CD1-CD1 4.09Å; L323-I327 HydrophobicContact CD1-CG1 4.34Å; L323-I327 HydrophobicContact CG-CD1 4.03Å; L323-I327 VanDerWaalsContact O-CG1 3.29Å; L323-I327 WeakPolarHBondContact O-CG1 3.29Å; L323-I327 PolarHBondContact O-N 3.42Å; N324-I327 PolarHBondContact O-N 2.86Å; I327-S331 PolarHBondContact O-N 3.27Å; I327-L361 HydrophobicContact CG2-CD2 3.46Å; I327-L361 VanDerWaalsContact CG2-CD2 3.46Å |
| 328 | V | 81.1 | Confident | 82.7 | Confident | 23 Ų | 23 | 19.2 Ų | 19.2 | 14% | 0.139 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -66 | -44.8 | 177 | 173.8 | 0 | 0 | 0 | 0 | 110.9 | N172 N324 A325 S326 S331 R332 | N172-V328 WeakPolarHBondContact OD1-CG2 3.35Å; N324-V328 WeakPolarHBondContact O-CG2 3.38Å; N324-V328 PolarHBondContact O-N 3.21Å; N324-V328 VanDerWaalsContact O-N 3.09Å; A325-V328 PolarHBondContact O-N 3.46Å; S326-V328 VanDerWaalsContact C-N 3.32Å; S326-V328 PolarHBondContact O-N 2.96Å; V328-S331 PolarHBondContact O-N 3.32Å; V328-S331 PolarHBondContact O-OG 2.96Å; V328-R332 PolarHBondContact O-N 3.39Å |
| 329 | A | 79.8 | Confident | 82.2 | Confident | 45 Ų | 45 | 24.4 Ų | 24.4 | 37% | 0.372 | 13% | 0.127 | S | C | . | . | H | α-helix | trans | -61.1 | -46.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A325 S326 S331 R332 L333 | A325-A329 WeakPolarHBondContact O-CB 3.3Å; A325-A329 PolarHBondContact O-N 3.22Å; S326-A329 PolarHBondContact O-N 3.23Å; A329-S331 VanDerWaalsContact C-N 3.3Å; A329-S331 PolarHBondContact O-N 2.91Å; A329-R332 PolarHBondContact O-N 3.41Å; A329-R332 VanDerWaalsContact O-N 3.14Å; A329-L333 PolarHBondContact O-N 3.41Å; A329-L333 VanDerWaalsContact O-N 3.14Å |
| 330 | A | 84.6 | Confident | 81.9 | Confident | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -57.8 | -42.8 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | E127 S326 R332 L333 F334 | E127-A330 HydrophobicContact CB-CB 3.94Å; E127-A330 HydrophobicContact CG-CB 3.86Å; S326-A330 WeakPolarHBondContact O-CB 3.41Å; S326-A330 PolarHBondContact O-N 3.28Å; A330-R332 VanDerWaalsContact C-N 3.3Å; A330-R332 PolarHBondContact O-N 3.13Å; A330-L333 WeakPolarHBondContact O-CB 3.42Å; A330-L333 PolarHBondContact O-N 3.24Å; A330-F334 HydrophobicContact CB-CE1 4.33Å; A330-F334 HydrophobicContact CB-CZ 4.13Å; A330-F334 WeakPolarHBondContact O-CD1 3.12Å; A330-F334 WeakPolarHBondContact O-CE1 3.36Å; A330-F334 VanDerWaalsContact O-CG 3.27Å; A330-F334 WeakPolarHBondContact O-CG 3.39Å; A330-F334 PolarHBondContact O-N 3.26Å; A330-F334 VanDerWaalsContact O-N 3.12Å |
| 331 | S | 81.8 | Confident | 81.5 | Confident | 10 Ų | 10 | 28.2 Ų | 28.2 | 7% | 0.07 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -61.1 | -36.3 | 178.4 | 76 | 0 | 0 | 0 | 0 | 113.4 | I327 V328 A329 F334 F335 | I327-S331 PolarHBondContact O-N 3.27Å; V328-S331 PolarHBondContact O-N 3.32Å; V328-S331 PolarHBondContact O-OG 2.96Å; A329-S331 VanDerWaalsContact C-N 3.3Å; A329-S331 PolarHBondContact O-N 2.91Å; S331-F334 PolarHBondContact O-N 3.44Å; S331-F335 PolarHBondContact O-N 3.33Å; S331-F335 VanDerWaalsContact O-N 3.17Å |
| 332 | R | 77.3 | Confident | 81.6 | Confident | 125 Ų | 125 | 29 Ų | 29 | 47% | 0.472 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -69.1 | -41.1 | 176.1 | -67.5 | -179.4 | -179.7 | -160.5 | -1.8 | 111.8 | E250 V328 A329 A330 F334 F335 V336 | E250-R332 IonicContact OE1-NH1 3.85Å; V328-R332 PolarHBondContact O-N 3.39Å; A329-R332 PolarHBondContact O-N 3.41Å; A329-R332 VanDerWaalsContact O-N 3.14Å; A330-R332 VanDerWaalsContact C-N 3.3Å; A330-R332 PolarHBondContact O-N 3.13Å; R332-F334 PolarHBondContact O-N 2.53Å; R332-F335 WeakPolarHBondContact O-CB 3.37Å; R332-F335 PolarHBondContact O-N 2.99Å; R332-V336 WeakPolarHBondContact O-CG2 3.17Å; R332-V336 PolarHBondContact O-N 3.32Å |
| 333 | L | 81.3 | Confident | 81.6 | Confident | 6 Ų | 6 | 28.6 Ų | 28.6 | 3% | 0.031 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -59.1 | -39.8 | 176.4 | -179.7 | 62.3 | 0 | 0 | 0 | 111.1 | L119 A329 A330 V336 G337 | L119-L333 HydrophobicContact CD1-CD1 3.97Å; L119-L333 HydrophobicContact CD1-CD2 4.33Å; L119-L333 HydrophobicContact CD1-CG 3.8Å; A329-L333 PolarHBondContact O-N 3.41Å; A329-L333 VanDerWaalsContact O-N 3.14Å; A330-L333 WeakPolarHBondContact O-CB 3.42Å; A330-L333 PolarHBondContact O-N 3.24Å; L333-V336 PolarHBondContact O-N 3.46Å; L333-G337 PolarHBondContact O-N 3.11Å |
| 334 | F | 81.6 | Confident | 81.3 | Confident | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -70.6 | -37.5 | -179 | -58 | -1.2 | 0 | 0 | 0 | 111.3 | L123 A330 S331 R332 G337 S338 L343 A360 F363 N364 | L123-F334 HydrophobicContact CB-CE1 4.48Å; L123-F334 HydrophobicContact CD2-CD1 3.29Å; L123-F334 HydrophobicContact CD2-CD2 3.83Å; L123-F334 HydrophobicContact CD2-CE1 3.13Å; L123-F334 HydrophobicContact CD2-CE2 3.64Å; L123-F334 HydrophobicContact CD2-CG 3.7Å; L123-F334 HydrophobicContact CD2-CZ 3.34Å; L123-F334 HydrophobicContact CG-CD1 3.93Å; L123-F334 HydrophobicContact CG-CE1 3.67Å; L123-F334 HydrophobicContact CG-CZ 4.22Å; A330-F334 HydrophobicContact CB-CE1 4.33Å; A330-F334 HydrophobicContact CB-CZ 4.13Å; A330-F334 WeakPolarHBondContact O-CD1 3.12Å; A330-F334 WeakPolarHBondContact O-CE1 3.36Å; A330-F334 VanDerWaalsContact O-CG 3.27Å; A330-F334 WeakPolarHBondContact O-CG 3.39Å; A330-F334 PolarHBondContact O-N 3.26Å; A330-F334 VanDerWaalsContact O-N 3.12Å; S331-F334 PolarHBondContact O-N 3.44Å; R332-F334 PolarHBondContact O-N 2.53Å; F334-G337 PolarHBondContact O-N 2.98Å; F334-S338 PolarHBondContact O-N 2.98Å; F334-L343 HydrophobicContact CB-CD1 4.42Å; F334-A360 HydrophobicContact CB-CB 4.18Å; F334-A360 HydrophobicContact CD2-CB 3.74Å; F334-A360 HydrophobicContact CG-CB 4.46Å; F334-F363 AromaticContact CE2-CD1 3.97Å; F334-F363 HydrophobicContact CE2-CD1 3.97Å; F334-N364 HydrophobicContact CE2-CB 3.81Å; F334-N364 HydrophobicContact CZ-CB 4.18Å |
| 335 | F | 75.1 | Confident | 81 | Confident | 49 Ų | 49 | 34.6 Ų | 34.6 | 22% | 0.215 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -59.9 | -48.9 | 173.5 | -173.1 | -99.5 | 0 | 0 | 0 | 111.6 | S331 R332 S338 R339 C348 I350 T491 | S331-F335 PolarHBondContact O-N 3.33Å; S331-F335 VanDerWaalsContact O-N 3.17Å; R332-F335 WeakPolarHBondContact O-CB 3.37Å; R332-F335 PolarHBondContact O-N 2.99Å; F335-S338 PolarHBondContact O-N 2.93Å; F335-R339 VanDerWaalsContact CE1-CD 3.48Å; F335-R339 HydrophobicContact CE1-CG 4.25Å; F335-R339 WeakPolarHBondContact O-CG 3.46Å; F335-R339 PolarHBondContact O-N 3.03Å; F335-R339 VanDerWaalsContact O-N 3.09Å; F335-C348 HydrophobicContact CD2-CB 3.81Å; F335-C348 HydrophobicContact CE2-CB 4.31Å; F335-I350 HydrophobicContact CE2-CD1 3.95Å; F335-I350 HydrophobicContact CE2-CG1 4.33Å; F335-T491 HydrophobicContact CE2-CG2 4.13Å; F335-T491 HydrophobicContact CZ-CG2 4.2Å |
| 336 | V | 76.5 | Confident | 81 | Confident | 32 Ų | 32 | 35.6 Ų | 35.6 | 19% | 0.194 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.1 | -43.8 | 177.3 | 174.6 | 0 | 0 | 0 | 0 | 111.6 | Y103 R332 L333 S338 R339 E340 | Y103-V336 HydrophobicContact CD1-CG1 4.16Å; Y103-V336 HydrophobicContact CE1-CG1 4.03Å; R332-V336 WeakPolarHBondContact O-CG2 3.17Å; R332-V336 PolarHBondContact O-N 3.32Å; L333-V336 PolarHBondContact O-N 3.46Å; V336-S338 VanDerWaalsContact C-N 3.29Å; V336-S338 PolarHBondContact O-N 3.47Å; V336-R339 PolarHBondContact O-N 2.91Å; V336-E340 PolarHBondContact O-N 3.46Å |
| 337 | G | 80.9 | Confident | 80.7 | Confident | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60.7 | -36.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | L333 F334 H342 L343 | L333-G337 PolarHBondContact O-N 3.11Å; F334-G337 PolarHBondContact O-N 2.98Å; G337-H342 WeakPolarHBondContact O-CB 3.35Å; G337-H342 PolarHBondContact O-N 3.26Å; G337-H342 VanDerWaalsContact O-N 3.11Å; G337-L343 PolarHBondContact O-N 3.17Å |
| 338 | S | 79.5 | Confident | 80.3 | Confident | 4 Ų | 4 | 36 Ų | 36 | 3% | 0.028 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -74.1 | -37.3 | 175.5 | -167.5 | 0 | 0 | 0 | 0 | 112.9 | F334 F335 V336 E340 G341 L343 C348 | F334-S338 PolarHBondContact O-N 2.98Å; F335-S338 PolarHBondContact O-N 2.93Å; V336-S338 VanDerWaalsContact C-N 3.29Å; V336-S338 PolarHBondContact O-N 3.47Å; S338-E340 PolarHBondContact O-N 2.71Å; S338-G341 WeakPolarHBondContact O-CA 3.46Å; S338-G341 PolarHBondContact O-N 3.11Å; S338-L343 PolarHBondContact OG-O 3.03Å; S338-C348 VanDerWaalsContact CB-CB 3.44Å; S338-C348 PolarHBondContact OG-SG 3.14Å |
| 339 | R | 76.4 | Confident | 80.4 | Confident | 109 Ų | 109 | 35.4 Ų | 35.4 | 41% | 0.411 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -59.9 | -32.8 | 176.6 | -75.7 | -176.3 | 67.1 | 170.7 | 8.6 | 112.8 | F335 V336 G341 D494 | F335-R339 VanDerWaalsContact CE1-CD 3.48Å; F335-R339 HydrophobicContact CE1-CG 4.25Å; F335-R339 WeakPolarHBondContact O-CG 3.46Å; F335-R339 PolarHBondContact O-N 3.03Å; F335-R339 VanDerWaalsContact O-N 3.09Å; V336-R339 PolarHBondContact O-N 2.91Å; R339-G341 PolarHBondContact O-N 3.48Å; R339-D494 IonicContact CZ-OD2 3.34Å; R339-D494 IonicContact NH2-OD2 3.59Å; R339-D494 PolarHBondContact NH2-OD2 2.83Å |
| 340 | E | 81.6 | Confident | 80.7 | Confident | 82 Ų | 82 | 34.9 Ų | 34.9 | 38% | 0.383 | 18% | 0.177 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.8 | 5.4 | 174.6 | -66.9 | -66.1 | 156.2 | 0 | 0 | 113.1 | Y103 L107 V336 S338 H342 | Y103-E340 HydrophobicContact CE1-CG 4.15Å; Y103-E340 WeakPolarHBondContact OH-CB 3.47Å; L107-E340 HydrophobicContact CD2-CG 4.26Å; V336-E340 PolarHBondContact O-N 3.46Å; S338-E340 PolarHBondContact O-N 2.71Å; E340-H342 PolarHBondContact O-N 3.07Å |
| 341 | G | 80.9 | Confident | 80.7 | Confident | 44 Ų | 44 | 36 Ų | 36 | 45% | 0.454 | 18% | 0.182 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 73 | 10.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | S338 R339 | S338-G341 WeakPolarHBondContact O-CA 3.46Å; S338-G341 PolarHBondContact O-N 3.11Å; R339-G341 PolarHBondContact O-N 3.48Å |
| 342 | H | 84.3 | Confident | 80.9 | Confident | 23 Ų | 23 | 37.9 Ų | 37.9 | 11% | 0.106 | 19% | 0.193 | C | C | . | . | S | Bend | trans | -87 | -17.5 | -179.7 | -74 | 164.9 | 0 | 0 | 0 | 113.5 | Y103 G112 F116 L119 G337 E340 C460 | Y103-H342 AromaticContact CE2-ND1 3.75Å; Y103-H342 AromaticContact CZ-ND1 3.7Å; Y103-H342 PolarHBondContact OH-CE1 3.33Å; Y103-H342 PolarHBondContact OH-ND1 3.13Å; G112-H342 PolarHBondContact O-CE1 3.26Å; F116-H342 HydrophobicContact CD2-CB 3.99Å; F116-H342 WeakPolarHBondContact CD2-O 3.44Å; F116-H342 WeakPolarHBondContact CE2-O 3.44Å; L119-H342 HydrophobicContact CD2-CB 3.94Å; G337-H342 WeakPolarHBondContact O-CB 3.35Å; G337-H342 PolarHBondContact O-N 3.26Å; G337-H342 VanDerWaalsContact O-N 3.11Å; E340-H342 PolarHBondContact O-N 3.07Å; H342-C460 PolarHBondContact O-SG 3.29Å |
| 343 | L | 83.8 | Confident | 81.1 | Confident | 11 Ų | 11 | 38.4 Ų | 38.4 | 6% | 0.058 | 20% | 0.2 | C | C | . | . | S | Bend | trans | -121.8 | 154.7 | 174.3 | -66.5 | 170.3 | 0 | 0 | 0 | 111.2 | L119 L123 F334 G337 S338 D345 | L119-L343 HydrophobicContact CD1-CD1 4.32Å; L119-L343 HydrophobicContact CD2-CD1 3.8Å; L119-L343 HydrophobicContact CD2-CD2 4.26Å; L119-L343 HydrophobicContact CD2-CG 3.73Å; L119-L343 HydrophobicContact CG-CD1 4.19Å; L119-L343 HydrophobicContact CG-CG 4.42Å; L123-L343 HydrophobicContact CD1-CD1 3.89Å; L123-L343 HydrophobicContact CD1-CD2 3.42Å; L123-L343 VanDerWaalsContact CD1-CD2 3.42Å; L123-L343 HydrophobicContact CD1-CG 4.24Å; F334-L343 HydrophobicContact CB-CD1 4.42Å; G337-L343 PolarHBondContact O-N 3.17Å; S338-L343 PolarHBondContact OG-O 3.03Å; L343-D345 PolarHBondContact O-N 3.43Å |
| 344 | P | 81.3 | Confident | 81 | Confident | 46 Ų | 46 | 43.8 Ų | 43.8 | 30% | 0.299 | 22% | 0.22 | S | C | . | . | trans | -59.4 | 135.5 | 173.1 | -21.2 | 32.3 | 0 | 0 | 0 | 112.1 | F346 L347 | P344-F346 HydrophobicContact CB-CD1 3.66Å; P344-F346 HydrophobicContact CB-CE1 3.24Å; P344-F346 HydrophobicContact CB-CE2 4.23Å; P344-F346 HydrophobicContact CB-CG 4.32Å; P344-F346 HydrophobicContact CB-CZ 3.56Å; P344-F346 HydrophobicContact CG-CE1 3.99Å; P344-F346 HydrophobicContact CG-CZ 3.92Å; P344-F346 PolarHBondContact O-N 3.36Å; P344-L347 PolarHBondContact O-N 3.44Å | ||
| 345 | D | 79.3 | Confident | 81 | Confident | 87 Ų | 87 | 52.7 Ų | 52.7 | 47% | 0.465 | 26% | 0.255 | S | S | . | . | G | 310 helix | trans | -57.5 | -22.9 | -175 | -51.7 | -28.2 | 0 | 0 | 0 | 114.2 | L343 L347 C348 L490 | L343-D345 PolarHBondContact O-N 3.43Å; D345-L347 PolarHBondContact O-N 2.94Å; D345-C348 PolarHBondContact O-N 3.43Å; D345-C348 PolarHBondContact O-SG 3.21Å; D345-L490 HydrophobicContact CB-CD1 3.86Å; D345-L490 HydrophobicContact CB-CD2 4.13Å; D345-L490 HydrophobicContact CB-CG 4.45Å |
| 346 | F | 80.1 | Confident | 81.3 | Confident | 35 Ų | 35 | 50.4 Ų | 50.4 | 15% | 0.154 | 25% | 0.245 | C | C | . | . | G | 310 helix | trans | -69.3 | -20.4 | 177.4 | 61.9 | -106.7 | 0 | 0 | 0 | 113.8 | P344 M349 P359 I475 I482 | P344-F346 HydrophobicContact CB-CD1 3.66Å; P344-F346 HydrophobicContact CB-CE1 3.24Å; P344-F346 HydrophobicContact CB-CE2 4.23Å; P344-F346 HydrophobicContact CB-CG 4.32Å; P344-F346 HydrophobicContact CB-CZ 3.56Å; P344-F346 HydrophobicContact CG-CE1 3.99Å; P344-F346 HydrophobicContact CG-CZ 3.92Å; P344-F346 PolarHBondContact O-N 3.36Å; F346-M349 HydrophobicContact CB-CE 3.93Å; F346-M349 HydrophobicContact CB-SD 4.14Å; F346-P359 VanDerWaalsContact O-CB 3.3Å; F346-P359 WeakPolarHBondContact O-CB 3.24Å; F346-I475 HydrophobicContact CE1-CG2 4.33Å; F346-I482 HydrophobicContact CB-CD1 4.21Å; F346-I482 HydrophobicContact CB-CG2 4.49Å; F346-I482 HydrophobicContact CD2-CD1 3.36Å; F346-I482 HydrophobicContact CE2-CD1 3.81Å; F346-I482 HydrophobicContact CG-CD1 3.84Å |
| 347 | L | 80.6 | Confident | 81.8 | Confident | 17 Ų | 17 | 49.9 Ų | 49.9 | 9% | 0.089 | 24% | 0.242 | C | C | . | . | G | 310 helix | trans | -77.1 | -22.4 | 177 | -70.1 | 177.3 | 0 | 0 | 0 | 112.5 | P344 D345 A360 F363 | P344-L347 PolarHBondContact O-N 3.44Å; D345-L347 PolarHBondContact O-N 2.94Å; L347-A360 WeakPolarHBondContact O-CB 3.44Å; L347-F363 HydrophobicContact CD2-CB 4.16Å; L347-F363 HydrophobicContact CD2-CG 4.37Å |
| 348 | C | 78.4 | Confident | 82.2 | Confident | 7 Ų | 7 | 50.8 Ų | 50.8 | 5% | 0.047 | 25% | 0.247 | C | C | . | . | S | Bend | trans | -97.1 | 3.2 | 177.7 | 70.7 | 0 | 0 | 0 | 0 | 114.2 | F335 S338 D345 | F335-C348 HydrophobicContact CD2-CB 3.81Å; F335-C348 HydrophobicContact CE2-CB 4.31Å; S338-C348 VanDerWaalsContact CB-CB 3.44Å; S338-C348 PolarHBondContact OG-SG 3.14Å; D345-C348 PolarHBondContact O-N 3.43Å; D345-C348 PolarHBondContact O-SG 3.21Å |
| 349 | M | 83.9 | Confident | 82.6 | Confident | 11 Ų | 11 | 51 Ų | 51 | 5% | 0.054 | 25% | 0.248 | C | C | . | . | trans | -63.1 | 141.3 | 177.3 | -68.1 | 175.7 | 178.5 | 0 | 0 | 111.5 | F346 P359 Q483 V489 L490 | F346-M349 HydrophobicContact CB-CE 3.93Å; F346-M349 HydrophobicContact CB-SD 4.14Å; M349-P359 HydrophobicContact CB-CG 4.34Å; M349-Q483 HydrophobicContact CE-CB 4.41Å; M349-Q483 HydrophobicContact CE-CG 4.43Å; M349-Q483 HydrophobicContact SD-CB 4.21Å; M349-Q483 HydrophobicContact SD-CG 4.25Å; M349-V489 CarbonylContact C-O 3.51Å; M349-V489 VanDerWaalsContact CA-O 3.31Å; M349-V489 WeakPolarHBondContact CA-O 3.36Å; M349-L490 HydrophobicContact CE-CD1 3.72Å; M349-L490 HydrophobicContact CG-CD1 3.88Å | ||
