| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 37.2 | Very low | 46 | Very low | 245 Ų | 245 | 132.3 Ų | 132.3 | 100% | 1.207 | 78% | 0.778 | S | S | * | * | 0 | 94.1 | 0 | -76.2 | 169.7 | 143.4 | 0 | 0 | 108 | |||||
| 2 | A | 40.9 | Very low | 46.8 | Very low | 107 Ų | 107 | 133.6 Ų | 133.6 | 88% | 0.884 | 78% | 0.779 | S | S | * | * | trans | -115.5 | 105.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 3 | S | 41.2 | Very low | 46.9 | Very low | 106 Ų | 106 | 131.2 Ų | 131.2 | 74% | 0.741 | 78% | 0.784 | S | S | * | * | trans | -136.9 | 92.6 | 178.1 | 50.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 4 | N | 42.3 | Very low | 47.5 | Very low | 127 Ų | 127 | 124.9 Ų | 124.9 | 68% | 0.679 | 76% | 0.76 | S | S | * | * | trans | 28.6 | 92.3 | 149.2 | -77.3 | 15.4 | 0 | 0 | 0 | 117.8 | T6 | N4-T6 PolarHBondContact O-N 3.22Š| ||
| 5 | S | 45.2 | Very low | 48.2 | Very low | 117 Ų | 117 | 121.5 Ų | 121.5 | 82% | 0.818 | 73% | 0.729 | S | S | * | * | trans | -78.9 | 14.4 | 159 | -54.8 | 0 | 0 | 0 | 0 | 113.5 | K7 | S5-K7 PolarHBondContact O-N 3.1Š| ||
| 6 | T | 51.9 | Low | 49.1 | Very low | 93 Ų | 93 | 116.6 Ų | 116.6 | 57% | 0.571 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -77.1 | 2.8 | 179.9 | 34.5 | 0 | 0 | 0 | 0 | 114.5 | N4 | N4-T6 PolarHBondContact O-N 3.22Š|
| 7 | K | 48.3 | Very low | 50.3 | Low | 195 Ų | 195 | 117.9 Ų | 117.9 | 85% | 0.848 | 71% | 0.707 | S | S | * | * | G | 310 helix | trans | -91.5 | 11.7 | -172.5 | -70.6 | -168.2 | 178.9 | -179.1 | 0 | 116.2 | S5 | S5-K7 PolarHBondContact O-N 3.1Š|
| 8 | S | 46 | Very low | 51.7 | Low | 108 Ų | 108 | 116.9 Ų | 116.9 | 76% | 0.755 | 69% | 0.693 | S | S | * | * | G | 310 helix | trans | -109.4 | 26.7 | 173.1 | 62 | 0 | 0 | 0 | 0 | 113.1 | ||
| 9 | F | 51.4 | Low | 53 | Low | 101 Ų | 101 | 114.4 Ų | 114.4 | 44% | 0.443 | 67% | 0.674 | S | S | . | * | S | Bend | trans | -88.4 | -3.8 | -175.3 | -120.5 | -79.5 | 0 | 0 | 0 | 114.7 | P58 | F9-P58 HydrophobicContact CE1-CG 3.65Å; F9-P58 HydrophobicContact CZ-CG 3.71Å |
| 10 | L | 54.7 | Low | 54.3 | Low | 166 Ų | 166 | 113.9 Ų | 113.9 | 87% | 0.869 | 67% | 0.668 | S | S | * | * | trans | -139.5 | 63.1 | -171.5 | -60.1 | 173.8 | 0 | 0 | 0 | 111.6 | ||||
| 11 | A | 47.3 | Very low | 55.9 | Low | 90 Ų | 90 | 112.9 Ų | 112.9 | 74% | 0.744 | 66% | 0.659 | S | S | * | * | trans | -113.3 | 77.8 | 160.8 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 12 | D | 54.6 | Low | 58.3 | Low | 148 Ų | 148 | 101.2 Ų | 101.2 | 79% | 0.791 | 60% | 0.602 | S | S | * | * | 64.3 | 127.2 | 90 | -159.6 | 35.1 | 0 | 0 | 0 | 113.9 | G14 | D12-G14 PolarHBondContact O-N 3.43Š| |||
| 13 | A | 48.3 | Very low | 60.5 | Low | 102 Ų | 102 | 99.6 Ų | 99.6 | 84% | 0.843 | 58% | 0.578 | S | S | * | * | S | Bend | trans | 72.8 | -24.5 | -178.8 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||
| 14 | G | 55.1 | Low | 62.9 | Low | 43 Ų | 43 | 97.8 Ų | 97.8 | 44% | 0.443 | 57% | 0.566 | S | S | . | * | S | Bend | trans | -103.5 | -5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | D12 | D12-G14 PolarHBondContact O-N 3.43Š|
| 15 | Y | 58.3 | Low | 65.2 | Low | 75 Ų | 75 | 93 Ų | 93 | 29% | 0.294 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -72.7 | -37.1 | -164.1 | -146.2 | -94.3 | 0 | 0 | 0 | 113.3 | E17 Q18 E19 F57 | Y15-E17 PolarHBondContact O-N 3.32Å; Y15-Q18 PolarHBondContact O-N 2.58Å; Y15-E19 HydrophobicContact CD1-CB 4.49Å; Y15-E19 WeakPolarHBondContact O-CB 3.38Å; Y15-E19 PolarHBondContact O-N 2.92Å; Y15-F57 HydrophobicContact CD2-CE1 4.21Å; Y15-F57 HydrophobicContact CE1-CD1 4.39Å; Y15-F57 AromaticContact CE2-CD1 3.69Å; Y15-F57 HydrophobicContact CE2-CD1 3.69Å; Y15-F57 AromaticContact CE2-CE1 3.41Å; Y15-F57 HydrophobicContact CE2-CE1 3.41Å; Y15-F57 VanDerWaalsContact CE2-CE1 3.41Å; Y15-F57 HydrophobicContact CE2-CZ 4.12Å; Y15-F57 AromaticContact CZ-CD1 3.44Å; Y15-F57 VanDerWaalsContact CZ-CD1 3.44Å; Y15-F57 AromaticContact CZ-CE1 3.63Å; Y15-F57 AromaticContact CZ-CG 3.96Å; Y15-F57 WeakPolarHBondContact OH-CD1 3.34Å; Y15-F57 WeakPolarHBondContact OH-CG 3.31Å |
| 16 | G | 63.4 | Low | 67.3 | Low | 42 Ų | 42 | 87.6 Ų | 87.6 | 43% | 0.433 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.7 | -46 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | E19 L20 | G16-E19 PolarHBondContact O-N 3.46Å; G16-L20 VanDerWaalsContact O-CG 3.26Å; G16-L20 WeakPolarHBondContact O-CG 3.3Å; G16-L20 PolarHBondContact O-N 3.28Å |
| 17 | E | 69.6 | Low | 69.2 | Low | 140 Ų | 140 | 89.2 Ų | 89.2 | 65% | 0.654 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67.2 | -43 | 178.6 | -61.5 | -63.6 | 133.1 | 0 | 0 | 111.6 | Y15 E19 L20 D21 | Y15-E17 PolarHBondContact O-N 3.32Å; E17-E19 VanDerWaalsContact C-N 3.3Å; E17-E19 PolarHBondContact O-N 3.48Å; E17-L20 PolarHBondContact O-N 3.11Å; E17-D21 WeakPolarHBondContact O-CB 3.42Å; E17-D21 PolarHBondContact O-N 3.43Å |
| 18 | Q | 74.8 | Confident | 71.2 | Confident | 99 Ų | 99 | 86.7 Ų | 86.7 | 46% | 0.463 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.8 | -32.8 | 175.3 | -80.6 | -176 | 5.9 | 0 | 0 | 112.8 | Y15 A22 F57 | Y15-Q18 PolarHBondContact O-N 2.58Å; Q18-A22 WeakPolarHBondContact O-CB 3.07Å; Q18-A22 PolarHBondContact O-N 3.1Å; Q18-F57 HydrophobicContact CB-CE2 4.26Å; Q18-F57 HydrophobicContact CB-CZ 4.2Å |
| 19 | E | 75.8 | Confident | 73.3 | Confident | 70 Ų | 70 | 82.3 Ų | 82.3 | 33% | 0.327 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -72.9 | -36.2 | 177.1 | -171.6 | 169.1 | -162.9 | 0 | 0 | 111.7 | Y15 G16 E17 N23 | Y15-E19 HydrophobicContact CD1-CB 4.49Å; Y15-E19 WeakPolarHBondContact O-CB 3.38Å; Y15-E19 PolarHBondContact O-N 2.92Å; G16-E19 PolarHBondContact O-N 3.46Å; E17-E19 VanDerWaalsContact C-N 3.3Å; E17-E19 PolarHBondContact O-N 3.48Å; E19-N23 WeakPolarHBondContact O-CB 3.42Å; E19-N23 PolarHBondContact O-N 3.2Å; E19-N23 PolarHBondContact O-ND2 2.94Å |