| 350 | I | 84.7 | Confident | 83.2 | Confident | 35 Ų | 35 | 45.9 Ų | 45.9 | 18% | 0.179 | 23% | 0.229 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.6 | 137.8 | -179.1 | -58.4 | -168.4 | 0 | 0 | 0 | 109.6 | F335 V352 S488 V489 T491 | F335-I350 HydrophobicContact CE2-CD1 3.95Å; F335-I350 HydrophobicContact CE2-CG1 4.33Å; I350-V352 PolarHBondContact O-N 3.41Å; I350-S488 CarbonylContact O-C 3.4Å; I350-S488 VanDerWaalsContact O-CA 3.22Å; I350-S488 WeakPolarHBondContact O-CA 3.42Å; I350-S488 WeakPolarHBondContact O-CB 3.39Å; I350-V489 PolarHBondContact N-O 2.9Å; I350-V489 PolarHBondContact O-N 3.28Å; I350-T491 HydrophobicContact CB-CG2 4.45Å; I350-T491 HydrophobicContact CD1-CG2 3.3Å; I350-T491 HydrophobicContact CG1-CG2 3.85Å |
| 351 | H | 86.3 | Confident | 83.6 | Confident | 23 Ų | 23 | 42.1 Ų | 42.1 | 11% | 0.106 | 21% | 0.212 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -65.6 | 130.8 | 177.1 | -176.9 | -71.8 | 0 | 0 | 0 | 112.1 | H353 R354 Y355 T356 I358 C486 | H351-H353 PolarHBondContact ND1-N 3.19Å; H351-H353 VanDerWaalsContact ND1-N 3.17Å; H351-H353 PolarHBondContact O-N 3.04Å; H351-R354 HydrophobicContact CB-CB 4.25Å; H351-R354 PolarHBondContact ND1-N 3Å; H351-R354 PolarHBondContact O-N 3.27Å; H351-Y355 WeakPolarHBondContact O-CA 3.26Å; H351-Y355 PolarHBondContact O-N 2.74Å; H351-T356 PolarHBondContact N-O 2.84Å; H351-I358 HydrophobicContact CB-CD1 3.68Å; H351-I358 HydrophobicContact CB-CG1 4.1Å; H351-I358 VanDerWaalsContact CD2-CD1 3.41Å; H351-I358 WeakPolarHBondContact CD2-CD1 3.43Å; H351-C486 PolarHBondContact CD2-O 3.47Å |
| 352 | V | 84.1 | Confident | 84.1 | Confident | 50 Ų | 50 | 44.2 Ų | 44.2 | 30% | 0.303 | 21% | 0.212 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55.5 | -47.7 | -170.3 | 178.4 | 0 | 0 | 0 | 0 | 113.7 | I350 Y487 V489 | I350-V352 PolarHBondContact O-N 3.41Å; V352-Y487 HydrophobicContact CB-CD1 4.02Å; V352-Y487 HydrophobicContact CB-CE1 3.76Å; V352-Y487 HydrophobicContact CG1-CE1 4.26Å; V352-Y487 HydrophobicContact CG2-CD1 4.11Å; V352-Y487 HydrophobicContact CG2-CE1 3.98Å; V352-Y487 PolarHBondContact N-O 3.11Å; V352-V489 HydrophobicContact CG2-CG1 3.81Å; V352-V489 HydrophobicContact CG2-CG2 4.01Å |
| 353 | H | 82.8 | Confident | 84.4 | Confident | 136 Ų | 136 | 46.2 Ų | 46.2 | 63% | 0.63 | 22% | 0.221 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -90.9 | -19.5 | -176.6 | -61.9 | -61.2 | 0 | 0 | 0 | 115 | H351 Y487 | H351-H353 PolarHBondContact ND1-N 3.19Å; H351-H353 VanDerWaalsContact ND1-N 3.17Å; H351-H353 PolarHBondContact O-N 3.04Å; H353-Y487 AromaticContact CD2-CE1 3.69Å; H353-Y487 AromaticContact NE2-CE1 3.59Å |
| 354 | R | 78.6 | Confident | 84.8 | Confident | 118 Ų | 118 | 45.7 Ų | 45.7 | 45% | 0.445 | 22% | 0.218 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -108.8 | -18.9 | -167.4 | -66.3 | 177.8 | 179.6 | -165.9 | -0.3 | 112.1 | A174 H351 T356 | A174-R354 WeakPolarHBondContact O-CD 3.38Å; H351-R354 HydrophobicContact CB-CB 4.25Å; H351-R354 PolarHBondContact ND1-N 3Å; H351-R354 PolarHBondContact O-N 3.27Å; R354-T356 HydrophobicContact CB-CG2 4.13Å; R354-T356 WeakPolarHBondContact O-CG2 3.41Å; R354-T356 PolarHBondContact O-N 3.46Å |
| 355 | Y | 81.7 | Confident | 85.3 | Confident | 188 Ų | 188 | 43.7 Ų | 43.7 | 74% | 0.737 | 21% | 0.206 | S | C | * | . | trans | 56.8 | 35.8 | -177 | -55.3 | -84.5 | 0 | 0 | 0 | 112.5 | H351 | H351-Y355 WeakPolarHBondContact O-CA 3.26Å; H351-Y355 PolarHBondContact O-N 2.74Å | ||
| 356 | T | 82.6 | Confident | 86.1 | Confident | 1 Ų | 1 | 45.7 Ų | 45.7 | 1% | 0.006 | 21% | 0.211 | C | C | . | . | trans | -115 | 140.8 | -179.3 | 59.1 | 0 | 0 | 0 | 0 | 111.7 | C173 V176 H351 R354 I358 | C173-T356 PolarHBondContact O-OG1 3.26Å; V176-T356 HydrophobicContact CB-CG2 4.34Å; V176-T356 HydrophobicContact CG2-CG2 3.46Å; V176-T356 VanDerWaalsContact CG2-CG2 3.46Å; H351-T356 PolarHBondContact N-O 2.84Å; R354-T356 HydrophobicContact CB-CG2 4.13Å; R354-T356 WeakPolarHBondContact O-CG2 3.41Å; R354-T356 PolarHBondContact O-N 3.46Å; T356-I358 VanDerWaalsContact C-N 3.31Å; T356-I358 PolarHBondContact O-N 3.42Å | ||
| 357 | P | 86.7 | Confident | 86.7 | Confident | 21 Ų | 21 | 45.2 Ų | 45.2 | 14% | 0.136 | 21% | 0.209 | C | C | . | . | trans | -82.8 | 71.1 | -179.1 | 34.4 | -36.3 | 0 | 0 | 0 | 111.5 | A360 L361 | P357-A360 HydrophobicContact CB-CB 4.32Å; P357-A360 PolarHBondContact O-N 2.95Å; P357-L361 HydrophobicContact CG-CD1 4.47Å; P357-L361 HydrophobicContact CG-CG 4.49Å; P357-L361 WeakPolarHBondContact O-CG 3.47Å; P357-L361 PolarHBondContact O-N 3.33Å; P357-L361 VanDerWaalsContact O-N 3.16Å | ||
| 358 | I | 88.4 | Confident | 87.4 | Confident | 18 Ų | 18 | 44.4 Ų | 44.4 | 9% | 0.092 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -56.8 | -46.9 | -173.5 | -62.1 | -178.9 | 0 | 0 | 0 | 113.2 | C173 H351 T356 A360 L361 L362 C486 | C173-I358 HydrophobicContact CB-CG1 4.18Å; H351-I358 HydrophobicContact CB-CD1 3.68Å; H351-I358 HydrophobicContact CB-CG1 4.1Å; H351-I358 VanDerWaalsContact CD2-CD1 3.41Å; H351-I358 WeakPolarHBondContact CD2-CD1 3.43Å; T356-I358 VanDerWaalsContact C-N 3.31Å; T356-I358 PolarHBondContact O-N 3.42Å; I358-A360 PolarHBondContact O-N 3.22Å; I358-L361 PolarHBondContact O-N 3Å; I358-L362 HydrophobicContact CG2-CD1 3.74Å; I358-L362 HydrophobicContact CG2-CG 4.01Å; I358-L362 WeakPolarHBondContact O-CG 3.41Å; I358-L362 PolarHBondContact O-N 3.45Å; I358-C486 HydrophobicContact CB-CB 4.46Å; I358-C486 HydrophobicContact CG2-CB 4.19Å |
| 359 | P | 89.1 | Confident | 88.3 | Confident | 9 Ų | 9 | 46.6 Ų | 46.6 | 6% | 0.058 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -60.9 | -41.3 | -178.1 | -26.2 | 37.6 | 0 | 0 | 0 | 113.6 | F346 M349 L362 F363 I482 C486 | F346-P359 VanDerWaalsContact O-CB 3.3Å; F346-P359 WeakPolarHBondContact O-CB 3.24Å; M349-P359 HydrophobicContact CB-CG 4.34Å; P359-L362 PolarHBondContact O-N 3.22Å; P359-F363 WeakPolarHBondContact O-CB 3.27Å; P359-F363 PolarHBondContact O-N 3.16Å; P359-I482 HydrophobicContact CB-CG2 3.81Å; P359-I482 HydrophobicContact CG-CG2 3.51Å; P359-C486 HydrophobicContact CG-CB 4.28Å |
| 360 | A | 87.9 | Confident | 88.8 | Confident | 1 Ų | 1 | 49.9 Ų | 49.9 | 1% | 0.008 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.3 | -45.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112 | F334 L347 P357 I358 F363 N364 | F334-A360 HydrophobicContact CB-CB 4.18Å; F334-A360 HydrophobicContact CD2-CB 3.74Å; F334-A360 HydrophobicContact CG-CB 4.46Å; L347-A360 WeakPolarHBondContact O-CB 3.44Å; P357-A360 HydrophobicContact CB-CB 4.32Å; P357-A360 PolarHBondContact O-N 2.95Å; I358-A360 PolarHBondContact O-N 3.22Å; A360-F363 PolarHBondContact O-N 3.47Å; A360-N364 WeakPolarHBondContact O-CB 3.48Å; A360-N364 PolarHBondContact O-N 3.01Å |
| 361 | L | 89.9 | Confident | 89.2 | Confident | 3 Ų | 3 | 49.6 Ų | 49.6 | 2% | 0.016 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -63.5 | -42.3 | 179.6 | -70.1 | 169.4 | 0 | 0 | 0 | 111.9 | T169 N172 I327 P357 I358 G365 | T169-L361 HydrophobicContact CG2-CB 4.3Å; T169-L361 WeakPolarHBondContact CG2-O 3.44Å; N172-L361 HydrophobicContact CB-CD1 4.01Å; N172-L361 HydrophobicContact CB-CD2 4.13Å; I327-L361 HydrophobicContact CG2-CD2 3.46Å; I327-L361 VanDerWaalsContact CG2-CD2 3.46Å; P357-L361 HydrophobicContact CG-CD1 4.47Å; P357-L361 HydrophobicContact CG-CG 4.49Å; P357-L361 WeakPolarHBondContact O-CG 3.47Å; P357-L361 PolarHBondContact O-N 3.33Å; P357-L361 VanDerWaalsContact O-N 3.16Å; I358-L361 PolarHBondContact O-N 3Å; L361-G365 PolarHBondContact O-N 3.24Å |
| 362 | L | 91.8 | Very high | 89.6 | Confident | 89 Ų | 89 | 49 Ų | 49 | 47% | 0.466 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -66.5 | -42.9 | 177 | -68.8 | 179.1 | 0 | 0 | 0 | 111.9 | T169 I358 P359 G365 F366 | T169-L362 HydrophobicContact CG2-CD2 4.4Å; I358-L362 HydrophobicContact CG2-CD1 3.74Å; I358-L362 HydrophobicContact CG2-CG 4.01Å; I358-L362 WeakPolarHBondContact O-CG 3.41Å; I358-L362 PolarHBondContact O-N 3.45Å; P359-L362 PolarHBondContact O-N 3.22Å; L362-G365 PolarHBondContact O-N 3.28Å; L362-F366 VanDerWaalsContact O-CB 3.27Å; L362-F366 WeakPolarHBondContact O-CB 3.31Å; L362-F366 PolarHBondContact O-N 3Å |
| 363 | F | 91 | Very high | 90 | Very high | 64 Ų | 64 | 51.5 Ų | 51.5 | 28% | 0.281 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -61.4 | -49 | 176.3 | 177.6 | -98.2 | 0 | 0 | 0 | 111.4 | L123 L124 F334 L347 P359 A360 F366 M367 | L123-F363 HydrophobicContact CD2-CD1 4.23Å; L123-F363 HydrophobicContact CD2-CE1 3.81Å; L124-F363 HydrophobicContact CD2-CZ 4.18Å; F334-F363 AromaticContact CE2-CD1 3.97Å; F334-F363 HydrophobicContact CE2-CD1 3.97Å; L347-F363 HydrophobicContact CD2-CB 4.16Å; L347-F363 HydrophobicContact CD2-CG 4.37Å; P359-F363 WeakPolarHBondContact O-CB 3.27Å; P359-F363 PolarHBondContact O-N 3.16Å; A360-F363 PolarHBondContact O-N 3.47Å; F363-F366 PolarHBondContact O-N 3.43Å; F363-M367 HydrophobicContact CD1-CG 4.41Å; F363-M367 HydrophobicContact CE1-CG 3.96Å; F363-M367 HydrophobicContact CE2-CG 4.22Å; F363-M367 HydrophobicContact CZ-CG 3.85Å; F363-M367 HydrophobicContact CZ-SD 4.31Å; F363-M367 WeakPolarHBondContact O-CG 3.27Å; F363-M367 PolarHBondContact O-N 2.99Å |
| 364 | N | 91.4 | Very high | 90.3 | Very high | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -61 | -47 | 177.9 | -177.4 | 54.8 | 0 | 0 | 0 | 111.9 | Q131 F334 A360 F366 M367 A368 | Q131-N364 VanDerWaalsContact CD-ND2 3.26Å; Q131-N364 PolarHBondContact NE2-ND2 3.31Å; Q131-N364 PolarHBondContact NE2-OD1 3.36Å; Q131-N364 VanDerWaalsContact NE2-OD1 3.14Å; Q131-N364 PolarHBondContact OE1-ND2 2.64Å; Q131-N364 PolarHBondContact OE1-OD1 2.96Å; F334-N364 HydrophobicContact CE2-CB 3.81Å; F334-N364 HydrophobicContact CZ-CB 4.18Å; A360-N364 WeakPolarHBondContact O-CB 3.48Å; A360-N364 PolarHBondContact O-N 3.01Å; N364-F366 PolarHBondContact O-N 3.21Å; N364-M367 PolarHBondContact O-N 2.92Å; N364-A368 WeakPolarHBondContact O-CB 3.1Å; N364-A368 PolarHBondContact O-N 3.03Å |
| 365 | G | 93.1 | Very high | 90.7 | Very high | 5 Ų | 5 | 48.4 Ų | 48.4 | 5% | 0.052 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60.8 | -43.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L361 L362 A368 L369 | L361-G365 PolarHBondContact O-N 3.24Å; L362-G365 PolarHBondContact O-N 3.28Å; G365-A368 PolarHBondContact O-N 3.39Å; G365-L369 WeakPolarHBondContact O-CG 3.31Å; G365-L369 PolarHBondContact O-N 3.27Å |
| 366 | F | 94.6 | Very high | 91 | Very high | 128 Ų | 128 | 42.3 Ų | 42.3 | 56% | 0.561 | 22% | 0.219 | S | C | * | . | H | α-helix | trans | -61.3 | -45.1 | 175.5 | 176.3 | -105.1 | 0 | 0 | 0 | 112.4 | L362 F363 N364 A368 L369 I370 | L362-F366 VanDerWaalsContact O-CB 3.27Å; L362-F366 WeakPolarHBondContact O-CB 3.31Å; L362-F366 PolarHBondContact O-N 3Å; F363-F366 PolarHBondContact O-N 3.43Å; N364-F366 PolarHBondContact O-N 3.21Å; F366-A368 VanDerWaalsContact C-N 3.33Å; F366-A368 PolarHBondContact O-N 3.42Å; F366-L369 WeakPolarHBondContact O-CB 3.24Å; F366-L369 PolarHBondContact O-N 3.02Å; F366-I370 HydrophobicContact CD1-CD1 4.02Å; F366-I370 HydrophobicContact CE1-CD1 3.49Å; F366-I370 VanDerWaalsContact CE1-CD1 3.49Å; F366-I370 HydrophobicContact CE1-CG1 4.39Å; F366-I370 HydrophobicContact CZ-CD1 3.82Å; F366-I370 HydrophobicContact CZ-CG1 4.36Å; F366-I370 PolarHBondContact O-N 3.02Å; F366-I370 VanDerWaalsContact O-N 3.16Å |
| 367 | M | 94.3 | Very high | 91.4 | Very high | 25 Ų | 25 | 43.1 Ų | 43.1 | 12% | 0.123 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.5 | -42 | 175.6 | -72.7 | -60.4 | -58.8 | 0 | 0 | 111.7 | L124 P128 F363 N364 L369 I370 Y371 | L124-M367 HydrophobicContact CD2-CE 3.8Å; L124-M367 HydrophobicContact CD2-SD 4.31Å; P128-M367 HydrophobicContact CB-CB 3.77Å; P128-M367 HydrophobicContact CG-CB 3.55Å; P128-M367 HydrophobicContact CG-CG 4.44Å; F363-M367 HydrophobicContact CD1-CG 4.41Å; F363-M367 HydrophobicContact CE1-CG 3.96Å; F363-M367 HydrophobicContact CE2-CG 4.22Å; F363-M367 HydrophobicContact CZ-CG 3.85Å; F363-M367 HydrophobicContact CZ-SD 4.31Å; F363-M367 WeakPolarHBondContact O-CG 3.27Å; F363-M367 PolarHBondContact O-N 2.99Å; N364-M367 PolarHBondContact O-N 2.92Å; M367-L369 VanDerWaalsContact C-N 3.29Å; M367-L369 PolarHBondContact O-N 3.04Å; M367-I370 WeakPolarHBondContact O-CB 3.49Å; M367-I370 PolarHBondContact O-N 3.11Å; M367-I370 VanDerWaalsContact O-N 3.13Å; M367-I370 HydrophobicContact SD-CD1 4.08Å; M367-Y371 HydrophobicContact CE-CE2 4.22Å; M367-Y371 WeakPolarHBondContact O-CD2 3.5Å; M367-Y371 PolarHBondContact O-N 3.13Å |
| 368 | A | 95.1 | Very high | 91.5 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.1 | -36.2 | 178 | 0 | 0 | 0 | 0 | 0 | 111.9 | P128 Q131 I165 N364 G365 F366 I370 Y371 L372 | P128-A368 HydrophobicContact CB-CB 4.48Å; Q131-A368 HydrophobicContact CB-CB 4.09Å; I165-A368 HydrophobicContact CD1-CB 3.96Å; I165-A368 HydrophobicContact CG2-CB 4.32Å; N364-A368 WeakPolarHBondContact O-CB 3.1Å; N364-A368 PolarHBondContact O-N 3.03Å; G365-A368 PolarHBondContact O-N 3.39Å; F366-A368 VanDerWaalsContact C-N 3.33Å; F366-A368 PolarHBondContact O-N 3.42Å; A368-I370 PolarHBondContact O-N 3.28Å; A368-Y371 PolarHBondContact O-N 2.89Å; A368-L372 PolarHBondContact O-N 3.42Å |
| 369 | L | 96.1 | Very high | 91.6 | Very high | 54 Ų | 54 | 48.9 Ų | 48.9 | 28% | 0.283 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -63.9 | -36.2 | 173.2 | -67.6 | 175 | 0 | 0 | 0 | 112.7 | A162 I165 G365 F366 M367 Y371 L372 | A162-L369 HydrophobicContact CB-CD2 3.72Å; I165-L369 HydrophobicContact CB-CD2 4.47Å; I165-L369 HydrophobicContact CG2-CD2 4.46Å; G365-L369 WeakPolarHBondContact O-CG 3.31Å; G365-L369 PolarHBondContact O-N 3.27Å; F366-L369 WeakPolarHBondContact O-CB 3.24Å; F366-L369 PolarHBondContact O-N 3.02Å; M367-L369 VanDerWaalsContact C-N 3.29Å; M367-L369 PolarHBondContact O-N 3.04Å; L369-Y371 VanDerWaalsContact C-N 3.33Å; L369-L372 HydrophobicContact CD2-CD1 4.03Å; L369-L372 WeakPolarHBondContact O-CB 3.46Å; L369-L372 PolarHBondContact O-N 2.8Å |
| 370 | I | 95.3 | Very high | 91.7 | Very high | 80 Ų | 80 | 48.4 Ų | 48.4 | 41% | 0.41 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -62.2 | -43.2 | 174.8 | -68.3 | 167.9 | 0 | 0 | 0 | 110.5 | F366 M367 A368 L372 C373 | F366-I370 HydrophobicContact CD1-CD1 4.02Å; F366-I370 HydrophobicContact CE1-CD1 3.49Å; F366-I370 VanDerWaalsContact CE1-CD1 3.49Å; F366-I370 HydrophobicContact CE1-CG1 4.39Å; F366-I370 HydrophobicContact CZ-CD1 3.82Å; F366-I370 HydrophobicContact CZ-CG1 4.36Å; F366-I370 PolarHBondContact O-N 3.02Å; F366-I370 VanDerWaalsContact O-N 3.16Å; M367-I370 WeakPolarHBondContact O-CB 3.49Å; M367-I370 PolarHBondContact O-N 3.11Å; M367-I370 VanDerWaalsContact O-N 3.13Å; M367-I370 HydrophobicContact SD-CD1 4.08Å; A368-I370 PolarHBondContact O-N 3.28Å; I370-L372 PolarHBondContact O-N 2.95Å; I370-C373 VanDerWaalsContact O-CB 3.27Å; I370-C373 WeakPolarHBondContact O-CB 3.2Å; I370-C373 PolarHBondContact O-N 3.49Å |
| 371 | Y | 93.8 | Very high | 91.9 | Very high | 29 Ų | 29 | 48.4 Ų | 48.4 | 11% | 0.114 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -69.3 | -20 | 178.8 | -81.3 | -79.8 | 0 | 0 | 0 | 113.5 | L124 P128 T129 M367 A368 L369 C373 V374 L380 | L124-Y371 WeakPolarHBondContact O-CE2 3.29Å; L124-Y371 PolarHBondContact O-OH 3.34Å; P128-Y371 HydrophobicContact CB-CD2 3.61Å; P128-Y371 HydrophobicContact CB-CE2 3.91Å; T129-Y371 WeakPolarHBondContact OG1-CE1 3.4Å; M367-Y371 HydrophobicContact CE-CE2 4.22Å; M367-Y371 WeakPolarHBondContact O-CD2 3.5Å; M367-Y371 PolarHBondContact O-N 3.13Å; A368-Y371 PolarHBondContact O-N 2.89Å; L369-Y371 VanDerWaalsContact C-N 3.33Å; Y371-C373 PolarHBondContact O-N 3.35Å; Y371-V374 HydrophobicContact CD1-CG2 4.41Å; Y371-V374 WeakPolarHBondContact O-CB 3.31Å; Y371-V374 PolarHBondContact O-N 3.27Å; Y371-V374 VanDerWaalsContact O-N 3.1Å; Y371-L380 HydrophobicContact CD1-CD2 3.52Å; Y371-L380 HydrophobicContact CE1-CD2 4.42Å; Y371-L380 HydrophobicContact CG-CD2 4.26Å |