| 20 | L | 79.9 | Confident | 75.2 | Confident | 104 Ų | 104 | 78.6 Ų | 78.6 | 55% | 0.545 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -65.6 | -45.2 | 171.4 | -72.3 | 171.6 | 0 | 0 | 0 | 111.4 | G16 E17 N23 S24 | G16-L20 VanDerWaalsContact O-CG 3.26Å; G16-L20 WeakPolarHBondContact O-CG 3.3Å; G16-L20 PolarHBondContact O-N 3.28Å; E17-L20 PolarHBondContact O-N 3.11Å; L20-N23 PolarHBondContact O-N 3.5Å; L20-S24 WeakPolarHBondContact O-CB 3.33Å; L20-S24 PolarHBondContact O-N 3.3Å; L20-S24 PolarHBondContact O-OG 2.9Å |
| 21 | D | 88.2 | Confident | 76.8 | Confident | 92 Ų | 92 | 78.7 Ų | 78.7 | 49% | 0.492 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.1 | -43.2 | 174.8 | -84.2 | -2.3 | 0 | 0 | 0 | 111.8 | E17 S24 A25 | E17-D21 WeakPolarHBondContact O-CB 3.42Å; E17-D21 PolarHBondContact O-N 3.43Å; D21-S24 PolarHBondContact O-N 3.37Å; D21-A25 WeakPolarHBondContact O-CB 3.21Å; D21-A25 PolarHBondContact O-N 2.65Å |
| 22 | A | 87.6 | Confident | 78.7 | Confident | 1 Ų | 1 | 75.2 Ų | 75.2 | 1% | 0.008 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -65.7 | -40.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q18 S24 A25 L26 Y55 L60 | Q18-A22 WeakPolarHBondContact O-CB 3.07Å; Q18-A22 PolarHBondContact O-N 3.1Å; A22-S24 VanDerWaalsContact C-N 3.35Å; A22-A25 PolarHBondContact O-N 3.14Å; A22-L26 WeakPolarHBondContact O-CB 3.43Å; A22-L26 PolarHBondContact O-N 3.09Å; A22-Y55 HydrophobicContact CB-CD1 3.86Å; A22-Y55 HydrophobicContact CB-CD2 3.98Å; A22-Y55 HydrophobicContact CB-CE1 4.18Å; A22-Y55 HydrophobicContact CB-CE2 4.3Å; A22-Y55 HydrophobicContact CB-CG 3.75Å; A22-L60 HydrophobicContact CB-CD1 3.96Å; A22-L60 HydrophobicContact CB-CD2 3.87Å |
| 23 | N | 87.2 | Confident | 80.2 | Confident | 72 Ų | 72 | 68.3 Ų | 68.3 | 39% | 0.385 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -62.6 | -43.2 | 173.7 | -93.7 | -72 | 0 | 0 | 0 | 111.4 | E19 L20 L26 M27 | E19-N23 WeakPolarHBondContact O-CB 3.42Å; E19-N23 PolarHBondContact O-N 3.2Å; E19-N23 PolarHBondContact O-ND2 2.94Å; L20-N23 PolarHBondContact O-N 3.5Å; N23-L26 PolarHBondContact O-N 2.96Å; N23-M27 WeakPolarHBondContact O-CG 3.38Å; N23-M27 PolarHBondContact O-N 3.07Å |
| 24 | S | 91.1 | Very high | 82 | Confident | 69 Ų | 69 | 72 Ų | 72 | 48% | 0.483 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -60.3 | -49.1 | 177.1 | -59.3 | 0 | 0 | 0 | 0 | 111 | L20 D21 A22 L26 M27 E28 | L20-S24 WeakPolarHBondContact O-CB 3.33Å; L20-S24 PolarHBondContact O-N 3.3Å; L20-S24 PolarHBondContact O-OG 2.9Å; D21-S24 PolarHBondContact O-N 3.37Å; A22-S24 VanDerWaalsContact C-N 3.35Å; S24-L26 VanDerWaalsContact C-N 3.32Å; S24-L26 PolarHBondContact O-N 3.27Å; S24-M27 PolarHBondContact O-N 3.16Å; S24-M27 VanDerWaalsContact O-N 3.15Å; S24-E28 PolarHBondContact O-N 3.17Å |
| 25 | A | 90.3 | Very high | 83.2 | Confident | 25 Ų | 25 | 71 Ų | 71 | 21% | 0.207 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -61.3 | -38.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | D21 A22 E28 L29 L51 | D21-A25 WeakPolarHBondContact O-CB 3.21Å; D21-A25 PolarHBondContact O-N 2.65Å; A22-A25 PolarHBondContact O-N 3.14Å; A25-E28 PolarHBondContact O-N 2.75Å; A25-L29 WeakPolarHBondContact O-CG 3.35Å; A25-L29 PolarHBondContact O-N 3.45Å; A25-L51 HydrophobicContact CB-CD1 3.51Å |
| 26 | L | 90.7 | Very high | 84.3 | Confident | 4 Ų | 4 | 71.4 Ų | 71.4 | 2% | 0.021 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -68.3 | -35.7 | 175.3 | -176.3 | 64.1 | 0 | 0 | 0 | 112.6 | A22 N23 S24 D30 F48 L51 L60 A64 K67 | A22-L26 WeakPolarHBondContact O-CB 3.43Å; A22-L26 PolarHBondContact O-N 3.09Å; N23-L26 PolarHBondContact O-N 2.96Å; S24-L26 VanDerWaalsContact C-N 3.32Å; S24-L26 PolarHBondContact O-N 3.27Å; L26-D30 WeakPolarHBondContact O-CB 3.43Å; L26-D30 PolarHBondContact O-N 3.19Å; L26-F48 HydrophobicContact CD1-CE1 3.78Å; L26-F48 HydrophobicContact CD1-CZ 4.38Å; L26-L51 HydrophobicContact CB-CD2 4.42Å; L26-L51 HydrophobicContact CD1-CD2 4.07Å; L26-L60 HydrophobicContact CB-CD1 4.05Å; L26-L60 HydrophobicContact CD2-CD1 3.85Å; L26-L60 HydrophobicContact CG-CD1 4.46Å; L26-A64 HydrophobicContact CD1-CB 3.83Å; L26-K67 HydrophobicContact CD1-CD 4.24Å; L26-K67 HydrophobicContact CD2-CD 4.4Å; L26-K67 HydrophobicContact CG-CD 4.19Å |
| 27 | M | 89.9 | Confident | 85.3 | Confident | 127 Ų | 127 | 75.7 Ų | 75.7 | 63% | 0.626 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -66.7 | -39.6 | 175 | -74.3 | -157.2 | -175.8 | 0 | 0 | 111.9 | N23 S24 D30 K31 | N23-M27 WeakPolarHBondContact O-CG 3.38Å; N23-M27 PolarHBondContact O-N 3.07Å; S24-M27 PolarHBondContact O-N 3.16Å; S24-M27 VanDerWaalsContact O-N 3.15Å; M27-D30 PolarHBondContact O-N 3.42Å; M27-K31 PolarHBondContact O-N 3.43Å |
| 28 | E | 91.5 | Very high | 85.8 | Confident | 143 Ų | 143 | 73.1 Ų | 73.1 | 67% | 0.668 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -62.1 | -43.1 | 174.9 | -71.6 | -173.7 | 166.7 | 0 | 0 | 112.1 | S24 A25 K31 G32 | S24-E28 PolarHBondContact O-N 3.17Å; A25-E28 PolarHBondContact O-N 2.75Å; E28-K31 WeakPolarHBondContact O-CB 3.3Å; E28-K31 PolarHBondContact O-N 3.3Å; E28-G32 PolarHBondContact O-N 3.09Å |
| 29 | L | 90.6 | Very high | 86.2 | Confident | 16 Ų | 16 | 71 Ų | 71 | 8% | 0.084 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -64.1 | -41.7 | 176.1 | -68.9 | 175.1 | 0 | 0 | 0 | 112 | A25 K31 G32 L33 A44 R47 F48 L51 | A25-L29 WeakPolarHBondContact O-CG 3.35Å; A25-L29 PolarHBondContact O-N 3.45Å; L29-K31 VanDerWaalsContact C-N 3.31Å; L29-K31 PolarHBondContact O-N 3.23Å; L29-G32 PolarHBondContact O-N 3.39Å; L29-G32 VanDerWaalsContact O-N 3.15Å; L29-L33 VanDerWaalsContact O-CG 3.31Å; L29-L33 WeakPolarHBondContact O-CG 3.1Å; L29-L33 PolarHBondContact O-N 3.26Å; L29-A44 HydrophobicContact CD2-CB 4.39Å; L29-R47 HydrophobicContact CD2-CB 3.52Å; L29-R47 HydrophobicContact CD2-CG 4.4Å; L29-F48 HydrophobicContact CB-CE2 3.88Å; L29-F48 HydrophobicContact CB-CZ 3.81Å; L29-F48 HydrophobicContact CD1-CD1 4.27Å; L29-F48 HydrophobicContact CD1-CD2 4.2Å; L29-F48 HydrophobicContact CD1-CE1 4.22Å; L29-F48 HydrophobicContact CD1-CE2 4.12Å; L29-F48 HydrophobicContact CD1-CG 4.27Å; L29-F48 HydrophobicContact CD1-CZ 4.14Å; L29-F48 HydrophobicContact CG-CE2 4.44Å; L29-L51 HydrophobicContact CD1-CB 4.29Å; L29-L51 HydrophobicContact CD1-CD1 4.44Å; L29-L51 HydrophobicContact CD1-CD2 3.94Å; L29-L51 HydrophobicContact CD1-CG 4.46Å |
| 30 | D | 89.7 | Confident | 86.7 | Confident | 23 Ų | 23 | 71 Ų | 71 | 12% | 0.123 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -60.5 | -40.1 | 175.1 | -171.4 | 20.2 | 0 | 0 | 0 | 111.9 | L26 M27 G32 L33 R34 K67 | L26-D30 WeakPolarHBondContact O-CB 3.43Å; L26-D30 PolarHBondContact O-N 3.19Å; M27-D30 PolarHBondContact O-N 3.42Å; D30-G32 VanDerWaalsContact C-N 3.35Å; D30-G32 PolarHBondContact O-N 2.99Å; D30-L33 PolarHBondContact O-N 3.3Å; D30-R34 WeakPolarHBondContact O-CB 3.14Å; D30-R34 VanDerWaalsContact O-CG 3.3Å; D30-R34 WeakPolarHBondContact O-CG 3.14Å; D30-R34 PolarHBondContact O-N 2.92Å; D30-R34 IonicContact OD1-CZ 3.48Å; D30-R34 IonicContact OD1-NE 3.72Å; D30-R34 PolarHBondContact OD1-NE 3.02Å; D30-R34 IonicContact OD1-NH2 3.17Å; D30-R34 IonicContact OD2-NE 2.84Å; D30-R34 IonicContact OD2-NH2 2.87Å; D30-K67 HydrophobicContact CB-CD 3.98Å; D30-K67 WeakPolarHBondContact OD2-CE 3.36Å; D30-K67 IonicContact OD2-NZ 2.75Å; D30-K67 PolarHBondContact OD2-NZ 2.85Å |
| 31 | K | 89.5 | Confident | 86.9 | Confident | 167 Ų | 167 | 68.3 Ų | 68.3 | 73% | 0.726 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -61.3 | -43.2 | 173.4 | -172.5 | -178.4 | 178.8 | -177.4 | 0 | 111.7 | M27 E28 L29 R34 S35 | M27-K31 PolarHBondContact O-N 3.43Å; E28-K31 WeakPolarHBondContact O-CB 3.3Å; E28-K31 PolarHBondContact O-N 3.3Å; L29-K31 VanDerWaalsContact C-N 3.31Å; L29-K31 PolarHBondContact O-N 3.23Å; K31-R34 PolarHBondContact O-N 2.54Å; K31-S35 PolarHBondContact O-N 3.19Å |
| 32 | G | 87.3 | Confident | 86.8 | Confident | 17 Ų | 17 | 67.2 Ų | 67.2 | 18% | 0.175 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -64.5 | -39.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113 | E28 L29 D30 S35 | E28-G32 PolarHBondContact O-N 3.09Å; L29-G32 PolarHBondContact O-N 3.39Å; L29-G32 VanDerWaalsContact O-N 3.15Å; D30-G32 VanDerWaalsContact C-N 3.35Å; D30-G32 PolarHBondContact O-N 2.99Å; G32-S35 VanDerWaalsContact O-CA 3.25Å; G32-S35 WeakPolarHBondContact O-CA 3.33Å; G32-S35 PolarHBondContact O-N 3.29Å |
| 33 | L | 86 | Confident | 86.8 | Confident | 3 Ų | 3 | 71.7 Ų | 71.7 | 2% | 0.016 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -66.8 | -36.3 | 175.7 | -72 | 172.3 | 0 | 0 | 0 | 113.1 | L29 D30 S35 Q41 A44 V45 F48 L68 V71 | L29-L33 VanDerWaalsContact O-CG 3.31Å; L29-L33 WeakPolarHBondContact O-CG 3.1Å; L29-L33 PolarHBondContact O-N 3.26Å; D30-L33 PolarHBondContact O-N 3.3Å; L33-S35 PolarHBondContact O-N 3.08Å; L33-Q41 WeakPolarHBondContact O-CG 3.17Å; L33-Q41 PolarHBondContact O-NE2 2.81Å; L33-Q41 VanDerWaalsContact O-NE2 3.08Å; L33-A44 HydrophobicContact CD2-CB 4Å; L33-A44 HydrophobicContact CG-CB 3.95Å; L33-V45 HydrophobicContact CD2-CG2 3.57Å; L33-F48 HydrophobicContact CD1-CE2 3.52Å; L33-F48 HydrophobicContact CD1-CZ 3.51Å; L33-F48 HydrophobicContact CD2-CE2 4.33Å; L33-F48 HydrophobicContact CG-CE2 4.11Å; L33-L68 HydrophobicContact CD1-CD2 4.16Å; L33-L68 HydrophobicContact CD2-CD2 4.26Å; L33-V71 HydrophobicContact CB-CG2 3.79Å; L33-V71 HydrophobicContact CD1-CG2 4.11Å; L33-V71 HydrophobicContact CD2-CG1 4.27Å; L33-V71 HydrophobicContact CD2-CG2 4.43Å; L33-V71 HydrophobicContact CG-CG2 4.33Å |
| 34 | R | 85.4 | Confident | 86.9 | Confident | 181 Ų | 181 | 68.6 Ų | 68.6 | 68% | 0.683 | 38% | 0.377 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.8 | 1 | 171.8 | -65.1 | 173.2 | -173.5 | -131.3 | -0.5 | 112.9 | D30 K31 G36 | D30-R34 WeakPolarHBondContact O-CB 3.14Å; D30-R34 VanDerWaalsContact O-CG 3.3Å; D30-R34 WeakPolarHBondContact O-CG 3.14Å; D30-R34 PolarHBondContact O-N 2.92Å; D30-R34 IonicContact OD1-CZ 3.48Å; D30-R34 IonicContact OD1-NE 3.72Å; D30-R34 PolarHBondContact OD1-NE 3.02Å; D30-R34 IonicContact OD1-NH2 3.17Å; D30-R34 IonicContact OD2-NE 2.84Å; D30-R34 IonicContact OD2-NH2 2.87Å; K31-R34 PolarHBondContact O-N 2.54Å; R34-G36 PolarHBondContact O-N 3.46Å |
| 35 | S | 81.8 | Confident | 86.7 | Confident | 21 Ų | 21 | 67.8 Ų | 67.8 | 15% | 0.147 | 37% | 0.369 | C | S | . | . | trans | -24.6 | 122.5 | 154.9 | 170.2 | 0 | 0 | 0 | 0 | 114.7 | K31 G32 L33 K37 E40 Q41 | K31-S35 PolarHBondContact O-N 3.19Å; G32-S35 VanDerWaalsContact O-CA 3.25Å; G32-S35 WeakPolarHBondContact O-CA 3.33Å; G32-S35 PolarHBondContact O-N 3.29Å; L33-S35 PolarHBondContact O-N 3.08Å; S35-K37 PolarHBondContact O-N 3.4Å; S35-K37 PolarHBondContact OG-N 2.94Å; S35-K37 VanDerWaalsContact OG-N 3.07Å; S35-E40 WeakPolarHBondContact CB-OE2 3.38Å; S35-E40 PolarHBondContact OG-OE2 2.87Å; S35-Q41 PolarHBondContact O-NE2 3.49Å | ||
| 36 | G | 80.8 | Confident | 86.7 | Confident | 84 Ų | 84 | 71.3 Ų | 71.3 | 87% | 0.866 | 39% | 0.388 | S | S | * | . | S | Bend | trans | -73.1 | -11.6 | 157.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | R34 | R34-G36 PolarHBondContact O-N 3.46Š|
| 37 | K | 83 | Confident | 86.6 | Confident | 132 Ų | 132 | 77.1 Ų | 77.1 | 57% | 0.574 | 41% | 0.409 | S | S | * | . | S | Bend | trans | -105.2 | 124 | -174.7 | -56.2 | -173.3 | -154.3 | 149.5 | 0 | 111.1 | S35 G39 E40 Q41 | S35-K37 PolarHBondContact O-N 3.4Å; S35-K37 PolarHBondContact OG-N 2.94Å; S35-K37 VanDerWaalsContact OG-N 3.07Å; K37-G39 PolarHBondContact O-N 2.86Å; K37-E40 HydrophobicContact CB-CB 4.36Å; K37-E40 HydrophobicContact CB-CG 4.21Å; K37-E40 HydrophobicContact CD-CG 4.48Å; K37-E40 WeakPolarHBondContact CD-OE1 3.43Å; K37-E40 WeakPolarHBondContact CE-OE1 3.36Å; K37-E40 IonicContact NZ-OE1 2.89Å; K37-E40 PolarHBondContact NZ-OE1 3.14Å; K37-E40 PolarHBondContact O-N 3.18Å; K37-E40 VanDerWaalsContact O-N 3.14Å; K37-Q41 WeakPolarHBondContact O-CG 3.48Å; K37-Q41 PolarHBondContact O-N 2.85Å; K37-Q41 VanDerWaalsContact O-N 3.1Å |