| 372 | L | 93.9 | Very high | 91.9 | Very high | 10 Ų | 10 | 49 Ų | 49 | 5% | 0.052 | 24% | 0.243 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65 | -18.2 | 169.8 | -69.6 | -176.3 | 0 | 0 | 0 | 113.3 | A132 A135 I136 R158 A161 A162 I165 A368 L369 I370 V374 | A132-L372 HydrophobicContact CB-CD2 4.07Å; A135-L372 HydrophobicContact CB-CD2 4.5Å; I136-L372 HydrophobicContact CD1-CD2 3.96Å; I136-L372 HydrophobicContact CG1-CD2 3.6Å; R158-L372 PolarHBondContact NH1-O 2.81Å; A161-L372 HydrophobicContact CB-CD1 4.17Å; A161-L372 HydrophobicContact CB-CD2 4.03Å; A162-L372 HydrophobicContact CB-CD1 3.72Å; I165-L372 HydrophobicContact CD1-CD1 3.83Å; I165-L372 HydrophobicContact CD1-CD2 4.39Å; I165-L372 HydrophobicContact CD1-CG 4.12Å; A368-L372 PolarHBondContact O-N 3.42Å; L369-L372 HydrophobicContact CD2-CD1 4.03Å; L369-L372 WeakPolarHBondContact O-CB 3.46Å; L369-L372 PolarHBondContact O-N 2.8Å; I370-L372 PolarHBondContact O-N 2.95Å; L372-V374 PolarHBondContact O-N 3.35Å |
| 373 | C | 91.3 | Very high | 91.7 | Very high | 102 Ų | 102 | 46.3 Ų | 46.3 | 69% | 0.689 | 23% | 0.227 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -71.9 | -13.4 | 173.5 | -60.5 | 0 | 0 | 0 | 0 | 113 | I370 Y371 E375 | I370-C373 VanDerWaalsContact O-CB 3.27Å; I370-C373 WeakPolarHBondContact O-CB 3.2Å; I370-C373 PolarHBondContact O-N 3.49Å; Y371-C373 PolarHBondContact O-N 3.35Å; C373-E375 PolarHBondContact O-N 3.48Å |
| 374 | V | 90.6 | Very high | 91.7 | Very high | 37 Ų | 37 | 43.9 Ų | 43.9 | 22% | 0.224 | 22% | 0.216 | C | C | . | . | trans | -77.6 | 117.8 | 175.4 | -177.3 | 0 | 0 | 0 | 0 | 109.3 | R158 Y371 L372 D376 R379 L380 | R158-V374 PolarHBondContact NH1-O 3.1Å; R158-V374 PolarHBondContact NH2-O 3.39Å; Y371-V374 HydrophobicContact CD1-CG2 4.41Å; Y371-V374 WeakPolarHBondContact O-CB 3.31Å; Y371-V374 PolarHBondContact O-N 3.27Å; Y371-V374 VanDerWaalsContact O-N 3.1Å; L372-V374 PolarHBondContact O-N 3.35Å; V374-D376 PolarHBondContact O-N 3.48Å; V374-R379 HydrophobicContact CG1-CB 4.37Å; V374-L380 HydrophobicContact CB-CD1 4.45Å; V374-L380 HydrophobicContact CB-CD2 3.78Å; V374-L380 HydrophobicContact CB-CG 4.11Å; V374-L380 HydrophobicContact CG1-CD2 4.03Å; V374-L380 HydrophobicContact CG1-CG 4.08Å; V374-L380 HydrophobicContact CG2-CD2 3.87Å | ||
| 375 | E | 85.7 | Confident | 91.7 | Very high | 152 Ų | 152 | 43.9 Ų | 43.9 | 71% | 0.71 | 22% | 0.216 | S | C | * | . | S | Bend | trans | -62.6 | -39.8 | -175.1 | -67 | -177.1 | 174.2 | 0 | 0 | 113.9 | Y154 R158 C373 | Y154-E375 HydrophobicContact CE2-CB 4.33Å; Y154-E375 HydrophobicContact CE2-CG 4.28Å; R158-E375 VanDerWaalsContact NH2-C 3.35Å; R158-E375 PolarHBondContact NH2-O 2.8Å; C373-E375 PolarHBondContact O-N 3.48Å |
| 376 | D | 88.5 | Confident | 91.6 | Very high | 60 Ų | 60 | 44.2 Ų | 44.2 | 32% | 0.321 | 22% | 0.216 | S | C | . | . | trans | -99.8 | 121.7 | -174.4 | -174.6 | -3.8 | 0 | 0 | 0 | 111.8 | V374 F378 R379 L380 | V374-D376 PolarHBondContact O-N 3.48Å; D376-F378 VanDerWaalsContact C-N 3.33Å; D376-F378 PolarHBondContact OD1-N 3.13Å; D376-R379 HydrophobicContact CB-CB 4.23Å; D376-R379 HydrophobicContact CB-CG 3.87Å; D376-R379 PolarHBondContact O-N 2.95Å; D376-R379 IonicContact OD2-NE 3.19Å; D376-L380 PolarHBondContact O-N 3.14Å | ||
| 377 | V | 90.5 | Very high | 91.5 | Very high | 18 Ų | 18 | 38.3 Ų | 38.3 | 11% | 0.109 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -67.2 | -33.8 | 177.8 | -177.1 | 0 | 0 | 0 | 0 | 111.4 | V56 V133 I136 R379 L380 I381 | V56-V377 HydrophobicContact CG1-CG1 4.3Å; V133-V377 HydrophobicContact CB-CG1 4.39Å; V133-V377 HydrophobicContact CG1-CG1 3.83Å; V133-V377 HydrophobicContact CG2-CG1 4.13Å; I136-V377 HydrophobicContact CB-CG2 4.14Å; I136-V377 HydrophobicContact CD1-CG2 3.98Å; I136-V377 HydrophobicContact CG2-CG2 3.46Å; I136-V377 VanDerWaalsContact CG2-CG2 3.46Å; V377-R379 VanDerWaalsContact C-N 3.33Å; V377-R379 PolarHBondContact O-N 2.75Å; V377-L380 WeakPolarHBondContact O-CB 3.33Å; V377-L380 PolarHBondContact O-N 3.27Å; V377-I381 HydrophobicContact CG1-CD1 4.29Å; V377-I381 WeakPolarHBondContact O-CG1 3.03Å; V377-I381 PolarHBondContact O-N 3.35Å |
| 378 | F | 89.6 | Confident | 91.3 | Very high | 31 Ų | 31 | 37.4 Ų | 37.4 | 14% | 0.136 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -71.2 | -30.5 | -180 | -66 | -70.6 | 0 | 0 | 0 | 111.8 | V56 K59 I63 D376 L380 I381 N382 | V56-F378 HydrophobicContact CG1-CE1 4.04Å; V56-F378 HydrophobicContact CG1-CZ 4.18Å; K59-F378 HydrophobicContact CB-CZ 4.14Å; K59-F378 HydrophobicContact CD-CE2 4.37Å; K59-F378 HydrophobicContact CD-CZ 4.35Å; K59-F378 HydrophobicContact CG-CE2 4.23Å; K59-F378 HydrophobicContact CG-CZ 3.91Å; I63-F378 HydrophobicContact CD1-CE2 4.25Å; D376-F378 VanDerWaalsContact C-N 3.33Å; D376-F378 PolarHBondContact OD1-N 3.13Å; F378-L380 VanDerWaalsContact C-N 3.33Å; F378-L380 PolarHBondContact O-N 3.18Å; F378-I381 HydrophobicContact CD1-CD1 3.97Å; F378-I381 HydrophobicContact CE1-CD1 4.28Å; F378-I381 PolarHBondContact O-N 2.76Å; F378-N382 VanDerWaalsContact O-CG 3.27Å; F378-N382 PolarHBondContact O-N 3.43Å; F378-N382 PolarHBondContact O-OD1 2.82Å |
| 379 | R | 90.3 | Very high | 91.2 | Very high | 129 Ų | 129 | 37.4 Ų | 37.4 | 49% | 0.487 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -61.4 | -42.4 | 168.8 | -68.8 | -177.2 | -170 | -179.1 | -0.6 | 111.8 | V374 D376 V377 N382 Y383 | V374-R379 HydrophobicContact CG1-CB 4.37Å; D376-R379 HydrophobicContact CB-CB 4.23Å; D376-R379 HydrophobicContact CB-CG 3.87Å; D376-R379 PolarHBondContact O-N 2.95Å; D376-R379 IonicContact OD2-NE 3.19Å; V377-R379 VanDerWaalsContact C-N 3.33Å; V377-R379 PolarHBondContact O-N 2.75Å; R379-N382 PolarHBondContact O-N 3.04Å; R379-Y383 HydrophobicContact CB-CE2 4.34Å; R379-Y383 WeakPolarHBondContact O-CD2 3.26Å; R379-Y383 PolarHBondContact O-N 2.83Å |
| 380 | L | 91.8 | Very high | 91 | Very high | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.5 | -46.1 | 173.8 | -65.2 | 174.3 | 0 | 0 | 0 | 111 | T129 A132 V133 I136 Y371 V374 D376 V377 F378 N382 Y383 Y384 | T129-L380 HydrophobicContact CG2-CB 3.67Å; T129-L380 HydrophobicContact CG2-CD2 3.94Å; T129-L380 HydrophobicContact CG2-CG 4.4Å; T129-L380 WeakPolarHBondContact CG2-O 3.27Å; A132-L380 HydrophobicContact CB-CD1 4.17Å; V133-L380 HydrophobicContact CG2-CB 3.5Å; V133-L380 VanDerWaalsContact CG2-CB 3.5Å; V133-L380 HydrophobicContact CG2-CD1 4.12Å; V133-L380 HydrophobicContact CG2-CG 4.46Å; I136-L380 HydrophobicContact CD1-CD1 3.72Å; Y371-L380 HydrophobicContact CD1-CD2 3.52Å; Y371-L380 HydrophobicContact CE1-CD2 4.42Å; Y371-L380 HydrophobicContact CG-CD2 4.26Å; V374-L380 HydrophobicContact CB-CD1 4.45Å; V374-L380 HydrophobicContact CB-CD2 3.78Å; V374-L380 HydrophobicContact CB-CG 4.11Å; V374-L380 HydrophobicContact CG1-CD2 4.03Å; V374-L380 HydrophobicContact CG1-CG 4.08Å; V374-L380 HydrophobicContact CG2-CD2 3.87Å; D376-L380 PolarHBondContact O-N 3.14Å; V377-L380 WeakPolarHBondContact O-CB 3.33Å; V377-L380 PolarHBondContact O-N 3.27Å; F378-L380 VanDerWaalsContact C-N 3.33Å; F378-L380 PolarHBondContact O-N 3.18Å; L380-N382 VanDerWaalsContact C-N 3.28Å; L380-N382 PolarHBondContact O-N 2.95Å; L380-Y383 HydrophobicContact CD2-CD2 4.49Å; L380-Y383 PolarHBondContact O-N 3.43Å; L380-Y384 WeakPolarHBondContact O-CB 3.4Å; L380-Y384 PolarHBondContact O-N 3.46Å |
| 381 | I | 91.6 | Very high | 90.9 | Very high | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -58.8 | -40 | 176.1 | -68.2 | 169.8 | 0 | 0 | 0 | 111.4 | V56 V133 F236 V377 F378 S385 | V56-I381 HydrophobicContact CG1-CD1 3.92Å; V133-I381 HydrophobicContact CG1-CD1 4.32Å; V133-I381 HydrophobicContact CG1-CG1 4.09Å; V133-I381 HydrophobicContact CG2-CG1 4.06Å; F236-I381 HydrophobicContact CB-CG2 3.84Å; F236-I381 HydrophobicContact CD1-CD1 4.22Å; F236-I381 HydrophobicContact CD1-CG1 4.23Å; F236-I381 HydrophobicContact CD2-CG1 4.39Å; F236-I381 HydrophobicContact CD2-CG2 4.38Å; F236-I381 HydrophobicContact CE1-CD1 4.49Å; F236-I381 HydrophobicContact CE1-CG1 4.4Å; F236-I381 HydrophobicContact CG-CG1 4.23Å; F236-I381 HydrophobicContact CG-CG2 4.05Å; V377-I381 HydrophobicContact CG1-CD1 4.29Å; V377-I381 WeakPolarHBondContact O-CG1 3.03Å; V377-I381 PolarHBondContact O-N 3.35Å; F378-I381 HydrophobicContact CD1-CD1 3.97Å; F378-I381 HydrophobicContact CE1-CD1 4.28Å; F378-I381 PolarHBondContact O-N 2.76Å; I381-S385 WeakPolarHBondContact O-CB 3.44Å; I381-S385 PolarHBondContact O-N 3.41Å; I381-S385 PolarHBondContact O-OG 3.4Å |
| 382 | N | 89.5 | Confident | 90.9 | Very high | 15 Ų | 15 | 34.4 Ų | 34.4 | 8% | 0.08 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -67.6 | -44.6 | 177.6 | -69.1 | -5.3 | 0 | 0 | 0 | 112.1 | Y232 F378 R379 L380 Y384 S385 F386 D438 | Y232-N382 HydrophobicContact CD2-CB 4.45Å; F378-N382 VanDerWaalsContact O-CG 3.27Å; F378-N382 PolarHBondContact O-N 3.43Å; F378-N382 PolarHBondContact O-OD1 2.82Å; R379-N382 PolarHBondContact O-N 3.04Å; L380-N382 VanDerWaalsContact C-N 3.28Å; L380-N382 PolarHBondContact O-N 2.95Å; N382-Y384 VanDerWaalsContact C-N 3.34Å; N382-Y384 PolarHBondContact O-N 3.21Å; N382-S385 PolarHBondContact O-N 3.09Å; N382-F386 WeakPolarHBondContact O-CB 3.29Å; N382-F386 PolarHBondContact O-N 2.93Å; N382-D438 PolarHBondContact ND2-OD2 3.42Å |
| 383 | Y | 87 | Confident | 90.9 | Very high | 33 Ų | 33 | 34.1 Ų | 34.1 | 13% | 0.129 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.1 | -46.9 | 175.7 | -71.1 | -47.4 | 0 | 0 | 0 | 112.3 | R379 L380 S387 N441 I444 | R379-Y383 HydrophobicContact CB-CE2 4.34Å; R379-Y383 WeakPolarHBondContact O-CD2 3.26Å; R379-Y383 PolarHBondContact O-N 2.83Å; L380-Y383 HydrophobicContact CD2-CD2 4.49Å; L380-Y383 PolarHBondContact O-N 3.43Å; Y383-S387 PolarHBondContact O-N 3.38Å; Y383-S387 PolarHBondContact O-OG 3.4Å; Y383-N441 HydrophobicContact CD1-CB 3.96Å; Y383-N441 VanDerWaalsContact CE1-CA 3.48Å; Y383-N441 HydrophobicContact CE1-CB 3.47Å; Y383-N441 VanDerWaalsContact CE1-CB 3.47Å; Y383-N441 WeakPolarHBondContact CE1-O 3.23Å; Y383-N441 PolarHBondContact OH-OD1 2.95Å; Y383-I444 HydrophobicContact CE1-CB 4.19Å; Y383-I444 HydrophobicContact CE1-CD1 4.4Å; Y383-I444 HydrophobicContact CE1-CG2 4.24Å |
| 384 | Y | 91.5 | Very high | 91.1 | Very high | 13 Ų | 13 | 30.4 Ų | 30.4 | 5% | 0.051 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -59.6 | -54.9 | 175.2 | 168.6 | -93.1 | 0 | 0 | 0 | 110.5 | I126 F236 S239 L380 N382 F386 S387 Y388 | I126-Y384 HydrophobicContact CB-CD2 4.44Å; I126-Y384 HydrophobicContact CG2-CD2 3.75Å; I126-Y384 HydrophobicContact CG2-CE2 3.44Å; I126-Y384 VanDerWaalsContact CG2-CE2 3.44Å; I126-Y384 WeakPolarHBondContact O-CD2 3.28Å; F236-Y384 AromaticContact CD2-CD1 3.54Å; F236-Y384 HydrophobicContact CD2-CD1 3.54Å; F236-Y384 AromaticContact CD2-CE1 3.61Å; F236-Y384 HydrophobicContact CD2-CE1 3.61Å; F236-Y384 HydrophobicContact CD2-CG 4.35Å; F236-Y384 AromaticContact CE2-CD1 4Å; F236-Y384 HydrophobicContact CE2-CD1 4Å; F236-Y384 HydrophobicContact CE2-CE1 4.08Å; F236-Y384 HydrophobicContact CE2-CG 4.4Å; S239-Y384 WeakPolarHBondContact CB-OH 3.23Å; S239-Y384 PolarHBondContact OG-OH 2.89Å; L380-Y384 WeakPolarHBondContact O-CB 3.4Å; L380-Y384 PolarHBondContact O-N 3.46Å; N382-Y384 VanDerWaalsContact C-N 3.34Å; N382-Y384 PolarHBondContact O-N 3.21Å; Y384-F386 PolarHBondContact O-N 2.9Å; Y384-S387 PolarHBondContact O-N 3.48Å; Y384-Y388 HydrophobicContact CE1-CD1 4.44Å; Y384-Y388 HydrophobicContact CE1-CG 4.28Å; Y384-Y388 HydrophobicContact CE2-CD2 4.38Å; Y384-Y388 HydrophobicContact CE2-CG 4.5Å; Y384-Y388 WeakPolarHBondContact O-CB 3.32Å; Y384-Y388 PolarHBondContact O-N 3.48Å |
| 385 | S | 91.8 | Very high | 91.2 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -63.4 | -44.9 | -170.9 | -62.8 | 0 | 0 | 0 | 0 | 111.9 | I381 N382 S387 Y388 W389 | I381-S385 WeakPolarHBondContact O-CB 3.44Å; I381-S385 PolarHBondContact O-N 3.41Å; I381-S385 PolarHBondContact O-OG 3.4Å; N382-S385 PolarHBondContact O-N 3.09Å; S385-S387 PolarHBondContact O-N 3.23Å; S385-Y388 PolarHBondContact O-N 3.33Å; S385-W389 WeakPolarHBondContact O-CB 3.4Å; S385-W389 PolarHBondContact O-N 3.22Å |
| 386 | F | 91.1 | Very high | 91.6 | Very high | 12 Ų | 12 | 21.5 Ų | 21.5 | 5% | 0.053 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -56.7 | -52.7 | 177.5 | 176.5 | -91.9 | 0 | 0 | 0 | 111.7 | Y232 N382 Y384 F390 V431 L435 I446 | Y232-F386 HydrophobicContact CE2-CB 4.2Å; Y232-F386 WeakPolarHBondContact OH-CA 3.19Å; N382-F386 WeakPolarHBondContact O-CB 3.29Å; N382-F386 PolarHBondContact O-N 2.93Å; Y384-F386 PolarHBondContact O-N 2.9Å; F386-F390 WeakPolarHBondContact O-CB 3.35Å; F386-F390 PolarHBondContact O-N 2.89Å; F386-F390 VanDerWaalsContact O-N 3.11Å; F386-V431 HydrophobicContact CE2-CG1 3.82Å; F386-V431 HydrophobicContact CZ-CG1 4.16Å; F386-L435 HydrophobicContact CE2-CD2 4.26Å; F386-L435 HydrophobicContact CE2-CG 4.21Å; F386-L435 HydrophobicContact CZ-CD2 4.33Å; F386-I446 HydrophobicContact CE1-CD1 4.38Å; F386-I446 HydrophobicContact CE1-CG1 3.77Å; F386-I446 HydrophobicContact CZ-CD1 3.93Å; F386-I446 HydrophobicContact CZ-CG1 3.83Å |
| 387 | S | 91.4 | Very high | 92 | Very high | 4 Ų | 4 | 22.5 Ų | 22.5 | 3% | 0.028 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -67.3 | -44.8 | -177 | -54.8 | 0 | 0 | 0 | 0 | 111.4 | Y383 Y384 S385 F391 | Y383-S387 PolarHBondContact O-N 3.38Å; Y383-S387 PolarHBondContact O-OG 3.4Å; Y384-S387 PolarHBondContact O-N 3.48Å; S385-S387 PolarHBondContact O-N 3.23Å; S387-F391 WeakPolarHBondContact O-CD2 3.3Å; S387-F391 PolarHBondContact O-N 2.99Å |
| 388 | Y | 91.8 | Very high | 92.1 | Very high | 7 Ų | 7 | 21.7 Ų | 21.7 | 3% | 0.027 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -61.3 | -52.6 | -179.8 | -178.7 | -100.3 | 0 | 0 | 0 | 111.3 | I126 D242 Y384 S385 F390 F391 V392 | I126-Y388 HydrophobicContact CG2-CD2 4.06Å; D242-Y388 VanDerWaalsContact CG-OH 3.22Å; D242-Y388 PolarHBondContact OD1-OH 3.42Å; D242-Y388 PolarHBondContact OD2-OH 2.85Å; Y384-Y388 HydrophobicContact CE1-CD1 4.44Å; Y384-Y388 HydrophobicContact CE1-CG 4.28Å; Y384-Y388 HydrophobicContact CE2-CD2 4.38Å; Y384-Y388 HydrophobicContact CE2-CG 4.5Å; Y384-Y388 WeakPolarHBondContact O-CB 3.32Å; Y384-Y388 PolarHBondContact O-N 3.48Å; S385-Y388 PolarHBondContact O-N 3.33Å; Y388-F390 VanDerWaalsContact C-N 3.35Å; Y388-F390 PolarHBondContact O-N 3.29Å; Y388-F391 PolarHBondContact O-N 3.25Å; Y388-V392 HydrophobicContact CD1-CG2 4.05Å; Y388-V392 HydrophobicContact CD2-CG2 4.41Å; Y388-V392 HydrophobicContact CE1-CG2 3.73Å; Y388-V392 HydrophobicContact CE2-CG2 4.11Å; Y388-V392 HydrophobicContact CG-CG2 4.38Å; Y388-V392 VanDerWaalsContact O-CG2 3.27Å; Y388-V392 WeakPolarHBondContact O-CG2 3.39Å; Y388-V392 PolarHBondContact O-N 3.04Å |
| 389 | W | 92 | Very high | 92.3 | Very high | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -68.2 | -31.9 | -177.6 | -68.3 | 119.3 | 0 | 0 | 0 | 113.3 | F81 L235 W241 S385 V392 G393 F423 L430 | F81-W389 HydrophobicContact CD1-CH2 4.35Å; F81-W389 HydrophobicContact CD1-CZ3 4.39Å; F81-W389 HydrophobicContact CE1-CD2 4.14Å; F81-W389 AromaticContact CE1-CE3 3.65Å; F81-W389 HydrophobicContact CE1-CE3 3.65Å; F81-W389 AromaticContact CE1-CH2 3.7Å; F81-W389 HydrophobicContact CE1-CH2 3.7Å; F81-W389 HydrophobicContact CE1-CZ2 4.19Å; F81-W389 AromaticContact CE1-CZ3 3.4Å; F81-W389 HydrophobicContact CE1-CZ3 3.4Å; F81-W389 VanDerWaalsContact CE1-CZ3 3.4Å; F81-W389 AromaticContact CZ-CE3 3.94Å; F81-W389 HydrophobicContact CZ-CE3 3.94Å; F81-W389 HydrophobicContact CZ-CZ3 4.04Å; L235-W389 HydrophobicContact CB-CZ2 3.63Å; L235-W389 HydrophobicContact CD1-CZ2 4.1Å; L235-W389 HydrophobicContact CD2-CH2 4.37Å; L235-W389 HydrophobicContact CD2-CZ2 3.98Å; L235-W389 HydrophobicContact CG-CZ2 4.11Å; W241-W389 HydrophobicContact CZ2-CH2 4.28Å; W241-W389 HydrophobicContact CZ2-CZ3 4.11Å; S385-W389 WeakPolarHBondContact O-CB 3.4Å; S385-W389 PolarHBondContact O-N 3.22Å; W389-V392 HydrophobicContact CE3-CB 4.12Å; W389-V392 HydrophobicContact CE3-CG1 4.08Å; W389-V392 HydrophobicContact CE3-CG2 4.48Å; W389-V392 HydrophobicContact CZ3-CB 4.46Å; W389-V392 HydrophobicContact CZ3-CG1 4.02Å; W389-V392 PolarHBondContact O-N 3.09Å; W389-G393 PolarHBondContact O-N 2.9Å; W389-F423 HydrophobicContact CE3-CZ 4.26Å; W389-F423 HydrophobicContact CZ3-CZ 4.01Å; W389-L430 HydrophobicContact CD2-CD1 4.49Å; W389-L430 HydrophobicContact CG-CD1 4.29Å |