| 38 | L | 80.5 | Confident | 86.5 | Confident | 85 Ų | 85 | 71.2 Ų | 71.2 | 45% | 0.445 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -55.9 | -38 | 179.3 | -175.1 | 66 | 0 | 0 | 0 | 112.9 | Q41 C42 | L38-Q41 PolarHBondContact O-N 3.35Å; L38-C42 WeakPolarHBondContact O-CB 3.48Å; L38-C42 PolarHBondContact O-N 2.83Å; L38-C42 PolarHBondContact O-SG 3.28Å |
| 39 | G | 83.9 | Confident | 86.4 | Confident | 54 Ų | 54 | 67.6 Ų | 67.6 | 56% | 0.557 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -61.1 | -45.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113 | K37 C42 E43 | K37-G39 PolarHBondContact O-N 2.86Å; G39-C42 PolarHBondContact O-N 3.4Å; G39-E43 WeakPolarHBondContact O-CB 3.4Å; G39-E43 PolarHBondContact O-N 2.86Å |
| 40 | E | 86.1 | Confident | 86.3 | Confident | 71 Ų | 71 | 76.1 Ų | 76.1 | 33% | 0.332 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -68 | -37 | 178.6 | -66.6 | 177.4 | -166 | 0 | 0 | 111.4 | S35 K37 E43 A44 | S35-E40 WeakPolarHBondContact CB-OE2 3.38Å; S35-E40 PolarHBondContact OG-OE2 2.87Å; K37-E40 HydrophobicContact CB-CB 4.36Å; K37-E40 HydrophobicContact CB-CG 4.21Å; K37-E40 HydrophobicContact CD-CG 4.48Å; K37-E40 WeakPolarHBondContact CD-OE1 3.43Å; K37-E40 WeakPolarHBondContact CE-OE1 3.36Å; K37-E40 IonicContact NZ-OE1 2.89Å; K37-E40 PolarHBondContact NZ-OE1 3.14Å; K37-E40 PolarHBondContact O-N 3.18Å; K37-E40 VanDerWaalsContact O-N 3.14Å; E40-E43 PolarHBondContact O-N 3.24Å; E40-A44 WeakPolarHBondContact O-CB 3.25Å; E40-A44 PolarHBondContact O-N 3.44Å |
| 41 | Q | 84.6 | Confident | 86.2 | Confident | 48 Ų | 48 | 75.7 Ų | 75.7 | 22% | 0.224 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -64 | -48.5 | 174.4 | -67.9 | -176.2 | -32.6 | 0 | 0 | 111.8 | L33 S35 K37 L38 E43 A44 V45 | L33-Q41 WeakPolarHBondContact O-CG 3.17Å; L33-Q41 PolarHBondContact O-NE2 2.81Å; L33-Q41 VanDerWaalsContact O-NE2 3.08Å; S35-Q41 PolarHBondContact O-NE2 3.49Å; K37-Q41 WeakPolarHBondContact O-CG 3.48Å; K37-Q41 PolarHBondContact O-N 2.85Å; K37-Q41 VanDerWaalsContact O-N 3.1Å; L38-Q41 PolarHBondContact O-N 3.35Å; Q41-E43 VanDerWaalsContact C-N 3.31Å; Q41-E43 PolarHBondContact O-N 3.12Å; Q41-A44 PolarHBondContact O-N 3.36Å; Q41-V45 WeakPolarHBondContact O-CG2 3.39Å; Q41-V45 PolarHBondContact O-N 3.05Å |
| 42 | C | 85.3 | Confident | 86.1 | Confident | 68 Ų | 68 | 69.8 Ų | 69.8 | 46% | 0.459 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -61.9 | -41.7 | 177.7 | -71.9 | 0 | 0 | 0 | 0 | 111.3 | L38 G39 A44 V45 V46 | L38-C42 WeakPolarHBondContact O-CB 3.48Å; L38-C42 PolarHBondContact O-N 2.83Å; L38-C42 PolarHBondContact O-SG 3.28Å; G39-C42 PolarHBondContact O-N 3.4Å; C42-A44 VanDerWaalsContact C-N 3.34Å; C42-V45 PolarHBondContact O-N 2.7Å; C42-V46 PolarHBondContact O-N 2.88Å; C42-V46 VanDerWaalsContact O-N 3.11Å |
| 43 | E | 88.2 | Confident | 86.1 | Confident | 96 Ų | 96 | 76.7 Ų | 76.7 | 45% | 0.449 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -62.7 | -40.9 | 176.2 | -173.1 | 173.5 | -175.2 | 0 | 0 | 112.1 | G39 E40 Q41 V46 R47 | G39-E43 WeakPolarHBondContact O-CB 3.4Å; G39-E43 PolarHBondContact O-N 2.86Å; E40-E43 PolarHBondContact O-N 3.24Å; Q41-E43 VanDerWaalsContact C-N 3.31Å; Q41-E43 PolarHBondContact O-N 3.12Å; E43-V46 WeakPolarHBondContact O-CG2 3.48Å; E43-R47 VanDerWaalsContact O-CG 3.3Å; E43-R47 WeakPolarHBondContact O-CG 3.21Å; E43-R47 PolarHBondContact O-N 3.47Å; E43-R47 IonicContact OE1-CZ 3.77Å; E43-R47 IonicContact OE1-NE 3.69Å; E43-R47 IonicContact OE1-NH2 3.72Å; E43-R47 PolarHBondContact OE1-NH2 3.49Å |
| 44 | A | 88.9 | Confident | 86.1 | Confident | 6 Ų | 6 | 83.4 Ų | 83.4 | 5% | 0.05 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -62.2 | -45.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | L29 L33 E40 Q41 C42 V46 R47 F48 | L29-A44 HydrophobicContact CD2-CB 4.39Å; L33-A44 HydrophobicContact CD2-CB 4Å; L33-A44 HydrophobicContact CG-CB 3.95Å; E40-A44 WeakPolarHBondContact O-CB 3.25Å; E40-A44 PolarHBondContact O-N 3.44Å; Q41-A44 PolarHBondContact O-N 3.36Å; C42-A44 VanDerWaalsContact C-N 3.34Å; A44-V46 PolarHBondContact O-N 3.04Å; A44-R47 PolarHBondContact O-N 3.18Å; A44-F48 WeakPolarHBondContact O-CD2 3.34Å |
| 45 | V | 86.9 | Confident | 86.2 | Confident | 52 Ų | 52 | 75.5 Ų | 75.5 | 32% | 0.315 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -59.2 | -45.6 | 179.5 | 173.4 | 0 | 0 | 0 | 0 | 112 | L33 Q41 C42 R47 F48 L68 | L33-V45 HydrophobicContact CD2-CG2 3.57Å; Q41-V45 WeakPolarHBondContact O-CG2 3.39Å; Q41-V45 PolarHBondContact O-N 3.05Å; C42-V45 PolarHBondContact O-N 2.7Å; V45-R47 PolarHBondContact O-N 3.34Å; V45-F48 PolarHBondContact O-N 3.15Å; V45-L68 HydrophobicContact CG2-CD2 4.21Å |
| 46 | V | 90 | Very high | 86.3 | Confident | 99 Ų | 99 | 78.1 Ų | 78.1 | 60% | 0.6 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -71 | -13.8 | -178.2 | -60.1 | 0 | 0 | 0 | 0 | 113.8 | C42 E43 A44 P49 | C42-V46 PolarHBondContact O-N 2.88Å; C42-V46 VanDerWaalsContact O-N 3.11Å; E43-V46 WeakPolarHBondContact O-CG2 3.48Å; A44-V46 PolarHBondContact O-N 3.04Å; V46-P49 WeakPolarHBondContact O-CD 3.04Å |
| 47 | R | 89.6 | Confident | 86.5 | Confident | 126 Ų | 126 | 75.1 Ų | 75.1 | 48% | 0.475 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -85.5 | -19.7 | 176.7 | -72.8 | 174.9 | -179.3 | -155.5 | 3.3 | 113.3 | L29 E43 A44 V45 R50 L51 | L29-R47 HydrophobicContact CD2-CB 3.52Å; L29-R47 HydrophobicContact CD2-CG 4.4Å; E43-R47 VanDerWaalsContact O-CG 3.3Å; E43-R47 WeakPolarHBondContact O-CG 3.21Å; E43-R47 PolarHBondContact O-N 3.47Å; E43-R47 IonicContact OE1-CZ 3.77Å; E43-R47 IonicContact OE1-NE 3.69Å; E43-R47 IonicContact OE1-NH2 3.72Å; E43-R47 PolarHBondContact OE1-NH2 3.49Å; A44-R47 PolarHBondContact O-N 3.18Å; V45-R47 PolarHBondContact O-N 3.34Å; R47-R50 PolarHBondContact O-N 3.29Å; R47-R50 VanDerWaalsContact O-N 3.16Å; R47-L51 PolarHBondContact O-N 3.03Å; R47-L51 VanDerWaalsContact O-N 3.09Å |
| 48 | F | 88.3 | Confident | 86.5 | Confident | 3 Ų | 3 | 71.7 Ų | 71.7 | 1% | 0.013 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -56.9 | -44.1 | 176.8 | -83 | -90.6 | 0 | 0 | 0 | 114.4 | L26 L29 L33 A44 V45 R50 L51 F52 A64 L68 | L26-F48 HydrophobicContact CD1-CE1 3.78Å; L26-F48 HydrophobicContact CD1-CZ 4.38Å; L29-F48 HydrophobicContact CB-CE2 3.88Å; L29-F48 HydrophobicContact CB-CZ 3.81Å; L29-F48 HydrophobicContact CD1-CD1 4.27Å; L29-F48 HydrophobicContact CD1-CD2 4.2Å; L29-F48 HydrophobicContact CD1-CE1 4.22Å; L29-F48 HydrophobicContact CD1-CE2 4.12Å; L29-F48 HydrophobicContact CD1-CG 4.27Å; L29-F48 HydrophobicContact CD1-CZ 4.14Å; L29-F48 HydrophobicContact CG-CE2 4.44Å; L33-F48 HydrophobicContact CD1-CE2 3.52Å; L33-F48 HydrophobicContact CD1-CZ 3.51Å; L33-F48 HydrophobicContact CD2-CE2 4.33Å; L33-F48 HydrophobicContact CG-CE2 4.11Å; A44-F48 WeakPolarHBondContact O-CD2 3.34Å; V45-F48 PolarHBondContact O-N 3.15Å; F48-R50 VanDerWaalsContact C-N 3.25Å; F48-R50 PolarHBondContact O-N 2.98Å; F48-L51 WeakPolarHBondContact O-CA 3.27Å; F48-L51 VanDerWaalsContact O-CB 3.3Å; F48-L51 WeakPolarHBondContact O-CB 3.33Å; F48-L51 PolarHBondContact O-N 3.4Å; F48-F52 HydrophobicContact CB-CE2 4.14Å; F48-F52 HydrophobicContact CB-CZ 4.25Å; F48-F52 HydrophobicContact CD1-CE1 4.36Å; F48-F52 AromaticContact CD1-CZ 3.9Å; F48-F52 HydrophobicContact CD1-CZ 3.9Å; F48-F52 WeakPolarHBondContact O-CD2 3.3Å; F48-F52 WeakPolarHBondContact O-CG 3.42Å; F48-F52 PolarHBondContact O-N 2.91Å; F48-A64 HydrophobicContact CD1-CB 3.8Å; F48-A64 HydrophobicContact CE1-CB 3.65Å; F48-L68 HydrophobicContact CB-CD1 4.38Å; F48-L68 HydrophobicContact CD1-CD1 3.92Å; F48-L68 HydrophobicContact CD1-CG 4.29Å; F48-L68 HydrophobicContact CD2-CD1 4.27Å; F48-L68 HydrophobicContact CD2-CD2 3.91Å; F48-L68 HydrophobicContact CD2-CG 4.32Å; F48-L68 HydrophobicContact CE1-CD1 4.25Å; F48-L68 HydrophobicContact CE1-CG 4.14Å; F48-L68 HydrophobicContact CE2-CD2 3.79Å; F48-L68 HydrophobicContact CE2-CG 4.2Å; F48-L68 HydrophobicContact CG-CD1 3.92Å; F48-L68 HydrophobicContact CG-CD2 4.4Å; F48-L68 HydrophobicContact CG-CG 4.37Å; F48-L68 HydrophobicContact CZ-CD2 4.16Å; F48-L68 HydrophobicContact CZ-CG 4.1Å |
| 49 | P | 87.8 | Confident | 86.9 | Confident | 68 Ų | 68 | 72.7 Ų | 72.7 | 44% | 0.442 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -57.1 | -38.4 | 175.9 | -26.9 | 35 | 0 | 0 | 0 | 113.2 | V46 F52 Q53 | V46-P49 WeakPolarHBondContact O-CD 3.04Å; P49-F52 PolarHBondContact O-N 3.43Å; P49-Q53 WeakPolarHBondContact O-CG 3.49Å; P49-Q53 PolarHBondContact O-N 3.06Å |
| 50 | R | 89 | Confident | 87 | Confident | 194 Ų | 194 | 70.7 Ų | 70.7 | 73% | 0.732 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -69.3 | -35.3 | 176.2 | -65.3 | -175 | -175.7 | -148.8 | 1 | 111.6 | R47 F48 Q53 K54 | R47-R50 PolarHBondContact O-N 3.29Å; R47-R50 VanDerWaalsContact O-N 3.16Å; F48-R50 VanDerWaalsContact C-N 3.25Å; F48-R50 PolarHBondContact O-N 2.98Å; R50-Q53 PolarHBondContact O-N 3.47Å; R50-K54 PolarHBondContact O-N 3.5Å; R50-K54 VanDerWaalsContact O-N 3.12Å |
| 51 | L | 87.9 | Confident | 87.1 | Confident | 14 Ų | 14 | 69.6 Ų | 69.6 | 7% | 0.073 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -60.8 | -44.8 | 174.1 | -169.1 | 79.3 | 0 | 0 | 0 | 111.2 | A25 L26 L29 R47 F48 Q53 K54 Y55 L60 | A25-L51 HydrophobicContact CB-CD1 3.51Å; L26-L51 HydrophobicContact CB-CD2 4.42Å; L26-L51 HydrophobicContact CD1-CD2 4.07Å; L29-L51 HydrophobicContact CD1-CB 4.29Å; L29-L51 HydrophobicContact CD1-CD1 4.44Å; L29-L51 HydrophobicContact CD1-CD2 3.94Å; L29-L51 HydrophobicContact CD1-CG 4.46Å; R47-L51 PolarHBondContact O-N 3.03Å; R47-L51 VanDerWaalsContact O-N 3.09Å; F48-L51 WeakPolarHBondContact O-CA 3.27Å; F48-L51 VanDerWaalsContact O-CB 3.3Å; F48-L51 WeakPolarHBondContact O-CB 3.33Å; F48-L51 PolarHBondContact O-N 3.4Å; L51-Q53 PolarHBondContact O-N 3.04Å; L51-K54 PolarHBondContact O-N 2.95Å; L51-Y55 HydrophobicContact CD1-CD2 3.9Å; L51-Y55 HydrophobicContact CD1-CE2 4.18Å; L51-Y55 HydrophobicContact CG-CD2 4.36Å; L51-Y55 PolarHBondContact O-N 3.41Å; L51-L60 HydrophobicContact CD2-CD2 4.08Å; L51-L60 HydrophobicContact CD2-CG 4.41Å; L51-L60 HydrophobicContact CG-CD2 4.14Å |
| 52 | F | 87.6 | Confident | 87.4 | Confident | 43 Ų | 43 | 72.3 Ų | 72.3 | 19% | 0.189 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -69.1 | -32.4 | -179.6 | -56.6 | -34.3 | 0 | 0 | 0 | 113.5 | F48 P49 K54 Y55 I61 A64 | F48-F52 HydrophobicContact CB-CE2 4.14Å; F48-F52 HydrophobicContact CB-CZ 4.25Å; F48-F52 HydrophobicContact CD1-CE1 4.36Å; F48-F52 AromaticContact CD1-CZ 3.9Å; F48-F52 HydrophobicContact CD1-CZ 3.9Å; F48-F52 WeakPolarHBondContact O-CD2 3.3Å; F48-F52 WeakPolarHBondContact O-CG 3.42Å; F48-F52 PolarHBondContact O-N 2.91Å; P49-F52 PolarHBondContact O-N 3.43Å; F52-K54 VanDerWaalsContact C-N 3.34Å; F52-Y55 CarbonylContact O-C 3.49Å; F52-I61 HydrophobicContact CD1-CG1 3.85Å; F52-I61 HydrophobicContact CE1-CG1 4.28Å; F52-I61 HydrophobicContact CG-CG1 4.42Å; F52-A64 HydrophobicContact CE1-CB 3.39Å; F52-A64 HydrophobicContact CZ-CB 3.55Å |
| 53 | Q | 86.6 | Confident | 87.6 | Confident | 162 Ų | 162 | 71.3 Ų | 71.3 | 76% | 0.757 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -67.2 | -37.9 | 172.9 | -71.8 | 174.6 | 12 | 0 | 0 | 111.7 | P49 R50 L51 | P49-Q53 WeakPolarHBondContact O-CG 3.49Å; P49-Q53 PolarHBondContact O-N 3.06Å; R50-Q53 PolarHBondContact O-N 3.47Å; L51-Q53 PolarHBondContact O-N 3.04Å |
| 54 | K | 86.4 | Confident | 87.7 | Confident | 145 Ų | 145 | 66.7 Ų | 66.7 | 63% | 0.63 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -77.4 | -35.7 | -179.7 | -168.3 | 174.1 | -179.7 | -166.7 | 0 | 112.6 | R50 L51 F52 | R50-K54 PolarHBondContact O-N 3.5Å; R50-K54 VanDerWaalsContact O-N 3.12Å; L51-K54 PolarHBondContact O-N 2.95Å; F52-K54 VanDerWaalsContact C-N 3.34Å |