| 390 | F | 92.6 | Very high | 92.5 | Very high | 94 Ų | 94 | 16.2 Ų | 16.2 | 41% | 0.412 | 8% | 0.079 | S | C | . | . | H | α-helix | trans | -57.6 | -50.1 | 171.1 | 175.6 | -99.2 | 0 | 0 | 0 | 111.6 | F386 Y388 G393 L394 V431 | F386-F390 WeakPolarHBondContact O-CB 3.35Å; F386-F390 PolarHBondContact O-N 2.89Å; F386-F390 VanDerWaalsContact O-N 3.11Å; Y388-F390 VanDerWaalsContact C-N 3.35Å; Y388-F390 PolarHBondContact O-N 3.29Å; F390-G393 PolarHBondContact O-N 3.35Å; F390-L394 PolarHBondContact O-N 3.36Å; F390-V431 HydrophobicContact CB-CG2 4.06Å; F390-V431 HydrophobicContact CD2-CG1 4.27Å; F390-V431 HydrophobicContact CD2-CG2 4.33Å |
| 391 | F | 93 | Very high | 92.6 | Very high | 4 Ų | 4 | 19.7 Ų | 19.7 | 2% | 0.018 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -75 | -29.8 | -178.9 | -78.7 | -62.5 | 0 | 0 | 0 | 114.2 | I106 I117 R118 T121 I126 S387 Y388 L394 S395 | I106-F391 HydrophobicContact CD1-CD1 4.1Å; I117-F391 HydrophobicContact CG2-CE1 4.39Å; I117-F391 HydrophobicContact CG2-CZ 3.99Å; R118-F391 HydrophobicContact CB-CD1 3.78Å; R118-F391 HydrophobicContact CB-CE1 3.8Å; R118-F391 HydrophobicContact CB-CG 4.43Å; R118-F391 HydrophobicContact CB-CZ 4.49Å; R118-F391 HydrophobicContact CG-CD1 4.17Å; R118-F391 HydrophobicContact CG-CG 4.42Å; T121-F391 VanDerWaalsContact CB-CE2 3.45Å; T121-F391 HydrophobicContact CG2-CD2 4.37Å; T121-F391 HydrophobicContact CG2-CE2 3.63Å; T121-F391 WeakPolarHBondContact OG1-CE2 3.4Å; I126-F391 HydrophobicContact CD1-CD2 4.46Å; S387-F391 WeakPolarHBondContact O-CD2 3.3Å; S387-F391 PolarHBondContact O-N 2.99Å; Y388-F391 PolarHBondContact O-N 3.25Å; F391-L394 HydrophobicContact CD1-CD2 4.12Å; F391-L394 HydrophobicContact CE1-CD2 4.35Å; F391-L394 PolarHBondContact O-N 2.93Å; F391-S395 PolarHBondContact O-N 3.1Å; F391-S395 PolarHBondContact O-OG 3.1Å |
| 392 | V | 93 | Very high | 92.6 | Very high | 1 Ų | 1 | 20 Ų | 20 | 1% | 0.006 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -65.3 | -45.2 | 171.4 | 173.1 | 0 | 0 | 0 | 0 | 109.8 | Y89 W241 Y388 W389 L394 S395 I396 F423 | Y89-V392 HydrophobicContact CE2-CG1 3.75Å; Y89-V392 WeakPolarHBondContact OH-CA 3.44Å; W241-V392 HydrophobicContact CH2-CG1 4.06Å; W241-V392 HydrophobicContact CZ2-CG1 4.27Å; Y388-V392 HydrophobicContact CD1-CG2 4.05Å; Y388-V392 HydrophobicContact CD2-CG2 4.41Å; Y388-V392 HydrophobicContact CE1-CG2 3.73Å; Y388-V392 HydrophobicContact CE2-CG2 4.11Å; Y388-V392 HydrophobicContact CG-CG2 4.38Å; Y388-V392 VanDerWaalsContact O-CG2 3.27Å; Y388-V392 WeakPolarHBondContact O-CG2 3.39Å; Y388-V392 PolarHBondContact O-N 3.04Å; W389-V392 HydrophobicContact CE3-CB 4.12Å; W389-V392 HydrophobicContact CE3-CG1 4.08Å; W389-V392 HydrophobicContact CE3-CG2 4.48Å; W389-V392 HydrophobicContact CZ3-CB 4.46Å; W389-V392 HydrophobicContact CZ3-CG1 4.02Å; W389-V392 PolarHBondContact O-N 3.09Å; V392-L394 VanDerWaalsContact C-N 3.35Å; V392-L394 PolarHBondContact O-N 2.79Å; V392-S395 WeakPolarHBondContact O-CB 3.18Å; V392-S395 PolarHBondContact O-N 3.24Å; V392-I396 HydrophobicContact CG1-CD1 4.4Å; V392-I396 PolarHBondContact O-N 3.47Å; V392-I396 VanDerWaalsContact O-N 3.16Å; V392-F423 HydrophobicContact CG1-CE1 3.83Å; V392-F423 HydrophobicContact CG1-CZ 3.72Å |
| 393 | G | 94.6 | Very high | 92.7 | Very high | 4 Ų | 4 | 20.8 Ų | 20.8 | 4% | 0.041 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -58.9 | -43.8 | 172 | 0 | 0 | 0 | 0 | 0 | 112.3 | W389 F390 S395 I396 L397 | W389-G393 PolarHBondContact O-N 2.9Å; F390-G393 PolarHBondContact O-N 3.35Å; G393-S395 VanDerWaalsContact C-N 3.33Å; G393-S395 PolarHBondContact O-N 2.87Å; G393-I396 PolarHBondContact O-N 2.93Å; G393-L397 PolarHBondContact O-N 2.82Å |
| 394 | L | 94.6 | Very high | 92.9 | Very high | 25 Ų | 25 | 29.1 Ų | 29.1 | 13% | 0.131 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -61.3 | -40.5 | 176.1 | -172.1 | 63 | 0 | 0 | 0 | 112.3 | I106 F110 L114 F390 F391 V392 I396 L397 G398 | I106-L394 HydrophobicContact CD1-CB 4.44Å; I106-L394 HydrophobicContact CD1-CD2 4.1Å; I106-L394 HydrophobicContact CD1-CG 4.34Å; I106-L394 HydrophobicContact CG1-CD2 4.5Å; I106-L394 HydrophobicContact CG1-CG 4.45Å; I106-L394 HydrophobicContact CG2-CD2 4.47Å; F110-L394 HydrophobicContact CD2-CD1 4.38Å; F110-L394 HydrophobicContact CD2-CG 4.39Å; F110-L394 HydrophobicContact CE2-CD1 3.84Å; F110-L394 HydrophobicContact CE2-CG 4.03Å; F110-L394 WeakPolarHBondContact CE2-O 3.41Å; F110-L394 HydrophobicContact CZ-CD1 4.16Å; L114-L394 HydrophobicContact CD1-CD2 4.44Å; L114-L394 HydrophobicContact CD2-CD2 4.47Å; F390-L394 PolarHBondContact O-N 3.36Å; F391-L394 HydrophobicContact CD1-CD2 4.12Å; F391-L394 HydrophobicContact CE1-CD2 4.35Å; F391-L394 PolarHBondContact O-N 2.93Å; V392-L394 VanDerWaalsContact C-N 3.35Å; V392-L394 PolarHBondContact O-N 2.79Å; L394-I396 VanDerWaalsContact C-N 3.33Å; L394-I396 PolarHBondContact O-N 3.36Å; L394-L397 WeakPolarHBondContact O-CB 3.46Å; L394-L397 PolarHBondContact O-N 3.21Å; L394-G398 PolarHBondContact O-N 3.07Å |
| 395 | S | 94.1 | Very high | 93 | Very high | 1 Ų | 1 | 34.4 Ų | 34.4 | 1% | 0.007 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -61.5 | -41.8 | 176.8 | -55 | 0 | 0 | 0 | 0 | 111.8 | Y89 F391 V392 G393 G398 Q399 | Y89-S395 VanDerWaalsContact OH-CB 3.3Å; Y89-S395 WeakPolarHBondContact OH-CB 3.26Å; Y89-S395 PolarHBondContact OH-OG 2.81Å; F391-S395 PolarHBondContact O-N 3.1Å; F391-S395 PolarHBondContact O-OG 3.1Å; V392-S395 WeakPolarHBondContact O-CB 3.18Å; V392-S395 PolarHBondContact O-N 3.24Å; G393-S395 VanDerWaalsContact C-N 3.33Å; G393-S395 PolarHBondContact O-N 2.87Å; S395-G398 WeakPolarHBondContact O-CA 3.41Å; S395-G398 PolarHBondContact O-N 3.39Å; S395-G398 VanDerWaalsContact O-N 3.13Å; S395-Q399 PolarHBondContact O-N 3.27Å; S395-Q399 VanDerWaalsContact O-N 3.08Å |
| 396 | I | 94.4 | Very high | 93 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -75.5 | -32.8 | 179.2 | -69.3 | 167.6 | 0 | 0 | 0 | 111.7 | C88 Y89 V392 G393 L394 G398 Q399 L400 P420 F423 | C88-I396 HydrophobicContact CB-CD1 3.7Å; C88-I396 HydrophobicContact CB-CG1 3.86Å; C88-I396 HydrophobicContact CB-CG2 4.32Å; Y89-I396 HydrophobicContact CD2-CD1 3.92Å; Y89-I396 HydrophobicContact CD2-CG1 4.03Å; Y89-I396 HydrophobicContact CE2-CD1 3.86Å; Y89-I396 HydrophobicContact CE2-CG1 3.86Å; V392-I396 HydrophobicContact CG1-CD1 4.4Å; V392-I396 PolarHBondContact O-N 3.47Å; V392-I396 VanDerWaalsContact O-N 3.16Å; G393-I396 PolarHBondContact O-N 2.93Å; L394-I396 VanDerWaalsContact C-N 3.33Å; L394-I396 PolarHBondContact O-N 3.36Å; I396-G398 PolarHBondContact O-N 3.15Å; I396-Q399 WeakPolarHBondContact O-CB 3.26Å; I396-Q399 PolarHBondContact O-N 3.28Å; I396-Q399 VanDerWaalsContact O-N 3.08Å; I396-L400 PolarHBondContact O-N 3.05Å; I396-L400 VanDerWaalsContact O-N 3.15Å; I396-P420 HydrophobicContact CG2-CB 3.6Å; I396-F423 HydrophobicContact CB-CD1 4.29Å; I396-F423 HydrophobicContact CD1-CD1 3.22Å; I396-F423 HydrophobicContact CD1-CD2 4.48Å; I396-F423 HydrophobicContact CD1-CE1 3.26Å; I396-F423 HydrophobicContact CD1-CG 3.87Å; I396-F423 HydrophobicContact CD1-CZ 3.95Å; I396-F423 HydrophobicContact CG1-CD1 4.32Å; I396-F423 HydrophobicContact CG1-CE1 4.47Å; I396-F423 HydrophobicContact CG2-CD1 4.27Å |
| 397 | L | 95.3 | Very high | 92.9 | Very high | 82 Ų | 82 | 41 Ų | 41 | 43% | 0.429 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -59.3 | -38 | 164.9 | -81.2 | 168 | 0 | 0 | 0 | 111.1 | F110 G393 L394 Q399 L400 Y401 C424 | F110-L397 HydrophobicContact CZ-CB 4.45Å; G393-L397 PolarHBondContact O-N 2.82Å; L394-L397 WeakPolarHBondContact O-CB 3.46Å; L394-L397 PolarHBondContact O-N 3.21Å; L397-Q399 VanDerWaalsContact C-N 3.3Å; L397-Q399 PolarHBondContact O-N 2.94Å; L397-L400 PolarHBondContact O-N 3.27Å; L397-Y401 WeakPolarHBondContact O-CB 3.35Å; L397-Y401 PolarHBondContact O-N 3.48Å; L397-C424 HydrophobicContact CD2-CB 4.48Å |
| 398 | G | 93.2 | Very high | 92.8 | Very high | 1 Ų | 1 | 48.2 Ų | 48.2 | 1% | 0.01 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -58.5 | -39.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L394 S395 I396 Y401 L402 | L394-G398 PolarHBondContact O-N 3.07Å; S395-G398 WeakPolarHBondContact O-CA 3.41Å; S395-G398 PolarHBondContact O-N 3.39Å; S395-G398 VanDerWaalsContact O-N 3.13Å; I396-G398 PolarHBondContact O-N 3.15Å; G398-Y401 PolarHBondContact O-N 3.22Å; G398-L402 WeakPolarHBondContact O-CB 3.3Å; G398-L402 VanDerWaalsContact O-CG 3.28Å; G398-L402 WeakPolarHBondContact O-CG 3.45Å; G398-L402 PolarHBondContact O-N 2.68Å |
| 399 | Q | 93.4 | Very high | 92.7 | Very high | 4 Ų | 4 | 50.9 Ų | 50.9 | 2% | 0.019 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.6 | -47.2 | 173 | -167.9 | -167.9 | -19.6 | 0 | 0 | 111.9 | C88 E91 L92 S395 I396 L397 Y401 L402 R403 | C88-Q399 PolarHBondContact O-OE1 3.37Å; E91-Q399 PolarHBondContact OE1-NE2 2.81Å; E91-Q399 PolarHBondContact OE2-NE2 3.38Å; L92-Q399 HydrophobicContact CD1-CB 4.18Å; L92-Q399 HydrophobicContact CD2-CB 3.72Å; L92-Q399 HydrophobicContact CD2-CG 3.91Å; L92-Q399 HydrophobicContact CG-CB 4Å; L92-Q399 HydrophobicContact CG-CG 4.05Å; S395-Q399 PolarHBondContact O-N 3.27Å; S395-Q399 VanDerWaalsContact O-N 3.08Å; I396-Q399 WeakPolarHBondContact O-CB 3.26Å; I396-Q399 PolarHBondContact O-N 3.28Å; I396-Q399 VanDerWaalsContact O-N 3.08Å; L397-Q399 VanDerWaalsContact C-N 3.3Å; L397-Q399 PolarHBondContact O-N 2.94Å; Q399-Y401 VanDerWaalsContact C-N 3.35Å; Q399-L402 PolarHBondContact O-N 3.07Å; Q399-R403 WeakPolarHBondContact O-CG 3.43Å; Q399-R403 PolarHBondContact O-N 3.16Å |
| 400 | L | 94 | Very high | 92.5 | Very high | 40 Ų | 40 | 59.2 Ų | 59.2 | 21% | 0.209 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -63.4 | -41.9 | 177 | -68.7 | 175.7 | 0 | 0 | 0 | 111.5 | I396 L397 R403 W404 L417 P420 I421 | I396-L400 PolarHBondContact O-N 3.05Å; I396-L400 VanDerWaalsContact O-N 3.15Å; L397-L400 PolarHBondContact O-N 3.27Å; L400-R403 WeakPolarHBondContact O-CB 3.27Å; L400-R403 PolarHBondContact O-N 2.87Å; L400-W404 PolarHBondContact O-N 2.84Å; L400-L417 HydrophobicContact CD2-CD2 3.74Å; L400-P420 HydrophobicContact CD1-CB 4.49Å; L400-P420 HydrophobicContact CD2-CB 3.96Å; L400-P420 HydrophobicContact CD2-CG 3.77Å; L400-P420 HydrophobicContact CG-CB 4.13Å; L400-P420 HydrophobicContact CG-CG 4.48Å; L400-I421 HydrophobicContact CD1-CG1 4.27Å; L400-I421 HydrophobicContact CD2-CG1 4.3Å |
| 401 | Y | 94.3 | Very high | 92.4 | Very high | 73 Ų | 73 | 56.7 Ų | 56.7 | 29% | 0.286 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -61.7 | -45.8 | 176.1 | 177.4 | -103.7 | 0 | 0 | 0 | 112.2 | A109 F110 L397 G398 Q399 R403 W404 K405 | A109-Y401 HydrophobicContact CB-CD1 4.5Å; A109-Y401 WeakPolarHBondContact O-CD1 3.39Å; A109-Y401 WeakPolarHBondContact O-CE1 3.45Å; F110-Y401 HydrophobicContact CE1-CD1 4.48Å; F110-Y401 HydrophobicContact CE1-CG 4.32Å; L397-Y401 WeakPolarHBondContact O-CB 3.35Å; L397-Y401 PolarHBondContact O-N 3.48Å; G398-Y401 PolarHBondContact O-N 3.22Å; Q399-Y401 VanDerWaalsContact C-N 3.35Å; Y401-R403 VanDerWaalsContact C-N 3.3Å; Y401-R403 PolarHBondContact O-N 3.19Å; Y401-W404 PolarHBondContact O-N 2.95Å; Y401-W404 VanDerWaalsContact O-N 3.15Å; Y401-K405 HydrophobicContact CE1-CB 4.44Å; Y401-K405 HydrophobicContact CE1-CD 3.6Å; Y401-K405 HydrophobicContact CE2-CD 4.28Å; Y401-K405 VanDerWaalsContact CZ-CD 3.43Å; Y401-K405 WeakPolarHBondContact O-CB 3.46Å; Y401-K405 PolarHBondContact O-N 2.82Å; Y401-K405 WeakPolarHBondContact OH-CD 3.44Å; Y401-K405 PolarHBondContact OH-NZ 3.32Å |
| 402 | L | 92.3 | Very high | 92.2 | Very high | 8 Ų | 8 | 59.4 Ų | 59.4 | 4% | 0.042 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.2 | -33.6 | 177.3 | -73.5 | 173.1 | 0 | 0 | 0 | 112.1 | I96 A109 G398 Q399 W404 Q406 R411 | I96-L402 HydrophobicContact CD1-CD1 3.94Å; A109-L402 HydrophobicContact CB-CD1 4.11Å; A109-L402 HydrophobicContact CB-CD2 4.5Å; A109-L402 HydrophobicContact CB-CG 4.07Å; G398-L402 WeakPolarHBondContact O-CB 3.3Å; G398-L402 VanDerWaalsContact O-CG 3.28Å; G398-L402 WeakPolarHBondContact O-CG 3.45Å; G398-L402 PolarHBondContact O-N 2.68Å; Q399-L402 PolarHBondContact O-N 3.07Å; L402-W404 VanDerWaalsContact C-N 3.29Å; L402-W404 PolarHBondContact O-N 2.74Å; L402-Q406 CarbonylContact O-C 3.57Å; L402-Q406 VanDerWaalsContact O-C 3.29Å; L402-Q406 WeakPolarHBondContact O-CA 3.27Å; L402-Q406 PolarHBondContact O-N 3.29Å; L402-Q406 VanDerWaalsContact O-O 3.05Å; L402-R411 PolarHBondContact O-NH2 2.94Å; L402-R411 VanDerWaalsContact O-NH2 3.11Å |
| 403 | R | 91.4 | Very high | 91.9 | Very high | 31 Ų | 31 | 61.2 Ų | 61.2 | 12% | 0.117 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -63 | -35.6 | 172.6 | -78.6 | -177.5 | 171.5 | -144.5 | 0.9 | 113.1 | E91 Q399 L400 Y401 R411 L415 L417 | E91-R403 IonicContact OE1-CZ 2.7Å; E91-R403 IonicContact OE1-NE 2.7Å; E91-R403 PolarHBondContact OE1-NE 3.08Å; E91-R403 IonicContact OE1-NH2 3.76Å; E91-R403 PolarHBondContact OE1-NH2 3.43Å; E91-R403 IonicContact OE2-CZ 2.84Å; E91-R403 IonicContact OE2-NH2 3.79Å; E91-R403 PolarHBondContact OE2-NH2 3.22Å; Q399-R403 WeakPolarHBondContact O-CG 3.43Å; Q399-R403 PolarHBondContact O-N 3.16Å; L400-R403 WeakPolarHBondContact O-CB 3.27Å; L400-R403 PolarHBondContact O-N 2.87Å; Y401-R403 VanDerWaalsContact C-N 3.3Å; Y401-R403 PolarHBondContact O-N 3.19Å; R403-R411 VanDerWaalsContact CA-NH2 3.31Å; R403-L415 VanDerWaalsContact CZ-O 3.32Å; R403-L415 PolarHBondContact NH1-O 2.91Å; R403-L415 PolarHBondContact NH2-O 3.33Å; R403-L417 VanDerWaalsContact NH1-CD2 3.31Å |
| 404 | W | 92.1 | Very high | 91.6 | Very high | 208 Ų | 208 | 68.2 Ų | 68.2 | 79% | 0.788 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -80.8 | -45.3 | 178.6 | -179.6 | 62.4 | 0 | 0 | 0 | 112.7 | L400 Y401 L402 | L400-W404 PolarHBondContact O-N 2.84Å; Y401-W404 PolarHBondContact O-N 2.95Å; Y401-W404 VanDerWaalsContact O-N 3.15Å; L402-W404 VanDerWaalsContact C-N 3.29Å; L402-W404 PolarHBondContact O-N 2.74Å |
| 405 | K | 92.9 | Very high | 91.4 | Very high | 124 Ų | 124 | 68.4 Ų | 68.4 | 54% | 0.539 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -81.4 | -33.3 | -174.9 | -174.2 | 172.8 | -179.4 | -173.5 | 0 | 114.1 | Y401 | Y401-K405 HydrophobicContact CE1-CB 4.44Å; Y401-K405 HydrophobicContact CE1-CD 3.6Å; Y401-K405 HydrophobicContact CE2-CD 4.28Å; Y401-K405 VanDerWaalsContact CZ-CD 3.43Å; Y401-K405 WeakPolarHBondContact O-CB 3.46Å; Y401-K405 PolarHBondContact O-N 2.82Å; Y401-K405 WeakPolarHBondContact OH-CD 3.44Å; Y401-K405 PolarHBondContact OH-NZ 3.32Å |
| 406 | Q | 92 | Very high | 91.3 | Very high | 77 Ų | 77 | 71.3 Ų | 71.3 | 36% | 0.36 | 34% | 0.341 | S | S | . | . | trans | -128.3 | 72.8 | -179 | -66.3 | -179.7 | -6.1 | 0 | 0 | 109.3 | L402 D408 R409 R411 | L402-Q406 CarbonylContact O-C 3.57Å; L402-Q406 VanDerWaalsContact O-C 3.29Å; L402-Q406 WeakPolarHBondContact O-CA 3.27Å; L402-Q406 PolarHBondContact O-N 3.29Å; L402-Q406 VanDerWaalsContact O-O 3.05Å; Q406-D408 VanDerWaalsContact C-N 3.32Å; Q406-D408 PolarHBondContact O-N 3.49Å; Q406-R409 HydrophobicContact CB-CB 4.39Å; Q406-R409 VanDerWaalsContact OE1-NH1 3.15Å; Q406-R411 PolarHBondContact O-NH2 2.71Å | ||
| 407 | P | 89.1 | Confident | 91.2 | Very high | 74 Ų | 74 | 75.3 Ų | 75.3 | 48% | 0.481 | 36% | 0.362 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | -35.8 | -176.8 | 26.6 | -33.5 | 0 | 0 | 0 | 112.3 | R409 R411 | P407-R409 VanDerWaalsContact C-N 3.31Å; P407-R409 PolarHBondContact O-N 3.38Å; P407-R411 PolarHBondContact O-NH1 3.45Å |
| 408 | D | 89.4 | Confident | 91 | Very high | 154 Ų | 154 | 76.5 Ų | 76.5 | 82% | 0.824 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | 0.8 | -172.8 | -54.2 | -43.4 | 0 | 0 | 0 | 114.4 | Q406 E410 | Q406-D408 VanDerWaalsContact C-N 3.32Å; Q406-D408 PolarHBondContact O-N 3.49Å; D408-E410 PolarHBondContact O-N 3.35Å |
| 409 | R | 89.6 | Confident | 90.9 | Very high | 64 Ų | 64 | 80.4 Ų | 80.4 | 24% | 0.242 | 38% | 0.382 | C | S | . | . | S | Bend | trans | -62.8 | 132.4 | 175.8 | -171.7 | 173.1 | -175.8 | 140.7 | 1 | 109.5 | T95 E108 Q406 P407 R411 | T95-R409 HydrophobicContact CG2-CG 4.24Å; E108-R409 IonicContact OE1-CZ 3.47Å; E108-R409 IonicContact OE1-NH1 2.68Å; E108-R409 PolarHBondContact OE1-NH1 2.88Å; E108-R409 IonicContact OE1-NH2 3.13Å; E108-R409 PolarHBondContact OE1-NH2 3.47Å; E108-R409 VanDerWaalsContact OE1-NH2 3.13Å; Q406-R409 HydrophobicContact CB-CB 4.39Å; Q406-R409 VanDerWaalsContact OE1-NH1 3.15Å; P407-R409 VanDerWaalsContact C-N 3.31Å; P407-R409 PolarHBondContact O-N 3.38Å; R409-R411 PolarHBondContact O-N 3.46Å |
| 410 | E | 88.3 | Confident | 90.9 | Very high | 174 Ų | 174 | 80.2 Ų | 80.2 | 81% | 0.813 | 38% | 0.381 | S | S | * | . | trans | -59.2 | 126.4 | 175 | -67.8 | -172.1 | 166.5 | 0 | 0 | 110.3 | D408 | D408-E410 PolarHBondContact O-N 3.35Š| ||
| 411 | R | 90.1 | Very high | 90.9 | Very high | 41 Ų | 41 | 81.8 Ų | 81.8 | 16% | 0.155 | 39% | 0.389 | C | S | . | . | trans | -128.5 | 95.5 | 179.4 | -69 | -176.7 | -175.6 | 108.9 | 10.8 | 108.5 | T95 L402 R403 Q406 P407 R409 L413 | T95-R411 HydrophobicContact CG2-CG 4.07Å; L402-R411 PolarHBondContact O-NH2 2.94Å; L402-R411 VanDerWaalsContact O-NH2 3.11Å; R403-R411 VanDerWaalsContact CA-NH2 3.31Å; Q406-R411 PolarHBondContact O-NH2 2.71Å; P407-R411 PolarHBondContact O-NH1 3.45Å; R409-R411 PolarHBondContact O-N 3.46Å; R411-L413 VanDerWaalsContact C-N 3.25Å; R411-L413 PolarHBondContact O-N 2.91Å | ||
| 412 | P | 87.9 | Confident | 90.9 | Very high | 62 Ų | 62 | 81.4 Ų | 81.4 | 40% | 0.403 | 39% | 0.392 | S | S | . | . | S | Bend | trans | -59 | -38.3 | -179.8 | -25.6 | 34.7 | 0 | 0 | 0 | 112.7 | E255 | E255-P412 HydrophobicContact CB-CB 3.95Å; E255-P412 VanDerWaalsContact CD-CB 3.42Å; E255-P412 HydrophobicContact CG-CB 3.53Å; E255-P412 HydrophobicContact CG-CG 3.86Å; E255-P412 WeakPolarHBondContact OE1-CG 3.45Å |
| 413 | L | 87.5 | Confident | 90.9 | Very high | 38 Ų | 38 | 81 Ų | 81 | 20% | 0.199 | 39% | 0.39 | C | S | . | . | S | Bend | trans | -108.1 | 125 | 168.5 | -171.6 | 77.8 | 0 | 0 | 0 | 109.3 | A90 E91 T94 P259 R411 L415 | A90-L413 HydrophobicContact CB-CD2 3.8Å; E91-L413 HydrophobicContact CB-CD2 4.19Å; E91-L413 WeakPolarHBondContact CG-O 3.45Å; T94-L413 HydrophobicContact CG2-CB 4.36Å; T94-L413 WeakPolarHBondContact OG1-CB 3.46Å; P259-L413 HydrophobicContact CB-CD1 4.32Å; P259-L413 HydrophobicContact CB-CD2 4.19Å; P259-L413 HydrophobicContact CG-CD1 4.08Å; P259-L413 HydrophobicContact CG-CD2 3.82Å; P259-L413 HydrophobicContact CG-CG 4.42Å; R411-L413 VanDerWaalsContact C-N 3.25Å; R411-L413 PolarHBondContact O-N 2.91Å; L413-L415 HydrophobicContact CD2-CG 4.49Å |
| 414 | K | 88.1 | Confident | 91 | Very high | 152 Ų | 152 | 80 Ų | 80 | 66% | 0.661 | 39% | 0.387 | S | S | * | . | trans | -127.1 | 107.6 | 175.8 | -172.7 | 178.5 | 179.7 | 177.9 | 0 | 110.3 | ||||
| 415 | L | 89.4 | Confident | 91.1 | Very high | 29 Ų | 29 | 76.8 Ų | 76.8 | 15% | 0.152 | 38% | 0.379 | C | S | . | . | trans | -82 | 160 | 176.2 | -65.1 | 170.4 | 0 | 0 | 0 | 111.9 | L87 E91 R403 L413 Y419 | L87-L415 HydrophobicContact CB-CD1 3.8Å; L87-L415 WeakPolarHBondContact O-CD1 3.3Å; E91-L415 HydrophobicContact CB-CD1 4.28Å; E91-L415 WeakPolarHBondContact OE2-CB 3.49Å; E91-L415 PolarHBondContact OE2-N 2.99Å; R403-L415 VanDerWaalsContact CZ-O 3.32Å; R403-L415 PolarHBondContact NH1-O 2.91Å; R403-L415 PolarHBondContact NH2-O 3.33Å; L413-L415 HydrophobicContact CD2-CG 4.49Å; L415-Y419 HydrophobicContact CB-CD2 4.44Å | ||
| 416 | S | 92.6 | Very high | 91 | Very high | 62 Ų | 62 | 74.1 Ų | 74.1 | 43% | 0.434 | 37% | 0.37 | S | S | . | . | trans | -61.7 | 143.8 | 167.4 | -179.8 | 0 | 0 | 0 | 0 | 110 | I418 Y419 P420 | S416-I418 PolarHBondContact O-N 2.76Å; S416-I418 VanDerWaalsContact O-N 3.11Å; S416-Y419 PolarHBondContact O-N 2.92Å; S416-P420 VanDerWaalsContact O-CD 3.3Å; S416-P420 WeakPolarHBondContact O-CD 3.38Å | ||
| 417 | L | 91.6 | Very high | 91 | Very high | 83 Ų | 83 | 70.8 Ų | 70.8 | 44% | 0.435 | 36% | 0.355 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.5 | -19.9 | 177.6 | -75.7 | 168.8 | 0 | 0 | 0 | 113.1 | L400 R403 Y419 P420 I421 | L400-L417 HydrophobicContact CD2-CD2 3.74Å; R403-L417 VanDerWaalsContact NH1-CD2 3.31Å; L417-Y419 VanDerWaalsContact C-N 3.3Å; L417-Y419 PolarHBondContact O-N 3.16Å; L417-P420 VanDerWaalsContact O-CD 3.29Å; L417-P420 WeakPolarHBondContact O-CD 3.49Å; L417-P420 WeakPolarHBondContact O-CG 3.48Å; L417-I421 HydrophobicContact CB-CD1 4.15Å; L417-I421 WeakPolarHBondContact O-CB 3.28Å; L417-I421 WeakPolarHBondContact O-CD1 3.37Å; L417-I421 WeakPolarHBondContact O-CG1 3.3Å; L417-I421 PolarHBondContact O-N 2.65Å |
| 418 | I | 92.1 | Very high | 91.1 | Very high | 107 Ų | 107 | 71.7 Ų | 71.7 | 55% | 0.549 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -58.3 | -42.3 | 179.2 | -62.5 | 172 | 0 | 0 | 0 | 111.1 | S416 I421 I422 | S416-I418 PolarHBondContact O-N 2.76Å; S416-I418 VanDerWaalsContact O-N 3.11Å; I418-I421 PolarHBondContact O-N 2.8Å; I418-I422 HydrophobicContact CG2-CD1 3.5Å; I418-I422 HydrophobicContact CG2-CG1 4.21Å; I418-I422 WeakPolarHBondContact O-CB 3.28Å; I418-I422 VanDerWaalsContact O-CG1 3.28Å; I418-I422 WeakPolarHBondContact O-CG1 3.45Å; I418-I422 PolarHBondContact O-N 3.31Å |
| 419 | Y | 91.9 | Very high | 91.2 | Very high | 83 Ų | 83 | 67.8 Ų | 67.8 | 33% | 0.325 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -60.6 | -58.6 | -178.2 | -66.7 | -85.6 | 0 | 0 | 0 | 113.2 | F84 L87 L415 S416 L417 I421 I422 F423 | F84-Y419 AromaticContact CD1-CD1 3.64Å; F84-Y419 HydrophobicContact CD1-CD1 3.64Å; F84-Y419 AromaticContact CD1-CE1 3.93Å; F84-Y419 HydrophobicContact CD1-CE1 3.93Å; F84-Y419 AromaticContact CE1-CD1 3.75Å; F84-Y419 HydrophobicContact CE1-CD1 3.75Å; F84-Y419 AromaticContact CE1-CE1 3.64Å; F84-Y419 HydrophobicContact CE1-CE1 3.64Å; F84-Y419 HydrophobicContact CG-CD1 4.25Å; F84-Y419 HydrophobicContact CZ-CD1 4.43Å; F84-Y419 HydrophobicContact CZ-CE1 4.42Å; L87-Y419 HydrophobicContact CD1-CE1 4.42Å; L415-Y419 HydrophobicContact CB-CD2 4.44Å; S416-Y419 PolarHBondContact O-N 2.92Å; L417-Y419 VanDerWaalsContact C-N 3.3Å; L417-Y419 PolarHBondContact O-N 3.16Å; Y419-I421 VanDerWaalsContact C-N 3.29Å; Y419-I421 PolarHBondContact O-N 3.3Å; Y419-I422 PolarHBondContact O-N 2.86Å; Y419-F423 WeakPolarHBondContact O-CB 3.44Å; Y419-F423 PolarHBondContact O-N 2.83Å |
| 420 | P | 93.3 | Very high | 91.2 | Very high | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -64.4 | -32.3 | 179.4 | 24 | -34 | 0 | 0 | 0 | 112.8 | C88 I396 L400 S416 L417 F423 C424 | C88-P420 VanDerWaalsContact SG-CA 3.59Å; I396-P420 HydrophobicContact CG2-CB 3.6Å; L400-P420 HydrophobicContact CD1-CB 4.49Å; L400-P420 HydrophobicContact CD2-CB 3.96Å; L400-P420 HydrophobicContact CD2-CG 3.77Å; L400-P420 HydrophobicContact CG-CB 4.13Å; L400-P420 HydrophobicContact CG-CG 4.48Å; S416-P420 VanDerWaalsContact O-CD 3.3Å; S416-P420 WeakPolarHBondContact O-CD 3.38Å; L417-P420 VanDerWaalsContact O-CD 3.29Å; L417-P420 WeakPolarHBondContact O-CD 3.49Å; L417-P420 WeakPolarHBondContact O-CG 3.48Å; P420-F423 PolarHBondContact O-N 3.46Å; P420-C424 WeakPolarHBondContact O-CB 3.13Å; P420-C424 PolarHBondContact O-N 3.23Å; P420-C424 PolarHBondContact O-SG 3.43Å |
| 421 | I | 93.9 | Very high | 91.2 | Very high | 73 Ų | 73 | 57.7 Ų | 57.7 | 37% | 0.374 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -65.5 | -50.1 | 177.1 | -69.3 | 169.5 | 0 | 0 | 0 | 110.8 | L400 L417 I418 Y419 F423 C424 F425 | L400-I421 HydrophobicContact CD1-CG1 4.27Å; L400-I421 HydrophobicContact CD2-CG1 4.3Å; L417-I421 HydrophobicContact CB-CD1 4.15Å; L417-I421 WeakPolarHBondContact O-CB 3.28Å; L417-I421 WeakPolarHBondContact O-CD1 3.37Å; L417-I421 WeakPolarHBondContact O-CG1 3.3Å; L417-I421 PolarHBondContact O-N 2.65Å; I418-I421 PolarHBondContact O-N 2.8Å; Y419-I421 VanDerWaalsContact C-N 3.29Å; Y419-I421 PolarHBondContact O-N 3.3Å; I421-F423 VanDerWaalsContact C-N 3.28Å; I421-F423 PolarHBondContact O-N 3.03Å; I421-C424 PolarHBondContact O-N 2.91Å; I421-F425 HydrophobicContact CG2-CD2 3.85Å; I421-F425 HydrophobicContact CG2-CE2 3.63Å; I421-F425 VanDerWaalsContact O-CD2 3.25Å; I421-F425 WeakPolarHBondContact O-CD2 3.45Å; I421-F425 PolarHBondContact O-N 3.2Å |
| 422 | I | 93.6 | Very high | 91.2 | Very high | 66 Ų | 66 | 59.4 Ų | 59.4 | 34% | 0.338 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -59 | -43.9 | 177.1 | -70 | 173.1 | 0 | 0 | 0 | 110.1 | F84 I418 Y419 C424 F425 L426 | F84-I422 HydrophobicContact CD2-CG2 4.02Å; F84-I422 HydrophobicContact CE2-CG2 3.96Å; I418-I422 HydrophobicContact CG2-CD1 3.5Å; I418-I422 HydrophobicContact CG2-CG1 4.21Å; I418-I422 WeakPolarHBondContact O-CB 3.28Å; I418-I422 VanDerWaalsContact O-CG1 3.28Å; I418-I422 WeakPolarHBondContact O-CG1 3.45Å; I418-I422 PolarHBondContact O-N 3.31Å; Y419-I422 PolarHBondContact O-N 2.86Å; I422-C424 VanDerWaalsContact C-N 3.34Å; I422-C424 PolarHBondContact O-N 2.85Å; I422-F425 PolarHBondContact O-N 3.28Å; I422-L426 HydrophobicContact CG2-CD1 3.77Å; I422-L426 HydrophobicContact CG2-CG 4.29Å; I422-L426 WeakPolarHBondContact O-CG 3.45Å; I422-L426 PolarHBondContact O-N 3.46Å |
| 423 | F | 93.1 | Very high | 91.3 | Very high | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -62.7 | -39.4 | 178.5 | -169.6 | -86.1 | 0 | 0 | 0 | 112.6 | F81 F84 W389 V392 I396 Y419 P420 I421 L426 T427 | F81-F423 HydrophobicContact CD1-CE2 4.18Å; F81-F423 HydrophobicContact CD2-CD2 4.15Å; F81-F423 HydrophobicContact CD2-CE2 4.04Å; F81-F423 AromaticContact CE1-CE2 3.73Å; F81-F423 HydrophobicContact CE1-CE2 3.73Å; F81-F423 HydrophobicContact CE1-CZ 4.01Å; F81-F423 AromaticContact CE2-CD2 3.78Å; F81-F423 HydrophobicContact CE2-CD2 3.78Å; F81-F423 AromaticContact CE2-CE2 3.51Å; F81-F423 HydrophobicContact CE2-CE2 3.51Å; F81-F423 HydrophobicContact CE2-CG 4.48Å; F81-F423 HydrophobicContact CE2-CZ 4.01Å; F81-F423 HydrophobicContact CG-CE2 4.36Å; F81-F423 HydrophobicContact CZ-CD2 4.11Å; F81-F423 HydrophobicContact CZ-CE1 4.35Å; F81-F423 AromaticContact CZ-CE2 3.36Å; F81-F423 HydrophobicContact CZ-CE2 3.36Å; F81-F423 AromaticContact CZ-CZ 3.51Å; F81-F423 HydrophobicContact CZ-CZ 3.51Å; F84-F423 HydrophobicContact CB-CD2 4.19Å; W389-F423 HydrophobicContact CE3-CZ 4.26Å; W389-F423 HydrophobicContact CZ3-CZ 4.01Å; V392-F423 HydrophobicContact CG1-CE1 3.83Å; V392-F423 HydrophobicContact CG1-CZ 3.72Å; I396-F423 HydrophobicContact CB-CD1 4.29Å; I396-F423 HydrophobicContact CD1-CD1 3.22Å; I396-F423 HydrophobicContact CD1-CD2 4.48Å; I396-F423 HydrophobicContact CD1-CE1 3.26Å; I396-F423 HydrophobicContact CD1-CG 3.87Å; I396-F423 HydrophobicContact CD1-CZ 3.95Å; I396-F423 HydrophobicContact CG1-CD1 4.32Å; I396-F423 HydrophobicContact CG1-CE1 4.47Å; I396-F423 HydrophobicContact CG2-CD1 4.27Å; Y419-F423 WeakPolarHBondContact O-CB 3.44Å; Y419-F423 PolarHBondContact O-N 2.83Å; P420-F423 PolarHBondContact O-N 3.46Å; I421-F423 VanDerWaalsContact C-N 3.28Å; I421-F423 PolarHBondContact O-N 3.03Å; F423-L426 PolarHBondContact O-N 2.74Å; F423-T427 HydrophobicContact CD1-CG2 3.77Å; F423-T427 HydrophobicContact CE1-CG2 3.23Å; F423-T427 HydrophobicContact CZ-CG2 3.74Å; F423-T427 WeakPolarHBondContact O-CG2 3.46Å; F423-T427 PolarHBondContact O-N 3.26Å; F423-T427 PolarHBondContact O-OG1 3.48Å |
| 424 | C | 93.4 | Very high | 91.2 | Very high | 10 Ų | 10 | 55.1 Ų | 55.1 | 7% | 0.068 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.4 | -43 | 174 | -70.1 | 0 | 0 | 0 | 0 | 111.7 | L397 P420 I421 I422 T427 I428 | L397-C424 HydrophobicContact CD2-CB 4.48Å; P420-C424 WeakPolarHBondContact O-CB 3.13Å; P420-C424 PolarHBondContact O-N 3.23Å; P420-C424 PolarHBondContact O-SG 3.43Å; I421-C424 PolarHBondContact O-N 2.91Å; I422-C424 VanDerWaalsContact C-N 3.34Å; I422-C424 PolarHBondContact O-N 2.85Å; C424-T427 VanDerWaalsContact CA-OG1 3.31Å; C424-T427 WeakPolarHBondContact CA-OG1 3.4Å; C424-T427 PolarHBondContact O-N 3.32Å; C424-T427 PolarHBondContact O-OG1 3.05Å; C424-I428 VanDerWaalsContact O-CG1 3.24Å; C424-I428 WeakPolarHBondContact O-CG1 3.37Å; C424-I428 PolarHBondContact O-N 3.37Å |
| 425 | F | 92.9 | Very high | 91.1 | Very high | 140 Ų | 140 | 50.7 Ų | 50.7 | 61% | 0.614 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -63.6 | -43.1 | 175.7 | -80.1 | -68.3 | 0 | 0 | 0 | 112.6 | I421 I422 I428 F429 | I421-F425 HydrophobicContact CG2-CD2 3.85Å; I421-F425 HydrophobicContact CG2-CE2 3.63Å; I421-F425 VanDerWaalsContact O-CD2 3.25Å; I421-F425 WeakPolarHBondContact O-CD2 3.45Å; I421-F425 PolarHBondContact O-N 3.2Å; I422-F425 PolarHBondContact O-N 3.28Å; F425-I428 PolarHBondContact O-N 3.22Å; F425-F429 PolarHBondContact O-N 3.3Å |
| 426 | L | 91.6 | Very high | 91 | Very high | 67 Ų | 67 | 55.3 Ų | 55.3 | 35% | 0.351 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -67.7 | -36.3 | 178.6 | -67.7 | 173.9 | 0 | 0 | 0 | 112 | F81 I422 F423 F429 L430 | F81-L426 HydrophobicContact CD2-CB 3.63Å; F81-L426 HydrophobicContact CD2-CD1 3.7Å; F81-L426 HydrophobicContact CD2-CG 4.27Å; F81-L426 HydrophobicContact CE2-CB 3.45Å; F81-L426 VanDerWaalsContact CE2-CB 3.45Å; F81-L426 HydrophobicContact CE2-CD1 4.35Å; I422-L426 HydrophobicContact CG2-CD1 3.77Å; I422-L426 HydrophobicContact CG2-CG 4.29Å; I422-L426 WeakPolarHBondContact O-CG 3.45Å; I422-L426 PolarHBondContact O-N 3.46Å; F423-L426 PolarHBondContact O-N 2.74Å; L426-F429 WeakPolarHBondContact O-CB 3.32Å; L426-F429 PolarHBondContact O-N 3.11Å; L426-L430 WeakPolarHBondContact O-CG 3.35Å; L426-L430 PolarHBondContact O-N 3.49Å |
| 427 | T | 91.8 | Very high | 90.5 | Very high | 7 Ų | 7 | 54.4 Ų | 54.4 | 4% | 0.043 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -68.9 | -35.7 | 173 | 44.8 | 0 | 0 | 0 | 0 | 112.7 | F81 F423 C424 F429 L430 V431 | F81-T427 HydrophobicContact CE2-CG2 4.23Å; F81-T427 HydrophobicContact CZ-CG2 3.84Å; F423-T427 HydrophobicContact CD1-CG2 3.77Å; F423-T427 HydrophobicContact CE1-CG2 3.23Å; F423-T427 HydrophobicContact CZ-CG2 3.74Å; F423-T427 WeakPolarHBondContact O-CG2 3.46Å; F423-T427 PolarHBondContact O-N 3.26Å; F423-T427 PolarHBondContact O-OG1 3.48Å; C424-T427 VanDerWaalsContact CA-OG1 3.31Å; C424-T427 WeakPolarHBondContact CA-OG1 3.4Å; C424-T427 PolarHBondContact O-N 3.32Å; C424-T427 PolarHBondContact O-OG1 3.05Å; T427-F429 VanDerWaalsContact C-N 3.32Å; T427-F429 PolarHBondContact O-N 3.45Å; T427-L430 PolarHBondContact O-N 2.77Å; T427-V431 WeakPolarHBondContact O-CG2 3.31Å; T427-V431 PolarHBondContact O-N 2.85Å |