| 55 | Y | 86.7 | Confident | 87.7 | Confident | 14 Ų | 14 | 72.1 Ų | 72.1 | 6% | 0.055 | 36% | 0.358 | C | S | . | . | trans | -132.7 | 83.1 | -175.8 | -54.8 | -72.6 | 0 | 0 | 0 | 110.2 | A22 L51 F52 F57 L60 | A22-Y55 HydrophobicContact CB-CD1 3.86Å; A22-Y55 HydrophobicContact CB-CD2 3.98Å; A22-Y55 HydrophobicContact CB-CE1 4.18Å; A22-Y55 HydrophobicContact CB-CE2 4.3Å; A22-Y55 HydrophobicContact CB-CG 3.75Å; L51-Y55 HydrophobicContact CD1-CD2 3.9Å; L51-Y55 HydrophobicContact CD1-CE2 4.18Å; L51-Y55 HydrophobicContact CG-CD2 4.36Å; L51-Y55 PolarHBondContact O-N 3.41Å; F52-Y55 CarbonylContact O-C 3.49Å; Y55-F57 HydrophobicContact CD1-CD2 4.48Å; Y55-F57 AromaticContact CD1-CE2 3.76Å; Y55-F57 HydrophobicContact CD1-CE2 3.76Å; Y55-F57 HydrophobicContact CD1-CZ 4.44Å; Y55-F57 HydrophobicContact CG-CE2 4.3Å; Y55-F57 PolarHBondContact O-N 3.32Å; Y55-L60 HydrophobicContact CD2-CD2 4.35Å; Y55-L60 HydrophobicContact CG-CD2 4.19Å | ||
| 56 | P | 83.6 | Confident | 87.9 | Confident | 76 Ų | 76 | 75.7 Ų | 75.7 | 49% | 0.494 | 38% | 0.375 | S | S | . | . | trans | -78.6 | 38.2 | -177.4 | 34.2 | -37.1 | 0 | 0 | 0 | 112.6 | ||||
| 57 | F | 85.8 | Confident | 87.7 | Confident | 21 Ų | 21 | 73.4 Ų | 73.4 | 9% | 0.092 | 36% | 0.357 | C | S | . | . | trans | -85.2 | 126.5 | -177.4 | -51.5 | -45.4 | 0 | 0 | 0 | 110.4 | Y15 Q18 Y55 I59 L60 I61 | Y15-F57 HydrophobicContact CD2-CE1 4.21Å; Y15-F57 HydrophobicContact CE1-CD1 4.39Å; Y15-F57 AromaticContact CE2-CD1 3.69Å; Y15-F57 HydrophobicContact CE2-CD1 3.69Å; Y15-F57 AromaticContact CE2-CE1 3.41Å; Y15-F57 HydrophobicContact CE2-CE1 3.41Å; Y15-F57 VanDerWaalsContact CE2-CE1 3.41Å; Y15-F57 HydrophobicContact CE2-CZ 4.12Å; Y15-F57 AromaticContact CZ-CD1 3.44Å; Y15-F57 VanDerWaalsContact CZ-CD1 3.44Å; Y15-F57 AromaticContact CZ-CE1 3.63Å; Y15-F57 AromaticContact CZ-CG 3.96Å; Y15-F57 WeakPolarHBondContact OH-CD1 3.34Å; Y15-F57 WeakPolarHBondContact OH-CG 3.31Å; Q18-F57 HydrophobicContact CB-CE2 4.26Å; Q18-F57 HydrophobicContact CB-CZ 4.2Å; Y55-F57 HydrophobicContact CD1-CD2 4.48Å; Y55-F57 AromaticContact CD1-CE2 3.76Å; Y55-F57 HydrophobicContact CD1-CE2 3.76Å; Y55-F57 HydrophobicContact CD1-CZ 4.44Å; Y55-F57 HydrophobicContact CG-CE2 4.3Å; Y55-F57 PolarHBondContact O-N 3.32Å; F57-I59 PolarHBondContact O-N 3.18Å; F57-L60 HydrophobicContact CB-CB 4.16Å; F57-L60 PolarHBondContact O-N 2.97Å; F57-L60 VanDerWaalsContact O-N 3.09Å; F57-I61 WeakPolarHBondContact O-CG1 3.47Å; F57-I61 PolarHBondContact O-N 3.49Å | ||
| 58 | P | 82.8 | Confident | 87.5 | Confident | 61 Ų | 61 | 68.2 Ų | 68.2 | 40% | 0.396 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -55.3 | -37.8 | -178.3 | -28 | 33.6 | 0 | 0 | 0 | 113.4 | F9 I61 N62 | F9-P58 HydrophobicContact CE1-CG 3.65Å; F9-P58 HydrophobicContact CZ-CG 3.71Å; P58-I61 PolarHBondContact O-N 3.32Å; P58-N62 WeakPolarHBondContact O-CB 3.4Å; P58-N62 PolarHBondContact O-N 3.45Å |
| 59 | I | 88.3 | Confident | 87.4 | Confident | 106 Ų | 106 | 70.7 Ų | 70.7 | 54% | 0.544 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -64.2 | -46.1 | 179 | -61.9 | 169.9 | 0 | 0 | 0 | 110.8 | F57 N62 S63 | F57-I59 PolarHBondContact O-N 3.18Å; I59-N62 PolarHBondContact O-N 3.04Å; I59-S63 WeakPolarHBondContact O-CB 3.3Å; I59-S63 PolarHBondContact O-N 2.87Å; I59-S63 PolarHBondContact O-OG 2.89Å |
| 60 | L | 86.4 | Confident | 87.2 | Confident | 11 Ų | 11 | 70.9 Ų | 70.9 | 6% | 0.058 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -65 | -44.4 | 178.7 | -172.9 | 76 | 0 | 0 | 0 | 111.2 | A22 L26 L51 Y55 F57 S63 A64 | A22-L60 HydrophobicContact CB-CD1 3.96Å; A22-L60 HydrophobicContact CB-CD2 3.87Å; L26-L60 HydrophobicContact CB-CD1 4.05Å; L26-L60 HydrophobicContact CD2-CD1 3.85Å; L26-L60 HydrophobicContact CG-CD1 4.46Å; L51-L60 HydrophobicContact CD2-CD2 4.08Å; L51-L60 HydrophobicContact CD2-CG 4.41Å; L51-L60 HydrophobicContact CG-CD2 4.14Å; Y55-L60 HydrophobicContact CD2-CD2 4.35Å; Y55-L60 HydrophobicContact CG-CD2 4.19Å; F57-L60 HydrophobicContact CB-CB 4.16Å; F57-L60 PolarHBondContact O-N 2.97Å; F57-L60 VanDerWaalsContact O-N 3.09Å; L60-S63 PolarHBondContact O-N 3.17Å; L60-A64 VanDerWaalsContact O-CB 3.27Å; L60-A64 WeakPolarHBondContact O-CB 3.46Å; L60-A64 PolarHBondContact O-N 3.09Å |
| 61 | I | 87.9 | Confident | 86.7 | Confident | 49 Ų | 49 | 63.1 Ų | 63.1 | 25% | 0.251 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -59.8 | -49.7 | 178.9 | -68.2 | 167.9 | 0 | 0 | 0 | 110.2 | F52 F57 P58 S63 A64 F65 | F52-I61 HydrophobicContact CD1-CG1 3.85Å; F52-I61 HydrophobicContact CE1-CG1 4.28Å; F52-I61 HydrophobicContact CG-CG1 4.42Å; F57-I61 WeakPolarHBondContact O-CG1 3.47Å; F57-I61 PolarHBondContact O-N 3.49Å; P58-I61 PolarHBondContact O-N 3.32Å; I61-S63 VanDerWaalsContact C-N 3.32Å; I61-S63 PolarHBondContact O-N 3.05Å; I61-A64 PolarHBondContact O-N 3.48Å; I61-F65 HydrophobicContact CG2-CD2 3.65Å; I61-F65 HydrophobicContact CG2-CE2 3.54Å; I61-F65 VanDerWaalsContact O-CD2 3.22Å; I61-F65 WeakPolarHBondContact O-CD2 3.22Å; I61-F65 PolarHBondContact O-N 3.33Å |
| 62 | N | 90.6 | Very high | 86.2 | Confident | 105 Ų | 105 | 67.7 Ų | 67.7 | 56% | 0.561 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -58.9 | -45.5 | 176.7 | -73.5 | -9.9 | 0 | 0 | 0 | 111.3 | P58 I59 A64 F65 L66 | P58-N62 WeakPolarHBondContact O-CB 3.4Å; P58-N62 PolarHBondContact O-N 3.45Å; I59-N62 PolarHBondContact O-N 3.04Å; N62-A64 PolarHBondContact O-N 3.36Å; N62-F65 PolarHBondContact O-N 3Å; N62-L66 WeakPolarHBondContact O-CG 3.45Å; N62-L66 PolarHBondContact O-N 2.83Å |
| 63 | S | 90.5 | Very high | 85.6 | Confident | 46 Ų | 46 | 74.6 Ų | 74.6 | 32% | 0.322 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -63.8 | -40.5 | -179.4 | -57.8 | 0 | 0 | 0 | 0 | 112.3 | I59 L60 I61 L66 K67 | I59-S63 WeakPolarHBondContact O-CB 3.3Å; I59-S63 PolarHBondContact O-N 2.87Å; I59-S63 PolarHBondContact O-OG 2.89Å; L60-S63 PolarHBondContact O-N 3.17Å; I61-S63 VanDerWaalsContact C-N 3.32Å; I61-S63 PolarHBondContact O-N 3.05Å; S63-L66 PolarHBondContact O-N 2.87Å; S63-K67 WeakPolarHBondContact O-CG 3.25Å; S63-K67 PolarHBondContact O-N 3.24Å |
| 64 | A | 89.7 | Confident | 84.7 | Confident | 0 Ų | 0 | 71.4 Ų | 71.4 | 0% | 0 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -65.5 | -42.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | L26 F48 F52 L60 I61 N62 K67 L68 | L26-A64 HydrophobicContact CD1-CB 3.83Å; F48-A64 HydrophobicContact CD1-CB 3.8Å; F48-A64 HydrophobicContact CE1-CB 3.65Å; F52-A64 HydrophobicContact CE1-CB 3.39Å; F52-A64 HydrophobicContact CZ-CB 3.55Å; L60-A64 VanDerWaalsContact O-CB 3.27Å; L60-A64 WeakPolarHBondContact O-CB 3.46Å; L60-A64 PolarHBondContact O-N 3.09Å; I61-A64 PolarHBondContact O-N 3.48Å; N62-A64 PolarHBondContact O-N 3.36Å; A64-K67 PolarHBondContact O-N 2.9Å; A64-L68 WeakPolarHBondContact O-CG 3.27Å; A64-L68 PolarHBondContact O-N 2.88Å |
| 65 | F | 89.4 | Confident | 83.3 | Confident | 119 Ų | 119 | 66 Ų | 66 | 52% | 0.522 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -63.8 | -39.6 | 176.2 | -85.5 | -63.2 | 0 | 0 | 0 | 112.5 | I61 N62 K67 L68 A69 | I61-F65 HydrophobicContact CG2-CD2 3.65Å; I61-F65 HydrophobicContact CG2-CE2 3.54Å; I61-F65 VanDerWaalsContact O-CD2 3.22Å; I61-F65 WeakPolarHBondContact O-CD2 3.22Å; I61-F65 PolarHBondContact O-N 3.33Å; N62-F65 PolarHBondContact O-N 3Å; F65-K67 PolarHBondContact O-N 3.37Å; F65-L68 PolarHBondContact O-N 3.36Å; F65-A69 VanDerWaalsContact O-CB 3.25Å; F65-A69 WeakPolarHBondContact O-CB 3.37Å; F65-A69 PolarHBondContact O-N 2.84Å |
| 66 | L | 90.1 | Very high | 81.7 | Confident | 127 Ų | 127 | 70.9 Ų | 70.9 | 67% | 0.665 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -61.5 | -43.4 | 175.3 | -70.1 | 172.8 | 0 | 0 | 0 | 111.8 | N62 S63 A69 D70 | N62-L66 WeakPolarHBondContact O-CG 3.45Å; N62-L66 PolarHBondContact O-N 2.83Å; S63-L66 PolarHBondContact O-N 2.87Å; L66-A69 PolarHBondContact O-N 3.15Å; L66-D70 PolarHBondContact O-N 3.32Å |
| 67 | K | 86.8 | Confident | 80 | Confident | 51 Ų | 51 | 77.4 Ų | 77.4 | 22% | 0.222 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -64.2 | -45.3 | 176.4 | -72.8 | -178.9 | 175.7 | -156.2 | 0 | 112.2 | L26 D30 S63 A64 F65 A69 D70 V71 | L26-K67 HydrophobicContact CD1-CD 4.24Å; L26-K67 HydrophobicContact CD2-CD 4.4Å; L26-K67 HydrophobicContact CG-CD 4.19Å; D30-K67 HydrophobicContact CB-CD 3.98Å; D30-K67 WeakPolarHBondContact OD2-CE 3.36Å; D30-K67 IonicContact OD2-NZ 2.75Å; D30-K67 PolarHBondContact OD2-NZ 2.85Å; S63-K67 WeakPolarHBondContact O-CG 3.25Å; S63-K67 PolarHBondContact O-N 3.24Å; A64-K67 PolarHBondContact O-N 2.9Å; F65-K67 PolarHBondContact O-N 3.37Å; K67-A69 VanDerWaalsContact C-N 3.34Å; K67-A69 PolarHBondContact O-N 2.89Å; K67-D70 PolarHBondContact O-N 2.93Å; K67-V71 WeakPolarHBondContact O-CG2 3.49Å; K67-V71 PolarHBondContact O-N 2.86Å; K67-V71 VanDerWaalsContact O-N 3.14Å |
| 68 | L | 85.4 | Confident | 78 | Confident | 18 Ų | 18 | 79.7 Ų | 79.7 | 9% | 0.094 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -60.2 | -44.7 | 174.6 | -77.3 | 171.3 | 0 | 0 | 0 | 111.3 | L33 V45 F48 A64 F65 D70 V71 F72 | L33-L68 HydrophobicContact CD1-CD2 4.16Å; L33-L68 HydrophobicContact CD2-CD2 4.26Å; V45-L68 HydrophobicContact CG2-CD2 4.21Å; F48-L68 HydrophobicContact CB-CD1 4.38Å; F48-L68 HydrophobicContact CD1-CD1 3.92Å; F48-L68 HydrophobicContact CD1-CG 4.29Å; F48-L68 HydrophobicContact CD2-CD1 4.27Å; F48-L68 HydrophobicContact CD2-CD2 3.91Å; F48-L68 HydrophobicContact CD2-CG 4.32Å; F48-L68 HydrophobicContact CE1-CD1 4.25Å; F48-L68 HydrophobicContact CE1-CG 4.14Å; F48-L68 HydrophobicContact CE2-CD2 3.79Å; F48-L68 HydrophobicContact CE2-CG 4.2Å; F48-L68 HydrophobicContact CG-CD1 3.92Å; F48-L68 HydrophobicContact CG-CD2 4.4Å; F48-L68 HydrophobicContact CG-CG 4.37Å; F48-L68 HydrophobicContact CZ-CD2 4.16Å; F48-L68 HydrophobicContact CZ-CG 4.1Å; A64-L68 WeakPolarHBondContact O-CG 3.27Å; A64-L68 PolarHBondContact O-N 2.88Å; F65-L68 PolarHBondContact O-N 3.36Å; L68-D70 VanDerWaalsContact C-N 3.32Å; L68-D70 PolarHBondContact O-N 3.46Å; L68-V71 PolarHBondContact O-N 2.93Å; L68-F72 HydrophobicContact CB-CD2 4.39Å; L68-F72 HydrophobicContact CB-CE2 4.24Å; L68-F72 HydrophobicContact CD2-CE2 4.41Å; L68-F72 WeakPolarHBondContact O-CD2 3.14Å; L68-F72 PolarHBondContact O-N 3.35Å |
| 69 | A | 86.7 | Confident | 76.1 | Confident | 54 Ų | 54 | 82.7 Ų | 82.7 | 45% | 0.446 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -59.9 | -41.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.2 | F65 L66 K67 F72 R73 | F65-A69 VanDerWaalsContact O-CB 3.25Å; F65-A69 WeakPolarHBondContact O-CB 3.37Å; F65-A69 PolarHBondContact O-N 2.84Å; L66-A69 PolarHBondContact O-N 3.15Å; K67-A69 VanDerWaalsContact C-N 3.34Å; K67-A69 PolarHBondContact O-N 2.89Å; A69-F72 PolarHBondContact O-N 3.26Å; A69-R73 VanDerWaalsContact O-CB 3.27Å; A69-R73 WeakPolarHBondContact O-CB 3.41Å; A69-R73 PolarHBondContact O-N 2.94Å |
| 70 | D | 83.4 | Confident | 73.9 | Confident | 72 Ų | 72 | 80.7 Ų | 80.7 | 39% | 0.385 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -67 | -37.9 | 177 | -163.4 | 38.3 | 0 | 0 | 0 | 111.9 | L66 K67 L68 R73 V74 | L66-D70 PolarHBondContact O-N 3.32Å; K67-D70 PolarHBondContact O-N 2.93Å; L68-D70 VanDerWaalsContact C-N 3.32Å; L68-D70 PolarHBondContact O-N 3.46Å; D70-R73 PolarHBondContact O-N 3.18Å; D70-R73 IonicContact OD1-CZ 3.43Å; D70-R73 IonicContact OD1-NE 2.65Å; D70-R73 PolarHBondContact OD1-NE 3.48Å; D70-R73 IonicContact OD1-NH2 3.57Å; D70-R73 PolarHBondContact OD1-NH2 2.96Å; D70-V74 WeakPolarHBondContact O-CB 3.35Å; D70-V74 WeakPolarHBondContact O-CG2 3.37Å; D70-V74 PolarHBondContact O-N 3.26Å |
| 71 | V | 77.5 | Confident | 71.8 | Confident | 32 Ų | 32 | 83.9 Ų | 83.9 | 19% | 0.194 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -66.2 | -39.7 | 173.9 | 175.4 | 0 | 0 | 0 | 0 | 111.7 | L33 K67 L68 G75 | L33-V71 HydrophobicContact CB-CG2 3.79Å; L33-V71 HydrophobicContact CD1-CG2 4.11Å; L33-V71 HydrophobicContact CD2-CG1 4.27Å; L33-V71 HydrophobicContact CD2-CG2 4.43Å; L33-V71 HydrophobicContact CG-CG2 4.33Å; K67-V71 WeakPolarHBondContact O-CG2 3.49Å; K67-V71 PolarHBondContact O-N 2.86Å; K67-V71 VanDerWaalsContact O-N 3.14Å; L68-V71 PolarHBondContact O-N 2.93Å; V71-G75 WeakPolarHBondContact O-CA 3.43Å; V71-G75 PolarHBondContact O-N 2.74Å |