| 428 | I | 92.1 | Very high | 90.1 | Very high | 94 Ų | 94 | 51.9 Ų | 51.9 | 48% | 0.482 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -59.4 | -45.9 | 171 | -70.4 | 164.4 | 0 | 0 | 0 | 110.1 | C424 F425 L430 V431 V432 | C424-I428 VanDerWaalsContact O-CG1 3.24Å; C424-I428 WeakPolarHBondContact O-CG1 3.37Å; C424-I428 PolarHBondContact O-N 3.37Å; F425-I428 PolarHBondContact O-N 3.22Å; I428-L430 VanDerWaalsContact C-N 3.33Å; I428-L430 PolarHBondContact O-N 3.42Å; I428-V431 PolarHBondContact O-N 3.49Å; I428-V432 HydrophobicContact CG2-CG2 3.83Å; I428-V432 VanDerWaalsContact O-CB 3.3Å; I428-V432 WeakPolarHBondContact O-CB 3.5Å; I428-V432 VanDerWaalsContact O-CG2 3.27Å; I428-V432 WeakPolarHBondContact O-CG2 3.19Å; I428-V432 PolarHBondContact O-N 3.49Å |
| 429 | F | 91 | Very high | 89.9 | Confident | 71 Ų | 71 | 49.8 Ų | 49.8 | 31% | 0.311 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -56.6 | -48.1 | 174.5 | 172.3 | -93.1 | 0 | 0 | 0 | 111.5 | A228 L231 F425 L426 T427 V431 V433 | A228-F429 HydrophobicContact CB-CE1 4.04Å; A228-F429 HydrophobicContact CB-CZ 4.26Å; L231-F429 HydrophobicContact CD1-CE1 4.07Å; F425-F429 PolarHBondContact O-N 3.3Å; L426-F429 WeakPolarHBondContact O-CB 3.32Å; L426-F429 PolarHBondContact O-N 3.11Å; T427-F429 VanDerWaalsContact C-N 3.32Å; T427-F429 PolarHBondContact O-N 3.45Å; F429-V431 PolarHBondContact O-N 3.31Å; F429-V433 HydrophobicContact CD2-CG2 3.64Å; F429-V433 HydrophobicContact CE2-CB 4.49Å; F429-V433 HydrophobicContact CE2-CG2 3.55Å; F429-V433 HydrophobicContact CG-CG2 4.29Å; F429-V433 HydrophobicContact CZ-CG2 4.11Å; F429-V433 WeakPolarHBondContact O-CB 3.34Å; F429-V433 WeakPolarHBondContact O-CG2 3.26Å; F429-V433 PolarHBondContact O-N 3.4Å |
| 430 | L | 88.9 | Confident | 89.7 | Confident | 5 Ų | 5 | 51.7 Ų | 51.7 | 3% | 0.026 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.9 | -22.6 | 179.2 | -72.3 | 177.4 | 0 | 0 | 0 | 113.8 | F81 L231 Y232 L235 W389 L426 T427 I428 P434 | F81-L430 HydrophobicContact CE1-CD1 3.83Å; F81-L430 HydrophobicContact CE2-CD1 4.01Å; F81-L430 HydrophobicContact CZ-CD1 3.47Å; F81-L430 VanDerWaalsContact CZ-CD1 3.47Å; L231-L430 HydrophobicContact CB-CD2 4.05Å; L231-L430 HydrophobicContact CD1-CD2 4.35Å; Y232-L430 HydrophobicContact CD1-CD2 4.04Å; Y232-L430 HydrophobicContact CE1-CB 4.06Å; Y232-L430 HydrophobicContact CE1-CD2 3.95Å; Y232-L430 VanDerWaalsContact CE1-O 3.29Å; Y232-L430 WeakPolarHBondContact CE1-O 3.28Å; Y232-L430 VanDerWaalsContact CZ-O 3.24Å; Y232-L430 PolarHBondContact OH-O 2.87Å; L235-L430 HydrophobicContact CD1-CD1 3.48Å; L235-L430 VanDerWaalsContact CD1-CD1 3.48Å; L235-L430 HydrophobicContact CD1-CD2 4.12Å; L235-L430 HydrophobicContact CD1-CG 4.47Å; W389-L430 HydrophobicContact CD2-CD1 4.49Å; W389-L430 HydrophobicContact CG-CD1 4.29Å; L426-L430 WeakPolarHBondContact O-CG 3.35Å; L426-L430 PolarHBondContact O-N 3.49Å; T427-L430 PolarHBondContact O-N 2.77Å; I428-L430 VanDerWaalsContact C-N 3.33Å; I428-L430 PolarHBondContact O-N 3.42Å; L430-P434 WeakPolarHBondContact O-CD 3.41Å; L430-P434 VanDerWaalsContact O-CG 3.3Å; L430-P434 WeakPolarHBondContact O-CG 3.37Å |
| 431 | V | 89.3 | Confident | 89.2 | Confident | 22 Ų | 22 | 52.6 Ų | 52.6 | 13% | 0.133 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -94 | -42.1 | 177.5 | 172.4 | 0 | 0 | 0 | 0 | 111.3 | F386 F390 T427 I428 F429 L435 | F386-V431 HydrophobicContact CE2-CG1 3.82Å; F386-V431 HydrophobicContact CZ-CG1 4.16Å; F390-V431 HydrophobicContact CB-CG2 4.06Å; F390-V431 HydrophobicContact CD2-CG1 4.27Å; F390-V431 HydrophobicContact CD2-CG2 4.33Å; T427-V431 WeakPolarHBondContact O-CG2 3.31Å; T427-V431 PolarHBondContact O-N 2.85Å; I428-V431 PolarHBondContact O-N 3.49Å; F429-V431 PolarHBondContact O-N 3.31Å; V431-L435 WeakPolarHBondContact O-CG 3.43Å |
| 432 | V | 90 | Very high | 88.8 | Confident | 76 Ų | 76 | 49.3 Ų | 49.3 | 46% | 0.461 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -74.9 | -40.1 | -173.9 | 174.1 | 0 | 0 | 0 | 0 | 111.9 | I428 L435 | I428-V432 HydrophobicContact CG2-CG2 3.83Å; I428-V432 VanDerWaalsContact O-CB 3.3Å; I428-V432 WeakPolarHBondContact O-CB 3.5Å; I428-V432 VanDerWaalsContact O-CG2 3.27Å; I428-V432 WeakPolarHBondContact O-CG2 3.19Å; I428-V432 PolarHBondContact O-N 3.49Å; V432-L435 WeakPolarHBondContact O-CB 3.47Å; V432-L435 PolarHBondContact O-N 2.92Å |
| 433 | V | 88.8 | Confident | 88.6 | Confident | 10 Ų | 10 | 50.9 Ų | 50.9 | 6% | 0.061 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.7 | -45.1 | -176.7 | 168.4 | 0 | 0 | 0 | 0 | 112.9 | A228 F429 L435 Y436 S437 | A228-V433 HydrophobicContact CB-CB 3.94Å; A228-V433 HydrophobicContact CB-CG1 3.38Å; F429-V433 HydrophobicContact CD2-CG2 3.64Å; F429-V433 HydrophobicContact CE2-CB 4.49Å; F429-V433 HydrophobicContact CE2-CG2 3.55Å; F429-V433 HydrophobicContact CG-CG2 4.29Å; F429-V433 HydrophobicContact CZ-CG2 4.11Å; F429-V433 WeakPolarHBondContact O-CB 3.34Å; F429-V433 WeakPolarHBondContact O-CG2 3.26Å; F429-V433 PolarHBondContact O-N 3.4Å; V433-L435 PolarHBondContact O-N 3.31Å; V433-Y436 HydrophobicContact CB-CE1 4.02Å; V433-Y436 HydrophobicContact CG1-CE1 4.11Å; V433-Y436 HydrophobicContact CG1-CE2 4.24Å; V433-Y436 VanDerWaalsContact CG1-OH 3.31Å; V433-Y436 WeakPolarHBondContact CG1-OH 3.29Å; V433-Y436 HydrophobicContact CG2-CE1 3.98Å; V433-Y436 WeakPolarHBondContact O-CD1 3.39Å; V433-Y436 WeakPolarHBondContact O-CE1 3.26Å; V433-Y436 PolarHBondContact O-N 2.95Å; V433-S437 PolarHBondContact O-N 2.96Å; V433-S437 VanDerWaalsContact O-N 3.13Å; V433-S437 PolarHBondContact O-OG 2.86Å |
| 434 | P | 85.7 | Confident | 88.3 | Confident | 1 Ų | 1 | 54.3 Ų | 54.3 | 1% | 0.006 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -67.5 | -21.5 | 177.5 | -29.5 | 44.1 | 0 | 0 | 0 | 113.9 | A228 Y232 L430 Y436 S437 D438 S442 | A228-P434 HydrophobicContact CB-CG 4.23Å; Y232-P434 HydrophobicContact CE1-CG 4.07Å; Y232-P434 HydrophobicContact CE2-CB 4.07Å; Y232-P434 HydrophobicContact CE2-CG 3.85Å; Y232-P434 WeakPolarHBondContact OH-CG 3.27Å; L430-P434 WeakPolarHBondContact O-CD 3.41Å; L430-P434 VanDerWaalsContact O-CG 3.3Å; L430-P434 WeakPolarHBondContact O-CG 3.37Å; P434-Y436 PolarHBondContact O-N 3.35Å; P434-S437 PolarHBondContact O-N 3.07Å; P434-D438 CarbonylContact O-C 3.52Å; P434-D438 VanDerWaalsContact O-C 3.32Å; P434-D438 WeakPolarHBondContact O-CA 3.5Å; P434-D438 PolarHBondContact O-N 3.2Å; P434-S442 PolarHBondContact O-OG 3.37Å |
| 435 | L | 87 | Confident | 87.9 | Confident | 58 Ų | 58 | 54 Ų | 54 | 30% | 0.304 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.6 | -30.4 | 174.7 | -78.6 | 168.5 | 0 | 0 | 0 | 113.4 | F386 V431 V432 V433 T439 I446 | F386-L435 HydrophobicContact CE2-CD2 4.26Å; F386-L435 HydrophobicContact CE2-CG 4.21Å; F386-L435 HydrophobicContact CZ-CD2 4.33Å; V431-L435 WeakPolarHBondContact O-CG 3.43Å; V432-L435 WeakPolarHBondContact O-CB 3.47Å; V432-L435 PolarHBondContact O-N 2.92Å; V433-L435 PolarHBondContact O-N 3.31Å; L435-T439 VanDerWaalsContact O-CA 3.28Å; L435-T439 WeakPolarHBondContact O-CA 3.31Å; L435-T439 VanDerWaalsContact O-CB 3.25Å; L435-T439 WeakPolarHBondContact O-CB 3.24Å; L435-T439 WeakPolarHBondContact O-CG2 3.21Å; L435-T439 PolarHBondContact O-OG1 3.02Å; L435-I446 HydrophobicContact CD2-CD1 3.72Å |
| 436 | Y | 86.1 | Confident | 87.7 | Confident | 127 Ų | 127 | 50 Ų | 50 | 50% | 0.498 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -98.9 | -25.5 | 173.6 | 65.8 | -104.1 | 0 | 0 | 0 | 113.2 | V433 P434 T439 | V433-Y436 HydrophobicContact CB-CE1 4.02Å; V433-Y436 HydrophobicContact CG1-CE1 4.11Å; V433-Y436 HydrophobicContact CG1-CE2 4.24Å; V433-Y436 VanDerWaalsContact CG1-OH 3.31Å; V433-Y436 WeakPolarHBondContact CG1-OH 3.29Å; V433-Y436 HydrophobicContact CG2-CE1 3.98Å; V433-Y436 WeakPolarHBondContact O-CD1 3.39Å; V433-Y436 WeakPolarHBondContact O-CE1 3.26Å; V433-Y436 PolarHBondContact O-N 2.95Å; P434-Y436 PolarHBondContact O-N 3.35Å; Y436-T439 PolarHBondContact O-OG1 3.45Å |
| 437 | S | 83.3 | Confident | 87.7 | Confident | 43 Ų | 43 | 48.8 Ų | 48.8 | 30% | 0.301 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -84.4 | -33.7 | -176.7 | -50 | 0 | 0 | 0 | 0 | 112.9 | G225 V433 P434 | G225-S437 WeakPolarHBondContact CA-OG 3.42Å; V433-S437 PolarHBondContact O-N 2.96Å; V433-S437 VanDerWaalsContact O-N 3.13Å; V433-S437 PolarHBondContact O-OG 2.86Å; P434-S437 PolarHBondContact O-N 3.07Å |
| 438 | D | 83.2 | Confident | 87.6 | Confident | 30 Ų | 30 | 50.4 Ų | 50.4 | 16% | 0.16 | 27% | 0.273 | C | S | . | . | S | Bend | trans | -137.7 | 52.3 | -179.7 | -166 | 7.6 | 0 | 0 | 0 | 110.6 | L229 N382 P434 I440 N441 S442 | L229-D438 HydrophobicContact CD2-CB 4.38Å; N382-D438 PolarHBondContact ND2-OD2 3.42Å; P434-D438 CarbonylContact O-C 3.52Å; P434-D438 VanDerWaalsContact O-C 3.32Å; P434-D438 WeakPolarHBondContact O-CA 3.5Å; P434-D438 PolarHBondContact O-N 3.2Å; D438-I440 VanDerWaalsContact C-N 3.33Å; D438-I440 PolarHBondContact O-N 3.23Å; D438-N441 PolarHBondContact O-N 3.13Å; D438-N441 VanDerWaalsContact O-N 3.16Å; D438-N441 WeakPolarHBondContact OD1-CB 3.28Å; D438-N441 VanDerWaalsContact OD1-CG 3.32Å; D438-N441 PolarHBondContact OD1-ND2 3.25Å; D438-N441 WeakPolarHBondContact OD2-CB 3.44Å; D438-N441 PolarHBondContact OD2-ND2 2.88Å; D438-S442 PolarHBondContact O-N 3.42Å; D438-S442 VanDerWaalsContact O-N 3.07Å; D438-S442 PolarHBondContact O-OG 2.92Å |
| 439 | T | 87 | Confident | 87.5 | Confident | 62 Ų | 62 | 46.7 Ų | 46.7 | 38% | 0.38 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -54.1 | -43.6 | -168.3 | -52.6 | 0 | 0 | 0 | 0 | 113.7 | L435 Y436 N441 S442 L443 | L435-T439 VanDerWaalsContact O-CA 3.28Å; L435-T439 WeakPolarHBondContact O-CA 3.31Å; L435-T439 VanDerWaalsContact O-CB 3.25Å; L435-T439 WeakPolarHBondContact O-CB 3.24Å; L435-T439 WeakPolarHBondContact O-CG2 3.21Å; L435-T439 PolarHBondContact O-OG1 3.02Å; Y436-T439 PolarHBondContact O-OG1 3.45Å; T439-N441 PolarHBondContact O-N 3Å; T439-S442 PolarHBondContact O-N 3.47Å; T439-L443 HydrophobicContact CG2-CD1 3.74Å; T439-L443 HydrophobicContact CG2-CG 4.14Å; T439-L443 VanDerWaalsContact O-CB 3.29Å; T439-L443 WeakPolarHBondContact O-CB 3.35Å; T439-L443 WeakPolarHBondContact O-CG 3.47Å; T439-L443 PolarHBondContact O-N 3.45Å |
| 440 | I | 87.3 | Confident | 87.6 | Confident | 124 Ų | 124 | 48.3 Ų | 48.3 | 64% | 0.636 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -63.1 | -47.4 | -177.2 | -63.2 | 175.1 | 0 | 0 | 0 | 109.7 | D438 L443 I444 | D438-I440 VanDerWaalsContact C-N 3.33Å; D438-I440 PolarHBondContact O-N 3.23Å; I440-L443 PolarHBondContact O-N 3.16Å; I440-I444 HydrophobicContact CG2-CD1 3.93Å; I440-I444 VanDerWaalsContact O-CG1 3.29Å; I440-I444 WeakPolarHBondContact O-CG1 3.47Å; I440-I444 PolarHBondContact O-N 3.08Å |
| 441 | N | 83.8 | Confident | 87.8 | Confident | 18 Ų | 18 | 50.3 Ų | 50.3 | 10% | 0.096 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -68.4 | -40.5 | -176.3 | -66.5 | -24.7 | 0 | 0 | 0 | 111.3 | Y383 D438 T439 I444 G445 | Y383-N441 HydrophobicContact CD1-CB 3.96Å; Y383-N441 VanDerWaalsContact CE1-CA 3.48Å; Y383-N441 HydrophobicContact CE1-CB 3.47Å; Y383-N441 VanDerWaalsContact CE1-CB 3.47Å; Y383-N441 WeakPolarHBondContact CE1-O 3.23Å; Y383-N441 PolarHBondContact OH-OD1 2.95Å; D438-N441 PolarHBondContact O-N 3.13Å; D438-N441 VanDerWaalsContact O-N 3.16Å; D438-N441 WeakPolarHBondContact OD1-CB 3.28Å; D438-N441 VanDerWaalsContact OD1-CG 3.32Å; D438-N441 PolarHBondContact OD1-ND2 3.25Å; D438-N441 WeakPolarHBondContact OD2-CB 3.44Å; D438-N441 PolarHBondContact OD2-ND2 2.88Å; T439-N441 PolarHBondContact O-N 3Å; N441-I444 PolarHBondContact O-N 3.19Å; N441-G445 PolarHBondContact O-N 3.41Å; N441-G445 VanDerWaalsContact O-N 3.13Å |
| 442 | S | 85.6 | Confident | 87.9 | Confident | 4 Ų | 4 | 49.2 Ų | 49.2 | 3% | 0.028 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -63.9 | -41.5 | 174.6 | -61 | 0 | 0 | 0 | 0 | 112.6 | P434 D438 T439 I444 G445 I446 | P434-S442 PolarHBondContact O-OG 3.37Å; D438-S442 PolarHBondContact O-N 3.42Å; D438-S442 VanDerWaalsContact O-N 3.07Å; D438-S442 PolarHBondContact O-OG 2.92Å; T439-S442 PolarHBondContact O-N 3.47Å; S442-I444 PolarHBondContact O-N 2.92Å; S442-G445 PolarHBondContact O-N 3.46Å; S442-I446 WeakPolarHBondContact O-CG1 3.36Å; S442-I446 PolarHBondContact O-N 3.02Å |
| 443 | L | 88.4 | Confident | 88 | Confident | 99 Ų | 99 | 47.5 Ų | 47.5 | 52% | 0.518 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -65.4 | -37.1 | 177.8 | -75.7 | 176.7 | 0 | 0 | 0 | 112.5 | T439 I440 G445 I446 G447 | T439-L443 HydrophobicContact CG2-CD1 3.74Å; T439-L443 HydrophobicContact CG2-CG 4.14Å; T439-L443 VanDerWaalsContact O-CB 3.29Å; T439-L443 WeakPolarHBondContact O-CB 3.35Å; T439-L443 WeakPolarHBondContact O-CG 3.47Å; T439-L443 PolarHBondContact O-N 3.45Å; I440-L443 PolarHBondContact O-N 3.16Å; L443-G445 VanDerWaalsContact C-N 3.34Å; L443-I446 PolarHBondContact O-N 2.85Å; L443-G447 PolarHBondContact O-N 3.43Å |
| 444 | I | 86.8 | Confident | 88.1 | Confident | 72 Ų | 72 | 50.4 Ų | 50.4 | 37% | 0.369 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -61.7 | -45.6 | 173.1 | -68.2 | 165.5 | 0 | 0 | 0 | 110 | Y383 I440 N441 S442 I446 G447 I448 | Y383-I444 HydrophobicContact CE1-CB 4.19Å; Y383-I444 HydrophobicContact CE1-CD1 4.4Å; Y383-I444 HydrophobicContact CE1-CG2 4.24Å; I440-I444 HydrophobicContact CG2-CD1 3.93Å; I440-I444 VanDerWaalsContact O-CG1 3.29Å; I440-I444 WeakPolarHBondContact O-CG1 3.47Å; I440-I444 PolarHBondContact O-N 3.08Å; N441-I444 PolarHBondContact O-N 3.19Å; S442-I444 PolarHBondContact O-N 2.92Å; I444-I446 PolarHBondContact O-N 3.39Å; I444-G447 PolarHBondContact O-N 2.84Å; I444-I448 HydrophobicContact CG2-CD1 3.88Å; I444-I448 HydrophobicContact CG2-CG1 4.47Å; I444-I448 WeakPolarHBondContact O-CG1 3.44Å; I444-I448 PolarHBondContact O-N 3.33Å |
| 445 | G | 85.8 | Confident | 88.3 | Confident | 3 Ų | 3 | 52.4 Ų | 52.4 | 3% | 0.031 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -57.7 | -47.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | N441 S442 L443 I448 A449 | N441-G445 PolarHBondContact O-N 3.41Å; N441-G445 VanDerWaalsContact O-N 3.13Å; S442-G445 PolarHBondContact O-N 3.46Å; L443-G445 VanDerWaalsContact C-N 3.34Å; G445-I448 PolarHBondContact O-N 3.07Å; G445-A449 PolarHBondContact O-N 3.43Å |
| 446 | I | 89.6 | Confident | 88.4 | Confident | 58 Ų | 58 | 51.1 Ų | 51.1 | 30% | 0.297 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.3 | -44.7 | 175.1 | -67.1 | 170.5 | 0 | 0 | 0 | 110.9 | F386 L435 S442 L443 I444 I448 A449 L450 | F386-I446 HydrophobicContact CE1-CD1 4.38Å; F386-I446 HydrophobicContact CE1-CG1 3.77Å; F386-I446 HydrophobicContact CZ-CD1 3.93Å; F386-I446 HydrophobicContact CZ-CG1 3.83Å; L435-I446 HydrophobicContact CD2-CD1 3.72Å; S442-I446 WeakPolarHBondContact O-CG1 3.36Å; S442-I446 PolarHBondContact O-N 3.02Å; L443-I446 PolarHBondContact O-N 2.85Å; I444-I446 PolarHBondContact O-N 3.39Å; I446-I448 VanDerWaalsContact C-N 3.34Å; I446-I448 PolarHBondContact O-N 3.46Å; I446-A449 PolarHBondContact O-N 3.45Å; I446-L450 HydrophobicContact CG2-CD1 3.69Å; I446-L450 HydrophobicContact CG2-CG 4.07Å; I446-L450 WeakPolarHBondContact O-CB 3.32Å; I446-L450 WeakPolarHBondContact O-CG 3.46Å; I446-L450 PolarHBondContact O-N 2.8Å |
| 447 | G | 91.3 | Very high | 88.4 | Confident | 40 Ų | 40 | 49.7 Ų | 49.7 | 41% | 0.412 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -59.8 | -43.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L443 I444 L450 S451 | L443-G447 PolarHBondContact O-N 3.43Å; I444-G447 PolarHBondContact O-N 2.84Å; G447-L450 PolarHBondContact O-N 2.88Å; G447-S451 WeakPolarHBondContact O-CB 3.48Å; G447-S451 PolarHBondContact O-N 2.94Å |