| 72 | F | 77 | Confident | 69.9 | Low | 109 Ų | 109 | 87.9 Ų | 87.9 | 48% | 0.478 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -65.9 | -41.3 | 173.5 | -75.8 | -64.9 | 0 | 0 | 0 | 111.1 | L68 A69 M76 | L68-F72 HydrophobicContact CB-CD2 4.39Å; L68-F72 HydrophobicContact CB-CE2 4.24Å; L68-F72 HydrophobicContact CD2-CE2 4.41Å; L68-F72 WeakPolarHBondContact O-CD2 3.14Å; L68-F72 PolarHBondContact O-N 3.35Å; A69-F72 PolarHBondContact O-N 3.26Å; F72-M76 WeakPolarHBondContact O-CB 3.49Å; F72-M76 WeakPolarHBondContact O-CG 3.46Å; F72-M76 PolarHBondContact O-N 3.47Å; F72-M76 VanDerWaalsContact O-N 3.09Å |
| 73 | R | 76.4 | Confident | 67.8 | Low | 188 Ų | 188 | 91.7 Ų | 91.7 | 71% | 0.709 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -62.8 | -43.4 | 178.4 | -170.1 | -177.5 | 71.6 | 101 | 1.6 | 112.6 | A69 D70 | A69-R73 VanDerWaalsContact O-CB 3.27Å; A69-R73 WeakPolarHBondContact O-CB 3.41Å; A69-R73 PolarHBondContact O-N 2.94Å; D70-R73 PolarHBondContact O-N 3.18Å; D70-R73 IonicContact OD1-CZ 3.43Å; D70-R73 IonicContact OD1-NE 2.65Å; D70-R73 PolarHBondContact OD1-NE 3.48Å; D70-R73 IonicContact OD1-NH2 3.57Å; D70-R73 PolarHBondContact OD1-NH2 2.96Å |
| 74 | V | 66.5 | Low | 65.6 | Low | 95 Ų | 95 | 96.4 Ų | 96.4 | 58% | 0.576 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -88.7 | -40.6 | -176.6 | 179 | 0 | 0 | 0 | 0 | 111.8 | D70 | D70-V74 WeakPolarHBondContact O-CB 3.35Å; D70-V74 WeakPolarHBondContact O-CG2 3.37Å; D70-V74 PolarHBondContact O-N 3.26Å |
| 75 | G | 58.8 | Low | 63.4 | Low | 33 Ų | 33 | 104.7 Ų | 104.7 | 34% | 0.34 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -83 | -11.9 | -174.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | V71 R77 C78 | V71-G75 WeakPolarHBondContact O-CA 3.43Å; V71-G75 PolarHBondContact O-N 2.74Å; G75-R77 PolarHBondContact O-N 3.38Å; G75-C78 PolarHBondContact O-N 2.93Å |
| 76 | M | 51.4 | Low | 61.3 | Low | 116 Ų | 116 | 107.5 Ų | 107.5 | 57% | 0.571 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -61.4 | -6 | 172.9 | -92 | 171.5 | 67.1 | 0 | 0 | 114.3 | F72 C78 S80 | F72-M76 WeakPolarHBondContact O-CB 3.49Å; F72-M76 WeakPolarHBondContact O-CG 3.46Å; F72-M76 PolarHBondContact O-N 3.47Å; F72-M76 VanDerWaalsContact O-N 3.09Å; M76-C78 VanDerWaalsContact C-N 3.27Å; M76-C78 PolarHBondContact O-N 2.83Å; M76-S80 WeakPolarHBondContact O-CB 3.37Å; M76-S80 PolarHBondContact O-N 3.41Å; M76-S80 PolarHBondContact O-OG 3.33Å |
| 77 | R | 48.9 | Very low | 59 | Low | 213 Ų | 213 | 113.8 Ų | 113.8 | 80% | 0.804 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -67 | -19.6 | 164.1 | -88.2 | -174.9 | -166.2 | 166.2 | 6.2 | 114.3 | G75 V81 | G75-R77 PolarHBondContact O-N 3.38Å; R77-V81 WeakPolarHBondContact O-CB 2.99Å; R77-V81 WeakPolarHBondContact O-CG2 3.15Å |
| 78 | C | 43.6 | Very low | 57.7 | Low | 68 Ų | 68 | 117 Ų | 117 | 46% | 0.459 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -92.6 | -32.7 | -178.3 | -128.2 | 0 | 0 | 0 | 0 | 114 | G75 M76 | G75-C78 PolarHBondContact O-N 2.93Å; M76-C78 VanDerWaalsContact C-N 3.27Å; M76-C78 PolarHBondContact O-N 2.83Å |
| 79 | M | 42.8 | Very low | 56.2 | Low | 125 Ų | 125 | 122.2 Ų | 122.2 | 62% | 0.616 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -79.1 | -41.3 | 173.8 | -82.8 | -175 | 66.2 | 0 | 0 | 112.3 | Y83 | M79-Y83 WeakPolarHBondContact O-CD2 3.33Å; M79-Y83 PolarHBondContact O-N 3.33Å |
| 80 | S | 41.4 | Very low | 54.5 | Low | 63 Ų | 63 | 125.9 Ų | 125.9 | 44% | 0.441 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -69.1 | -35.8 | -178.7 | 55.6 | 0 | 0 | 0 | 0 | 113.1 | M76 L84 | M76-S80 WeakPolarHBondContact O-CB 3.37Å; M76-S80 PolarHBondContact O-N 3.41Å; M76-S80 PolarHBondContact O-OG 3.33Å; S80-L84 WeakPolarHBondContact O-CB 3.26Å; S80-L84 PolarHBondContact O-N 2.93Å; S80-L84 VanDerWaalsContact O-N 3.1Å |
| 81 | V | 43.3 | Very low | 52.8 | Low | 78 Ų | 78 | 129.1 Ų | 129.1 | 47% | 0.473 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -73.7 | -29 | -177.9 | 177.9 | 0 | 0 | 0 | 0 | 112.9 | R77 K85 | R77-V81 WeakPolarHBondContact O-CB 2.99Å; R77-V81 WeakPolarHBondContact O-CG2 3.15Å; V81-K85 HydrophobicContact CG1-CG 4.35Å; V81-K85 VanDerWaalsContact O-CB 3.3Å; V81-K85 WeakPolarHBondContact O-CB 3.44Å; V81-K85 WeakPolarHBondContact O-CG 3.35Å; V81-K85 PolarHBondContact O-N 3.34Å |
| 82 | K | 48.4 | Very low | 51.3 | Low | 133 Ų | 133 | 135.2 Ų | 135.2 | 58% | 0.578 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -79.2 | -32.9 | 177.5 | -68 | -173 | -176.1 | -177.7 | 0 | 113.4 | ||
| 83 | Y | 45.3 | Very low | 49.5 | Very low | 185 Ų | 185 | 136.9 Ų | 136.9 | 73% | 0.725 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -78 | -28.1 | 174.7 | -81.8 | -88.2 | 0 | 0 | 0 | 112.8 | M79 | M79-Y83 WeakPolarHBondContact O-CD2 3.33Å; M79-Y83 PolarHBondContact O-N 3.33Å |
| 84 | L | 44.6 | Very low | 47.6 | Very low | 145 Ų | 145 | 133.3 Ų | 133.3 | 76% | 0.759 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -85.3 | -17.8 | 176.6 | -121.7 | 90 | 0 | 0 | 0 | 114.6 | S80 H86 | S80-L84 WeakPolarHBondContact O-CB 3.26Å; S80-L84 PolarHBondContact O-N 2.93Å; S80-L84 VanDerWaalsContact O-N 3.1Å; L84-H86 VanDerWaalsContact C-N 3.32Å |
| 85 | K | 44.4 | Very low | 46.2 | Very low | 174 Ų | 174 | 136.2 Ų | 136.2 | 76% | 0.757 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.2 | -0.3 | 176.4 | -84.1 | -108.1 | -177.9 | 175.9 | 0 | 114 | V81 | V81-K85 HydrophobicContact CG1-CG 4.35Å; V81-K85 VanDerWaalsContact O-CB 3.3Å; V81-K85 WeakPolarHBondContact O-CB 3.44Å; V81-K85 WeakPolarHBondContact O-CG 3.35Å; V81-K85 PolarHBondContact O-N 3.34Å |
| 86 | H | 45.4 | Very low | 45.1 | Very low | 179 Ų | 179 | 144.8 Ų | 144.8 | 83% | 0.829 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118 | 20.6 | 179.4 | -115 | 28.1 | 0 | 0 | 0 | 113.5 | L84 | L84-H86 VanDerWaalsContact C-N 3.32Š|
| 87 | K | 41.7 | Very low | 44.5 | Very low | 259 Ų | 259 | 147.5 Ų | 147.5 | 100% | 1.126 | 69% | 0.688 | S | S | * | * | trans | -117.6 | 0 | 160.8 | -94.2 | -164.5 | 173.8 | -175.7 | 0 | 109.9 |
Retrieved 87 of 87 residues in 26.1 ms
(Link to these results)