| 448 | I | 89.1 | Confident | 88.5 | Confident | 41 Ų | 41 | 51.8 Ų | 51.8 | 21% | 0.21 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -67 | -42.2 | 175.7 | -64.7 | 168.4 | 0 | 0 | 0 | 110.6 | W120 L124 I125 I444 G445 I446 L450 S451 | W120-I448 PolarHBondContact NE1-O 3.35Å; L124-I448 HydrophobicContact CB-CG2 3.91Å; L124-I448 HydrophobicContact CD1-CG2 3.88Å; I125-I448 HydrophobicContact CD1-CB 3.71Å; I125-I448 HydrophobicContact CD1-CD1 4.09Å; I125-I448 HydrophobicContact CD1-CG2 3.65Å; I125-I448 HydrophobicContact CG1-CB 4.26Å; I125-I448 HydrophobicContact CG1-CD1 4.2Å; I125-I448 HydrophobicContact CG1-CG2 3.71Å; I444-I448 HydrophobicContact CG2-CD1 3.88Å; I444-I448 HydrophobicContact CG2-CG1 4.47Å; I444-I448 WeakPolarHBondContact O-CG1 3.44Å; I444-I448 PolarHBondContact O-N 3.33Å; G445-I448 PolarHBondContact O-N 3.07Å; I446-I448 VanDerWaalsContact C-N 3.34Å; I446-I448 PolarHBondContact O-N 3.46Å; I448-L450 PolarHBondContact O-N 3.25Å; I448-S451 WeakPolarHBondContact O-CB 3.07Å; I448-S451 PolarHBondContact O-N 3.26Å; I448-S451 PolarHBondContact O-OG 3.32Å |
| 449 | A | 89.8 | Confident | 88.3 | Confident | 16 Ų | 16 | 51.9 Ų | 51.9 | 13% | 0.132 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.6 | -45.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | I117 G445 I446 S451 G452 | I117-A449 HydrophobicContact CG2-CB 4.43Å; G445-A449 PolarHBondContact O-N 3.43Å; I446-A449 PolarHBondContact O-N 3.45Å; A449-S451 VanDerWaalsContact C-N 3.31Å; A449-S451 PolarHBondContact O-N 2.78Å; A449-G452 PolarHBondContact O-N 3.09Å; A449-G452 VanDerWaalsContact O-N 3.13Å |
| 450 | L | 92.5 | Very high | 88 | Confident | 105 Ų | 105 | 50.4 Ų | 50.4 | 55% | 0.55 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -69.2 | -25.5 | 177.9 | -69.7 | 179.5 | 0 | 0 | 0 | 113.2 | I446 G447 I448 G452 V453 P454 | I446-L450 HydrophobicContact CG2-CD1 3.69Å; I446-L450 HydrophobicContact CG2-CG 4.07Å; I446-L450 WeakPolarHBondContact O-CB 3.32Å; I446-L450 WeakPolarHBondContact O-CG 3.46Å; I446-L450 PolarHBondContact O-N 2.8Å; G447-L450 PolarHBondContact O-N 2.88Å; I448-L450 PolarHBondContact O-N 3.25Å; L450-G452 PolarHBondContact O-N 3.49Å; L450-G452 VanDerWaalsContact O-N 3.14Å; L450-V453 HydrophobicContact CD2-CG2 4.28Å; L450-V453 VanDerWaalsContact O-CB 3.3Å; L450-V453 WeakPolarHBondContact O-CB 3.42Å; L450-V453 WeakPolarHBondContact O-CG2 3.28Å; L450-V453 PolarHBondContact O-N 3.15Å; L450-P454 WeakPolarHBondContact O-CD 3.37Å |
| 451 | S | 94.1 | Very high | 87.7 | Confident | 47 Ų | 47 | 52.2 Ų | 52.2 | 33% | 0.329 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -60.7 | -20.9 | 171.6 | 79.3 | 0 | 0 | 0 | 0 | 112.6 | W120 G447 I448 A449 V453 P454 | W120-S451 PolarHBondContact NE1-OG 3.49Å; W120-S451 VanDerWaalsContact NE1-OG 3.11Å; G447-S451 WeakPolarHBondContact O-CB 3.48Å; G447-S451 PolarHBondContact O-N 2.94Å; I448-S451 WeakPolarHBondContact O-CB 3.07Å; I448-S451 PolarHBondContact O-N 3.26Å; I448-S451 PolarHBondContact O-OG 3.32Å; A449-S451 VanDerWaalsContact C-N 3.31Å; A449-S451 PolarHBondContact O-N 2.78Å; S451-V453 VanDerWaalsContact C-N 3.3Å; S451-V453 PolarHBondContact O-N 3.2Å; S451-P454 VanDerWaalsContact O-CD 3.27Å; S451-P454 WeakPolarHBondContact O-CD 3.48Å; S451-P454 VanDerWaalsContact O-CG 3.29Å; S451-P454 WeakPolarHBondContact O-CG 3.36Å |
| 452 | G | 90.7 | Very high | 87.4 | Confident | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -68.9 | -25.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | F116 W120 A449 L450 V455 Y456 | F116-G452 WeakPolarHBondContact CE1-O 3.07Å; W120-G452 VanDerWaalsContact CD1-CA 3.45Å; A449-G452 PolarHBondContact O-N 3.09Å; A449-G452 VanDerWaalsContact O-N 3.13Å; L450-G452 PolarHBondContact O-N 3.49Å; L450-G452 VanDerWaalsContact O-N 3.14Å; G452-V455 PolarHBondContact O-N 3.07Å; G452-Y456 WeakPolarHBondContact O-CB 3.12Å; G452-Y456 PolarHBondContact O-N 3.31Å |
| 453 | V | 92.4 | Very high | 86.8 | Confident | 40 Ų | 40 | 56.3 Ų | 56.3 | 24% | 0.242 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -59.6 | -54.9 | -178.4 | -179.6 | 0 | 0 | 0 | 0 | 112.6 | F113 I117 L450 S451 V455 Y456 F457 | F113-V453 HydrophobicContact CE2-CG1 4.24Å; F113-V453 HydrophobicContact CE2-CG2 4.21Å; F113-V453 HydrophobicContact CZ-CG1 4.33Å; F113-V453 HydrophobicContact CZ-CG2 3.93Å; I117-V453 HydrophobicContact CD1-CG2 3.87Å; L450-V453 HydrophobicContact CD2-CG2 4.28Å; L450-V453 VanDerWaalsContact O-CB 3.3Å; L450-V453 WeakPolarHBondContact O-CB 3.42Å; L450-V453 WeakPolarHBondContact O-CG2 3.28Å; L450-V453 PolarHBondContact O-N 3.15Å; S451-V453 VanDerWaalsContact C-N 3.3Å; S451-V453 PolarHBondContact O-N 3.2Å; V453-V455 VanDerWaalsContact C-N 3.27Å; V453-V455 PolarHBondContact O-N 3.37Å; V453-Y456 PolarHBondContact O-N 2.82Å; V453-F457 HydrophobicContact CG1-CD2 3.97Å; V453-F457 HydrophobicContact CG1-CE2 3.8Å; V453-F457 VanDerWaalsContact O-CD2 3.26Å; V453-F457 WeakPolarHBondContact O-CD2 3.29Å; V453-F457 PolarHBondContact O-N 3.14Å |
| 454 | P | 91.3 | Very high | 85.9 | Confident | 71 Ų | 71 | 54.2 Ų | 54.2 | 46% | 0.461 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -61.9 | -36.3 | 177.1 | 23.9 | -34.3 | 0 | 0 | 0 | 112.1 | L450 S451 F457 L458 | L450-P454 WeakPolarHBondContact O-CD 3.37Å; S451-P454 VanDerWaalsContact O-CD 3.27Å; S451-P454 WeakPolarHBondContact O-CD 3.48Å; S451-P454 VanDerWaalsContact O-CG 3.29Å; S451-P454 WeakPolarHBondContact O-CG 3.36Å; P454-F457 PolarHBondContact O-N 2.9Å; P454-L458 WeakPolarHBondContact O-CB 3.49Å; P454-L458 VanDerWaalsContact O-CG 3.26Å; P454-L458 WeakPolarHBondContact O-CG 3.29Å; P454-L458 PolarHBondContact O-N 2.92Å |
| 455 | V | 89.4 | Confident | 85 | Confident | 42 Ų | 42 | 56 Ų | 56 | 26% | 0.255 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -65.3 | -42 | 178.1 | -178.6 | 0 | 0 | 0 | 0 | 111.1 | F116 W120 G452 V453 F457 L458 C459 | F116-V455 HydrophobicContact CZ-CB 4.18Å; F116-V455 HydrophobicContact CZ-CG1 3.85Å; W120-V455 HydrophobicContact CH2-CB 4.42Å; W120-V455 HydrophobicContact CH2-CG1 4.09Å; W120-V455 HydrophobicContact CH2-CG2 4Å; W120-V455 HydrophobicContact CZ2-CG2 4.02Å; W120-V455 HydrophobicContact CZ3-CG1 3.98Å; G452-V455 PolarHBondContact O-N 3.07Å; V453-V455 VanDerWaalsContact C-N 3.27Å; V453-V455 PolarHBondContact O-N 3.37Å; V455-F457 PolarHBondContact O-N 2.99Å; V455-L458 PolarHBondContact O-N 3.03Å; V455-C459 HydrophobicContact CG1-CB 4.44Å; V455-C459 VanDerWaalsContact O-CB 3.23Å; V455-C459 WeakPolarHBondContact O-CB 3.38Å; V455-C459 PolarHBondContact O-N 2.76Å |
| 456 | Y | 88.5 | Confident | 84.5 | Confident | 31 Ų | 31 | 63.7 Ų | 63.7 | 12% | 0.122 | 36% | 0.356 | C | S | . | . | I | π-helix | trans | -59.9 | -47.5 | 176.6 | 179.3 | -98.4 | 0 | 0 | 0 | 111.7 | F113 F116 G452 V453 L458 C460 Y461 | F113-Y456 HydrophobicContact CB-CE1 3.99Å; F113-Y456 AromaticContact CD2-CD1 3.49Å; F113-Y456 HydrophobicContact CD2-CD1 3.49Å; F113-Y456 VanDerWaalsContact CD2-CD1 3.49Å; F113-Y456 AromaticContact CD2-CE1 3.71Å; F113-Y456 HydrophobicContact CD2-CE1 3.71Å; F113-Y456 AromaticContact CD2-CG 3.9Å; F113-Y456 HydrophobicContact CD2-CG 3.9Å; F113-Y456 HydrophobicContact CE2-CD1 4.16Å; F113-Y456 HydrophobicContact CE2-CG 4.48Å; F113-Y456 HydrophobicContact CG-CE1 4.33Å; F113-Y456 PolarHBondContact N-OH 3.17Å; F116-Y456 HydrophobicContact CB-CD2 3.43Å; F116-Y456 VanDerWaalsContact CB-CD2 3.43Å; F116-Y456 HydrophobicContact CB-CE2 3.8Å; F116-Y456 HydrophobicContact CB-CG 4.45Å; F116-Y456 AromaticContact CD1-CD2 3.81Å; F116-Y456 HydrophobicContact CD1-CD2 3.81Å; F116-Y456 HydrophobicContact CD1-CG 4.16Å; F116-Y456 AromaticContact CD2-CD2 3.95Å; F116-Y456 HydrophobicContact CD2-CD2 3.95Å; F116-Y456 AromaticContact CG-CD2 3.44Å; F116-Y456 HydrophobicContact CG-CD2 3.44Å; F116-Y456 VanDerWaalsContact CG-CD2 3.44Å; F116-Y456 HydrophobicContact CG-CE2 4.28Å; F116-Y456 HydrophobicContact CG-CG 4.25Å; G452-Y456 WeakPolarHBondContact O-CB 3.12Å; G452-Y456 PolarHBondContact O-N 3.31Å; V453-Y456 PolarHBondContact O-N 2.82Å; Y456-L458 VanDerWaalsContact C-N 3.34Å; Y456-L458 PolarHBondContact O-N 3.33Å; Y456-C460 HydrophobicContact CD2-CB 3.59Å; Y456-C460 HydrophobicContact CE2-CB 3.73Å; Y456-C460 HydrophobicContact CG-CB 4.26Å; Y456-C460 WeakPolarHBondContact O-CA 3.3Å; Y456-C460 WeakPolarHBondContact O-CB 3.44Å; Y456-C460 PolarHBondContact O-N 3.06Å; Y456-Y461 PolarHBondContact O-N 3.2Å |
| 457 | F | 87.3 | Confident | 84.1 | Confident | 97 Ų | 97 | 63.8 Ų | 63.8 | 43% | 0.425 | 35% | 0.353 | S | S | . | . | I | π-helix | trans | -66.8 | -36.8 | -179.5 | -76.1 | -68.8 | 0 | 0 | 0 | 112.3 | F113 V453 P454 V455 Y461 T462 | F113-F457 HydrophobicContact CE2-CE2 4.31Å; V453-F457 HydrophobicContact CG1-CD2 3.97Å; V453-F457 HydrophobicContact CG1-CE2 3.8Å; V453-F457 VanDerWaalsContact O-CD2 3.26Å; V453-F457 WeakPolarHBondContact O-CD2 3.29Å; V453-F457 PolarHBondContact O-N 3.14Å; P454-F457 PolarHBondContact O-N 2.9Å; V455-F457 PolarHBondContact O-N 2.99Å; F457-Y461 AromaticContact CD1-CD1 3.94Å; F457-Y461 HydrophobicContact CD1-CD1 3.94Å; F457-Y461 AromaticContact CD1-CG 4Å; F457-Y461 HydrophobicContact CD1-CG 4Å; F457-Y461 HydrophobicContact CE1-CD1 4.42Å; F457-Y461 HydrophobicContact CE1-CG 4.37Å; F457-T462 WeakPolarHBondContact O-CB 3.22Å; F457-T462 VanDerWaalsContact O-CG2 3.31Å; F457-T462 WeakPolarHBondContact O-CG2 3.38Å; F457-T462 PolarHBondContact O-N 2.8Å; F457-T462 PolarHBondContact O-OG1 3.01Å |
| 458 | L | 84.1 | Confident | 83.7 | Confident | 87 Ų | 87 | 64.5 Ų | 64.5 | 46% | 0.455 | 35% | 0.35 | S | S | . | . | I | π-helix | trans | -79.2 | -31.5 | -179.8 | -71.9 | 171.1 | 0 | 0 | 0 | 114.6 | P454 V455 Y456 T462 | P454-L458 WeakPolarHBondContact O-CB 3.49Å; P454-L458 VanDerWaalsContact O-CG 3.26Å; P454-L458 WeakPolarHBondContact O-CG 3.29Å; P454-L458 PolarHBondContact O-N 2.92Å; V455-L458 PolarHBondContact O-N 3.03Å; Y456-L458 VanDerWaalsContact C-N 3.34Å; Y456-L458 PolarHBondContact O-N 3.33Å; L458-T462 VanDerWaalsContact C-OG1 3.22Å; L458-T462 PolarHBondContact O-OG1 3.42Å |
| 459 | C | 80.6 | Confident | 83.4 | Confident | 33 Ų | 33 | 69 Ų | 69 | 22% | 0.223 | 37% | 0.374 | C | S | . | . | I | π-helix | trans | -110.2 | -34.7 | -172.6 | -65.9 | 0 | 0 | 0 | 0 | 113.2 | V455 R467 | V455-C459 HydrophobicContact CG1-CB 4.44Å; V455-C459 VanDerWaalsContact O-CB 3.23Å; V455-C459 WeakPolarHBondContact O-CB 3.38Å; V455-C459 PolarHBondContact O-N 2.76Å; C459-R467 PolarHBondContact O-NE 3.08Å; C459-R467 PolarHBondContact O-NH2 3.33Å |
| 460 | C | 79.9 | Confident | 83.2 | Confident | 31 Ų | 31 | 77.4 Ų | 77.4 | 21% | 0.209 | 40% | 0.402 | C | S | . | . | I | π-helix | trans | -104.3 | -51.2 | -173.5 | -57.7 | 0 | 0 | 0 | 0 | 112.1 | H342 Y456 | H342-C460 PolarHBondContact O-SG 3.29Å; Y456-C460 HydrophobicContact CD2-CB 3.59Å; Y456-C460 HydrophobicContact CE2-CB 3.73Å; Y456-C460 HydrophobicContact CG-CB 4.26Å; Y456-C460 WeakPolarHBondContact O-CA 3.3Å; Y456-C460 WeakPolarHBondContact O-CB 3.44Å; Y456-C460 PolarHBondContact O-N 3.06Å |
| 461 | Y | 82 | Confident | 82.8 | Confident | 161 Ų | 161 | 73.8 Ų | 73.8 | 63% | 0.631 | 38% | 0.384 | S | S | * | . | I | π-helix | trans | -73.2 | -38.8 | -175.7 | -175 | -101.8 | 0 | 0 | 0 | 113 | Y456 F457 P463 | Y456-Y461 PolarHBondContact O-N 3.2Å; F457-Y461 AromaticContact CD1-CD1 3.94Å; F457-Y461 HydrophobicContact CD1-CD1 3.94Å; F457-Y461 AromaticContact CD1-CG 4Å; F457-Y461 HydrophobicContact CD1-CG 4Å; F457-Y461 HydrophobicContact CE1-CD1 4.42Å; F457-Y461 HydrophobicContact CE1-CG 4.37Å; Y461-P463 WeakPolarHBondContact O-CD 3.28Å |
| 462 | T | 77.3 | Confident | 82.2 | Confident | 39 Ų | 39 | 75.5 Ų | 75.5 | 24% | 0.239 | 38% | 0.383 | C | S | . | . | S | Bend | trans | -76.2 | 124.2 | 178.7 | 40.1 | 0 | 0 | 0 | 0 | 110.4 | F457 L458 A464 R467 | F457-T462 WeakPolarHBondContact O-CB 3.22Å; F457-T462 VanDerWaalsContact O-CG2 3.31Å; F457-T462 WeakPolarHBondContact O-CG2 3.38Å; F457-T462 PolarHBondContact O-N 2.8Å; F457-T462 PolarHBondContact O-OG1 3.01Å; L458-T462 VanDerWaalsContact C-OG1 3.22Å; L458-T462 PolarHBondContact O-OG1 3.42Å; T462-A464 PolarHBondContact O-N 2.98Å; T462-R467 PolarHBondContact O-NE 2.85Å |
| 463 | P | 73.1 | Confident | 81.9 | Confident | 69 Ų | 69 | 78.3 Ų | 78.3 | 45% | 0.448 | 40% | 0.402 | S | S | . | . | trans | -52.4 | 142.7 | 176.5 | -25.9 | 33 | 0 | 0 | 0 | 110.3 | Y461 T465 K466 R467 | Y461-P463 WeakPolarHBondContact O-CD 3.28Å; P463-T465 PolarHBondContact O-N 3.44Å; P463-K466 HydrophobicContact CG-CD 4.44Å; P463-K466 PolarHBondContact O-N 3.01Å; P463-R467 PolarHBondContact O-N 3.46Å | ||
| 464 | A | 69 | Low | 81.6 | Confident | 55 Ų | 55 | 82.2 Ų | 82.2 | 46% | 0.455 | 42% | 0.416 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.1 | -29 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | T462 R472 | T462-A464 PolarHBondContact O-N 2.98Å; A464-R472 VanDerWaalsContact O-CD 3.28Å; A464-R472 WeakPolarHBondContact O-CD 3.46Å; A464-R472 PolarHBondContact O-NE 3.43Å; A464-R472 PolarHBondContact O-NH1 3.04Å; A464-R472 VanDerWaalsContact O-NH1 3.16Å; A464-R472 PolarHBondContact O-NH2 2.9Å |
| 465 | T | 67.4 | Low | 81.3 | Confident | 109 Ų | 109 | 80.9 Ų | 80.9 | 67% | 0.669 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.4 | -10.6 | 177.1 | 55.1 | 0 | 0 | 0 | 0 | 116.1 | P463 R472 | P463-T465 PolarHBondContact O-N 3.44Å; T465-R472 VanDerWaalsContact C-CZ 3.48Å; T465-R472 PolarHBondContact O-NH2 3.46Å |
| 466 | K | 75.9 | Confident | 81.1 | Confident | 165 Ų | 165 | 81.5 Ų | 81.5 | 72% | 0.717 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.4 | -6.2 | 175.3 | -66.6 | -173.7 | 179.7 | 179.7 | 0 | 114 | P463 | P463-K466 HydrophobicContact CG-CD 4.44Å; P463-K466 PolarHBondContact O-N 3.01Å |
| 467 | R | 80.9 | Confident | 81.1 | Confident | 60 Ų | 60 | 87.3 Ų | 87.3 | 23% | 0.226 | 44% | 0.44 | C | S | . | . | S | Bend | trans | -62.6 | 146.8 | 176.6 | -62.6 | -178.9 | -165.1 | 160.2 | 5.5 | 111.5 | C459 T462 P463 R472 | C459-R467 PolarHBondContact O-NE 3.08Å; C459-R467 PolarHBondContact O-NH2 3.33Å; T462-R467 PolarHBondContact O-NE 2.85Å; P463-R467 PolarHBondContact O-N 3.46Å; R467-R472 HydrophobicContact CB-CG 3.91Å; R467-R472 VanDerWaalsContact O-CZ 3.28Å; R467-R472 PolarHBondContact O-NE 2.82Å; R467-R472 PolarHBondContact O-NH2 3.43Å |
| 468 | P | 83.2 | Confident | 81.1 | Confident | 55 Ų | 55 | 84.1 Ų | 84.1 | 36% | 0.357 | 43% | 0.43 | S | S | . | . | trans | -53.1 | 139.7 | 175.3 | -25.9 | 34.6 | 0 | 0 | 0 | 112.5 | W470 L471 R472 | P468-W470 VanDerWaalsContact C-N 3.28Å; P468-W470 PolarHBondContact O-N 3.15Å; P468-L471 HydrophobicContact CB-CB 4.32Å; P468-L471 PolarHBondContact O-N 3.38Å; P468-L471 VanDerWaalsContact O-N 3.11Å; P468-R472 PolarHBondContact O-N 3.4Å; P468-R472 VanDerWaalsContact O-N 3.13Å | ||
| 469 | L | 81.9 | Confident | 81.1 | Confident | 135 Ų | 135 | 80.4 Ų | 80.4 | 71% | 0.707 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -58.8 | -37.5 | -176.5 | -74.5 | 168.7 | 0 | 0 | 0 | 113 | R472 S473 | L469-R472 PolarHBondContact O-N 2.88Å; L469-S473 WeakPolarHBondContact O-CB 3.4Å; L469-S473 PolarHBondContact O-N 3.2Å; L469-S473 PolarHBondContact O-OG 3.37Å |
| 470 | W | 86 | Confident | 81.5 | Confident | 193 Ų | 193 | 83 Ų | 83 | 73% | 0.731 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -62.5 | -42.7 | 177.2 | 83.5 | -68.8 | 0 | 0 | 0 | 111.6 | P468 S473 F474 | P468-W470 VanDerWaalsContact C-N 3.28Å; P468-W470 PolarHBondContact O-N 3.15Å; W470-S473 PolarHBondContact O-N 3.1Å; W470-F474 VanDerWaalsContact O-CB 3.29Å; W470-F474 WeakPolarHBondContact O-CB 3.45Å; W470-F474 PolarHBondContact O-N 2.96Å |
| 471 | L | 83.5 | Confident | 82 | Confident | 29 Ų | 29 | 86.7 Ų | 86.7 | 15% | 0.152 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -67.2 | -43 | -179.6 | -178.3 | 62.3 | 0 | 0 | 0 | 111.2 | P468 F474 I475 | P468-L471 HydrophobicContact CB-CB 4.32Å; P468-L471 PolarHBondContact O-N 3.38Å; P468-L471 VanDerWaalsContact O-N 3.11Å; L471-F474 PolarHBondContact O-N 3.31Å; L471-I475 HydrophobicContact CD1-CD1 4.04Å; L471-I475 HydrophobicContact CD1-CG1 4.32Å; L471-I475 HydrophobicContact CG-CD1 3.95Å; L471-I475 VanDerWaalsContact O-CG1 3.3Å; L471-I475 WeakPolarHBondContact O-CG1 3.25Å; L471-I475 PolarHBondContact O-N 2.88Å |
| 472 | R | 81.4 | Confident | 82.3 | Confident | 84 Ų | 84 | 81 Ų | 81 | 32% | 0.317 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -62.9 | -45 | 174.2 | -66 | -170.1 | -139.1 | -179.5 | 0.5 | 112.1 | A464 T465 R467 P468 L469 F474 I475 A476 | A464-R472 VanDerWaalsContact O-CD 3.28Å; A464-R472 WeakPolarHBondContact O-CD 3.46Å; A464-R472 PolarHBondContact O-NE 3.43Å; A464-R472 PolarHBondContact O-NH1 3.04Å; A464-R472 VanDerWaalsContact O-NH1 3.16Å; A464-R472 PolarHBondContact O-NH2 2.9Å; T465-R472 VanDerWaalsContact C-CZ 3.48Å; T465-R472 PolarHBondContact O-NH2 3.46Å; R467-R472 HydrophobicContact CB-CG 3.91Å; R467-R472 VanDerWaalsContact O-CZ 3.28Å; R467-R472 PolarHBondContact O-NE 2.82Å; R467-R472 PolarHBondContact O-NH2 3.43Å; P468-R472 PolarHBondContact O-N 3.4Å; P468-R472 VanDerWaalsContact O-N 3.13Å; L469-R472 PolarHBondContact O-N 2.88Å; R472-F474 VanDerWaalsContact C-N 3.27Å; R472-F474 PolarHBondContact O-N 3.11Å; R472-I475 PolarHBondContact O-N 2.7Å; R472-A476 VanDerWaalsContact O-CB 3.26Å; R472-A476 WeakPolarHBondContact O-CB 3.18Å; R472-A476 PolarHBondContact O-N 2.83Å |
| 473 | S | 84.4 | Confident | 82.8 | Confident | 58 Ų | 58 | 83.1 Ų | 83.1 | 41% | 0.406 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -62.4 | -38.9 | 178.4 | -59.9 | 0 | 0 | 0 | 0 | 111.1 | L469 W470 K477 | L469-S473 WeakPolarHBondContact O-CB 3.4Å; L469-S473 PolarHBondContact O-N 3.2Å; L469-S473 PolarHBondContact O-OG 3.37Å; W470-S473 PolarHBondContact O-N 3.1Å; S473-K477 VanDerWaalsContact O-CB 3.26Å; S473-K477 WeakPolarHBondContact O-CB 3.41Å; S473-K477 WeakPolarHBondContact O-CG 3.36Å; S473-K477 PolarHBondContact O-N 3.2Å |
| 474 | F | 86.8 | Confident | 83.5 | Confident | 123 Ų | 123 | 87.5 Ų | 87.5 | 54% | 0.539 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -65.1 | -53.5 | 175.8 | -180 | -99.7 | 0 | 0 | 0 | 111.5 | W470 L471 R472 A476 K477 C478 | W470-F474 VanDerWaalsContact O-CB 3.29Å; W470-F474 WeakPolarHBondContact O-CB 3.45Å; W470-F474 PolarHBondContact O-N 2.96Å; L471-F474 PolarHBondContact O-N 3.31Å; R472-F474 VanDerWaalsContact C-N 3.27Å; R472-F474 PolarHBondContact O-N 3.11Å; F474-A476 VanDerWaalsContact C-N 3.3Å; F474-A476 PolarHBondContact O-N 2.84Å; F474-K477 PolarHBondContact O-N 2.77Å; F474-C478 VanDerWaalsContact CZ-SG 3.5Å; F474-C478 WeakPolarHBondContact O-CB 3.17Å; F474-C478 PolarHBondContact O-N 3.01Å; F474-C478 PolarHBondContact O-SG 3.35Å; F474-C478 VanDerWaalsContact O-SG 3.4Å |
| 475 | I | 84.6 | Confident | 84.6 | Confident | 43 Ų | 43 | 90.2 Ų | 90.2 | 22% | 0.221 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -58 | -43.4 | 178.8 | -67.5 | 168.1 | 0 | 0 | 0 | 110.8 | F346 L471 R472 G479 | F346-I475 HydrophobicContact CE1-CG2 4.33Å; L471-I475 HydrophobicContact CD1-CD1 4.04Å; L471-I475 HydrophobicContact CD1-CG1 4.32Å; L471-I475 HydrophobicContact CG-CD1 3.95Å; L471-I475 VanDerWaalsContact O-CG1 3.3Å; L471-I475 WeakPolarHBondContact O-CG1 3.25Å; L471-I475 PolarHBondContact O-N 2.88Å; R472-I475 PolarHBondContact O-N 2.7Å; I475-G479 PolarHBondContact O-N 2.72Å |
| 476 | A | 84.6 | Confident | 85.5 | Confident | 54 Ų | 54 | 85.8 Ų | 85.8 | 45% | 0.446 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.9 | -44.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | R472 F474 G479 I480 | R472-A476 VanDerWaalsContact O-CB 3.26Å; R472-A476 WeakPolarHBondContact O-CB 3.18Å; R472-A476 PolarHBondContact O-N 2.83Å; F474-A476 VanDerWaalsContact C-N 3.3Å; F474-A476 PolarHBondContact O-N 2.84Å; A476-G479 PolarHBondContact O-N 2.97Å; A476-I480 VanDerWaalsContact O-CG1 3.29Å; A476-I480 WeakPolarHBondContact O-CG1 3.37Å; A476-I480 PolarHBondContact O-N 2.87Å |
| 477 | K | 88.9 | Confident | 86.2 | Confident | 154 Ų | 154 | 84.1 Ų | 84.1 | 67% | 0.67 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -63.7 | -44.6 | 176.9 | -76.4 | 175.2 | -177.8 | -176.2 | 0 | 111.7 | S473 F474 I480 L481 | S473-K477 VanDerWaalsContact O-CB 3.26Å; S473-K477 WeakPolarHBondContact O-CB 3.41Å; S473-K477 WeakPolarHBondContact O-CG 3.36Å; S473-K477 PolarHBondContact O-N 3.2Å; F474-K477 PolarHBondContact O-N 2.77Å; K477-I480 PolarHBondContact O-N 2.7Å; K477-L481 VanDerWaalsContact O-CB 3.29Å; K477-L481 WeakPolarHBondContact O-CB 3.33Å; K477-L481 PolarHBondContact O-N 3.01Å |
| 478 | C | 86.6 | Confident | 86.4 | Confident | 30 Ų | 30 | 81.3 Ų | 81.3 | 20% | 0.203 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -61.9 | -44.9 | 174.7 | -74 | 0 | 0 | 0 | 0 | 111.1 | F474 L481 I482 | F474-C478 VanDerWaalsContact CZ-SG 3.5Å; F474-C478 WeakPolarHBondContact O-CB 3.17Å; F474-C478 PolarHBondContact O-N 3.01Å; F474-C478 PolarHBondContact O-SG 3.35Å; F474-C478 VanDerWaalsContact O-SG 3.4Å; C478-L481 PolarHBondContact O-N 3.08Å; C478-I482 WeakPolarHBondContact O-CB 3.29Å; C478-I482 VanDerWaalsContact O-CG1 3.24Å; C478-I482 WeakPolarHBondContact O-CG1 3.3Å; C478-I482 PolarHBondContact O-N 2.97Å |
| 479 | G | 85.5 | Confident | 86.5 | Confident | 9 Ų | 9 | 81.7 Ų | 81.7 | 9% | 0.093 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -57.4 | -51 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | I475 A476 L481 I482 Q483 | I475-G479 PolarHBondContact O-N 2.72Å; A476-G479 PolarHBondContact O-N 2.97Å; G479-L481 PolarHBondContact O-N 3.1Å; G479-I482 PolarHBondContact O-N 2.94Å; G479-Q483 VanDerWaalsContact O-CB 3.25Å; G479-Q483 WeakPolarHBondContact O-CB 3.45Å; G479-Q483 PolarHBondContact O-N 3.41Å |
| 480 | I | 87.4 | Confident | 86.4 | Confident | 87 Ų | 87 | 78.7 Ų | 78.7 | 45% | 0.446 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63.2 | -40.8 | 177.8 | -66.5 | 165.2 | 0 | 0 | 0 | 111.5 | A476 K477 Q483 K484 | A476-I480 VanDerWaalsContact O-CG1 3.29Å; A476-I480 WeakPolarHBondContact O-CG1 3.37Å; A476-I480 PolarHBondContact O-N 2.87Å; K477-I480 PolarHBondContact O-N 2.7Å; I480-Q483 PolarHBondContact O-N 3.34Å; I480-K484 HydrophobicContact CG2-CD 4.08Å; I480-K484 HydrophobicContact CG2-CG 4.48Å; I480-K484 WeakPolarHBondContact O-CB 3.44Å; I480-K484 VanDerWaalsContact O-CG 3.32Å; I480-K484 WeakPolarHBondContact O-CG 3.45Å; I480-K484 PolarHBondContact O-N 3.43Å |
| 481 | L | 90.8 | Very high | 85.6 | Confident | 109 Ų | 109 | 71.7 Ų | 71.7 | 57% | 0.571 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -62 | -49.9 | 177.4 | 178.7 | 66 | 0 | 0 | 0 | 110.7 | K477 C478 G479 Q483 K484 V485 | K477-L481 VanDerWaalsContact O-CB 3.29Å; K477-L481 WeakPolarHBondContact O-CB 3.33Å; K477-L481 PolarHBondContact O-N 3.01Å; C478-L481 PolarHBondContact O-N 3.08Å; G479-L481 PolarHBondContact O-N 3.1Å; L481-Q483 VanDerWaalsContact C-N 3.32Å; L481-Q483 PolarHBondContact O-N 3.3Å; L481-K484 PolarHBondContact O-N 3.18Å; L481-V485 HydrophobicContact CD1-CG2 3.87Å; L481-V485 HydrophobicContact CG-CG2 4.26Å; L481-V485 WeakPolarHBondContact O-CB 3.49Å; L481-V485 VanDerWaalsContact O-CG2 3.24Å; L481-V485 WeakPolarHBondContact O-CG2 3.34Å; L481-V485 PolarHBondContact O-N 2.84Å |
| 482 | I | 88.2 | Confident | 84.3 | Confident | 41 Ų | 41 | 79.5 Ų | 79.5 | 21% | 0.21 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -61.4 | -43.7 | 178.1 | -69.8 | 167.9 | 0 | 0 | 0 | 110 | F346 P359 C478 G479 K484 V485 C486 | F346-I482 HydrophobicContact CB-CD1 4.21Å; F346-I482 HydrophobicContact CB-CG2 4.49Å; F346-I482 HydrophobicContact CD2-CD1 3.36Å; F346-I482 HydrophobicContact CE2-CD1 3.81Å; F346-I482 HydrophobicContact CG-CD1 3.84Å; P359-I482 HydrophobicContact CB-CG2 3.81Å; P359-I482 HydrophobicContact CG-CG2 3.51Å; C478-I482 WeakPolarHBondContact O-CB 3.29Å; C478-I482 VanDerWaalsContact O-CG1 3.24Å; C478-I482 WeakPolarHBondContact O-CG1 3.3Å; C478-I482 PolarHBondContact O-N 2.97Å; G479-I482 PolarHBondContact O-N 2.94Å; I482-K484 VanDerWaalsContact C-N 3.32Å; I482-K484 PolarHBondContact O-N 3.29Å; I482-V485 PolarHBondContact O-N 3.13Å; I482-C486 WeakPolarHBondContact O-CA 3.39Å; I482-C486 WeakPolarHBondContact O-CB 3.42Å; I482-C486 PolarHBondContact O-N 3Å |
| 483 | Q | 87.9 | Confident | 82.8 | Confident | 84 Ų | 84 | 80.6 Ų | 80.6 | 39% | 0.393 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -57.3 | -44.5 | 177.2 | -157.1 | -175.1 | -7.9 | 0 | 0 | 111.9 | M349 G479 I480 L481 Y487 S488 | M349-Q483 HydrophobicContact CE-CB 4.41Å; M349-Q483 HydrophobicContact CE-CG 4.43Å; M349-Q483 HydrophobicContact SD-CB 4.21Å; M349-Q483 HydrophobicContact SD-CG 4.25Å; G479-Q483 VanDerWaalsContact O-CB 3.25Å; G479-Q483 WeakPolarHBondContact O-CB 3.45Å; G479-Q483 PolarHBondContact O-N 3.41Å; I480-Q483 PolarHBondContact O-N 3.34Å; L481-Q483 VanDerWaalsContact C-N 3.32Å; L481-Q483 PolarHBondContact O-N 3.3Å; Q483-Y487 VanDerWaalsContact O-CA 3.25Å; Q483-Y487 WeakPolarHBondContact O-CA 3.18Å; Q483-Y487 PolarHBondContact O-N 2.88Å; Q483-S488 WeakPolarHBondContact CG-O 3.11Å; Q483-S488 PolarHBondContact O-N 3.15Å |
| 484 | K | 89.1 | Confident | 80.7 | Confident | 161 Ų | 161 | 83.2 Ų | 83.2 | 70% | 0.7 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -72.1 | -44.2 | 178.7 | -73 | 178.3 | 179.4 | -175.8 | 0 | 112.8 | I480 L481 I482 | I480-K484 HydrophobicContact CG2-CD 4.08Å; I480-K484 HydrophobicContact CG2-CG 4.48Å; I480-K484 WeakPolarHBondContact O-CB 3.44Å; I480-K484 VanDerWaalsContact O-CG 3.32Å; I480-K484 WeakPolarHBondContact O-CG 3.45Å; I480-K484 PolarHBondContact O-N 3.43Å; L481-K484 PolarHBondContact O-N 3.18Å; I482-K484 VanDerWaalsContact C-N 3.32Å; I482-K484 PolarHBondContact O-N 3.29Å |
| 485 | V | 90.8 | Very high | 78.1 | Confident | 111 Ų | 111 | 84.4 Ų | 84.4 | 67% | 0.673 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -72.2 | -43.2 | -176.6 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | L481 I482 | L481-V485 HydrophobicContact CD1-CG2 3.87Å; L481-V485 HydrophobicContact CG-CG2 4.26Å; L481-V485 WeakPolarHBondContact O-CB 3.49Å; L481-V485 VanDerWaalsContact O-CG2 3.24Å; L481-V485 WeakPolarHBondContact O-CG2 3.34Å; L481-V485 PolarHBondContact O-N 2.84Å; I482-V485 PolarHBondContact O-N 3.13Å |
| 486 | C | 87.5 | Confident | 75.6 | Confident | 16 Ų | 16 | 91.4 Ų | 91.4 | 11% | 0.108 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -91 | -3.6 | -177.3 | -59.3 | 0 | 0 | 0 | 0 | 113.2 | H351 I358 P359 I482 S488 | H351-C486 PolarHBondContact CD2-O 3.47Å; I358-C486 HydrophobicContact CB-CB 4.46Å; I358-C486 HydrophobicContact CG2-CB 4.19Å; P359-C486 HydrophobicContact CG-CB 4.28Å; I482-C486 WeakPolarHBondContact O-CA 3.39Å; I482-C486 WeakPolarHBondContact O-CB 3.42Å; I482-C486 PolarHBondContact O-N 3Å; C486-S488 PolarHBondContact O-N 2.91Å |
| 487 | Y | 89.3 | Confident | 72.9 | Confident | 130 Ų | 130 | 93.5 Ų | 93.5 | 51% | 0.51 | 47% | 0.474 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 45.6 | 50.1 | -175.5 | -162.3 | -110.1 | 0 | 0 | 0 | 112.2 | V352 H353 Q483 | V352-Y487 HydrophobicContact CB-CD1 4.02Å; V352-Y487 HydrophobicContact CB-CE1 3.76Å; V352-Y487 HydrophobicContact CG1-CE1 4.26Å; V352-Y487 HydrophobicContact CG2-CD1 4.11Å; V352-Y487 HydrophobicContact CG2-CE1 3.98Å; V352-Y487 PolarHBondContact N-O 3.11Å; H353-Y487 AromaticContact CD2-CE1 3.69Å; H353-Y487 AromaticContact NE2-CE1 3.59Å; Q483-Y487 VanDerWaalsContact O-CA 3.25Å; Q483-Y487 WeakPolarHBondContact O-CA 3.18Å; Q483-Y487 PolarHBondContact O-N 2.88Å |
| 488 | S | 86.3 | Confident | 70.1 | Confident | 1 Ų | 1 | 99 Ų | 99 | 1% | 0.007 | 50% | 0.503 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.5 | 151.6 | -171.7 | 57.8 | 0 | 0 | 0 | 0 | 111.2 | I350 Q483 C486 | I350-S488 CarbonylContact O-C 3.4Å; I350-S488 VanDerWaalsContact O-CA 3.22Å; I350-S488 WeakPolarHBondContact O-CA 3.42Å; I350-S488 WeakPolarHBondContact O-CB 3.39Å; Q483-S488 WeakPolarHBondContact CG-O 3.11Å; Q483-S488 PolarHBondContact O-N 3.15Å; C486-S488 PolarHBondContact O-N 2.91Å |
| 489 | V | 84.6 | Confident | 69.3 | Low | 64 Ų | 64 | 102.5 Ų | 102.5 | 39% | 0.388 | 52% | 0.518 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.1 | 154 | -179.2 | -68.4 | 0 | 0 | 0 | 0 | 109.9 | M349 I350 V352 | M349-V489 CarbonylContact C-O 3.51Å; M349-V489 VanDerWaalsContact CA-O 3.31Å; M349-V489 WeakPolarHBondContact CA-O 3.36Å; I350-V489 PolarHBondContact N-O 2.9Å; I350-V489 PolarHBondContact O-N 3.28Å; V352-V489 HydrophobicContact CG2-CG1 3.81Å; V352-V489 HydrophobicContact CG2-CG2 4.01Å |
| 490 | L | 79.9 | Confident | 68.4 | Low | 71 Ų | 71 | 107.4 Ų | 107.4 | 37% | 0.372 | 54% | 0.54 | S | S | . | . | P | Polyproline II helix | trans | -65.7 | 141.2 | 168.1 | -106.9 | 94 | 0 | 0 | 0 | 109.2 | D345 M349 | D345-L490 HydrophobicContact CB-CD1 3.86Å; D345-L490 HydrophobicContact CB-CD2 4.13Å; D345-L490 HydrophobicContact CB-CG 4.45Å; M349-L490 HydrophobicContact CE-CD1 3.72Å; M349-L490 HydrophobicContact CG-CD1 3.88Å |
| 491 | T | 68.6 | Low | 67.4 | Low | 46 Ų | 46 | 108.5 Ų | 108.5 | 28% | 0.282 | 55% | 0.545 | S | S | . | . | P | Polyproline II helix | trans | -68.4 | 140.4 | 163.1 | 45.1 | 0 | 0 | 0 | 0 | 109.2 | F335 I350 M493 | F335-T491 HydrophobicContact CE2-CG2 4.13Å; F335-T491 HydrophobicContact CZ-CG2 4.2Å; I350-T491 HydrophobicContact CB-CG2 4.45Å; I350-T491 HydrophobicContact CD1-CG2 3.3Å; I350-T491 HydrophobicContact CG1-CG2 3.85Å; T491-M493 PolarHBondContact O-N 3.38Å; T491-M493 VanDerWaalsContact O-N 3.07Å |
| 492 | E | 57.5 | Low | 66 | Low | 193 Ų | 193 | 108.5 Ų | 108.5 | 90% | 0.902 | 54% | 0.544 | S | S | * | . | P | Polyproline II helix | trans | -50.7 | 119.3 | 166.3 | -72.9 | 176.3 | 170.4 | 0 | 0 | 107.8 | ||
| 493 | M | 50.3 | Low | 64.6 | Low | 108 Ų | 108 | 112.7 Ų | 112.7 | 53% | 0.532 | 56% | 0.564 | S | S | . | * | P | Polyproline II helix | trans | -69.9 | 133.3 | 173.9 | -70 | -173 | 56.9 | 0 | 0 | 106.6 | T491 D495 | T491-M493 PolarHBondContact O-N 3.38Å; T491-M493 VanDerWaalsContact O-N 3.07Å; M493-D495 PolarHBondContact O-N 3.41Å |
| 494 | D | 38.8 | Very low | 63 | Low | 113 Ų | 113 | 114.6 Ų | 114.6 | 60% | 0.604 | 58% | 0.576 | S | S | * | * | trans | -51.8 | 107.2 | 165.2 | -65.8 | -41.5 | 0 | 0 | 0 | 106.8 | R339 K496 | R339-D494 IonicContact CZ-OD2 3.34Å; R339-D494 IonicContact NH2-OD2 3.59Å; R339-D494 PolarHBondContact NH2-OD2 2.83Å; D494-K496 PolarHBondContact O-N 3.39Å | ||
| 495 | D | 32 | Very low | 61.2 | Low | 148 Ų | 148 | 111.3 Ų | 111.3 | 79% | 0.791 | 57% | 0.567 | S | S | * | * | trans | -59.5 | 104.3 | 175.2 | -95.7 | -28.6 | 0 | 0 | 0 | 106.3 | M493 S497 | M493-D495 PolarHBondContact O-N 3.41Å; D495-S497 PolarHBondContact O-N 3.47Å | ||
| 496 | K | 32.5 | Very low | 58.9 | Low | 189 Ų | 189 | 111.3 Ų | 111.3 | 82% | 0.822 | 56% | 0.559 | S | S | * | * | trans | -73.4 | 70.8 | 165.5 | -76.6 | -177.2 | 180 | 169.7 | 0 | 107.4 | D494 | D494-K496 PolarHBondContact O-N 3.39Š| ||
| 497 | S | 28.7 | Very low | 56.5 | Low | 98 Ų | 98 | 119.3 Ų | 119.3 | 69% | 0.685 | 60% | 0.596 | S | S | * | * | trans | -104.7 | 77.9 | 160.7 | 58.9 | 0 | 0 | 0 | 0 | 108.4 | D495 | D495-S497 PolarHBondContact O-N 3.47Š| ||
| 498 | E | 29.8 | Very low | 53.5 | Low | 270 Ų | 270 | 118.3 Ų | 118.3 | 100% | 1.262 | 60% | 0.604 | S | S | * | * | trans | -134.2 | 0 | 152.7 | -78.5 | -166.7 | 158.4 | 0 | 0 | 109.3 |
Retrieved 498 of 498 residues in 1306.4 ms
(Link to these results)