| 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 | 40.3 | Very low | 56.8 | Low | 239 Ų | 239 | 135.6 Ų | 135.6 | 100% | 1.177 | 79% | 0.787 | S | S | * | * | 0 | 111.7 | 0 | -71.6 | 138.5 | 91.2 | 0 | 0 | 107.5 | |||||
| 2 | N | 55.5 | Low | 57.2 | Low | 144 Ų | 144 | 137.5 Ų | 137.5 | 77% | 0.77 | 78% | 0.778 | S | S | * | * | trans | -103.5 | 98.2 | -174.7 | 53.8 | -19.2 | 0 | 0 | 0 | 110.1 | T4 | N2-T4 PolarHBondContact O-N 3.44Š| ||
| 3 | S | 49.9 | Very low | 57.9 | Low | 120 Ų | 120 | 135.7 Ų | 135.7 | 84% | 0.839 | 77% | 0.765 | S | S | * | * | trans | -70.7 | 98.4 | 177.1 | -48.6 | 0 | 0 | 0 | 0 | 109.8 | T5 | S3-T5 PolarHBondContact O-N 2.88Š| ||
| 4 | T | 52.7 | Low | 58.4 | Low | 116 Ų | 116 | 128 Ų | 128 | 71% | 0.712 | 73% | 0.731 | S | S | * | * | trans | -71.4 | 106.9 | 176 | -62 | 0 | 0 | 0 | 0 | 108.7 | N2 T6 | N2-T4 PolarHBondContact O-N 3.44Å; T4-T6 PolarHBondContact O-N 3.48Å | ||
| 5 | T | 59.5 | Low | 59.2 | Low | 124 Ų | 124 | 124.2 Ų | 124.2 | 76% | 0.761 | 72% | 0.722 | S | S | * | * | trans | -77.2 | 99.7 | 172.7 | -172 | 0 | 0 | 0 | 0 | 108.9 | S3 Q7 | S3-T5 PolarHBondContact O-N 2.88Å; T5-Q7 PolarHBondContact O-N 3.03Å; T5-Q7 VanDerWaalsContact O-N 3.15Å | ||
| 6 | T | 57.7 | Low | 60.4 | Low | 124 Ų | 124 | 121.2 Ų | 121.2 | 76% | 0.761 | 71% | 0.705 | S | S | * | * | trans | -75.3 | 97.8 | 172.4 | -62.9 | 0 | 0 | 0 | 0 | 108.1 | T4 | T4-T6 PolarHBondContact O-N 3.48Š| ||
| 7 | Q | 63 | Low | 61.4 | Low | 165 Ų | 165 | 117.4 Ų | 117.4 | 77% | 0.771 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 134.8 | 166.2 | -81.4 | -174.6 | -11.6 | 0 | 0 | 109.5 | T5 | T5-Q7 PolarHBondContact O-N 3.03Å; T5-Q7 VanDerWaalsContact O-N 3.15Å |
| 8 | P | 66 | Low | 62.7 | Low | 111 Ų | 111 | 116.1 Ų | 116.1 | 72% | 0.721 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 145.3 | 174.3 | 24.4 | -27.1 | 0 | 0 | 0 | 110.1 | A10 | P8-A10 PolarHBondContact O-N 3.26Š|
| 9 | P | 60.5 | Low | 63.9 | Low | 124 Ų | 124 | 112.7 Ų | 112.7 | 81% | 0.805 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 123.7 | -178.8 | 24.9 | -32.5 | 0 | 0 | 0 | 109.7 | H11 | P9-H11 PolarHBondContact O-N 3.42Š|
| 10 | A | 62.6 | Low | 65.2 | Low | 81 Ų | 81 | 115.8 Ų | 115.8 | 67% | 0.669 | 67% | 0.669 | S | S | * | * | trans | -55.5 | 114.8 | 175 | 0 | 0 | 0 | 0 | 0 | 109.6 | P8 K12 | P8-A10 PolarHBondContact O-N 3.26Å; A10-K12 PolarHBondContact O-N 3.46Å | ||
| 11 | H | 57.5 | Low | 66.5 | Low | 144 Ų | 144 | 115.3 Ų | 115.3 | 67% | 0.667 | 67% | 0.667 | S | S | * | * | trans | -68.1 | 90 | -179.8 | -175.7 | 65.8 | 0 | 0 | 0 | 109.8 | P9 D13 | P9-H11 PolarHBondContact O-N 3.42Å; H11-D13 VanDerWaalsContact C-N 3.3Å; H11-D13 IonicContact CE1-OD2 3.64Å; H11-D13 IonicContact ND1-OD2 3.57Å | ||
| 12 | K | 61.8 | Low | 69 | Low | 158 Ų | 158 | 108.6 Ų | 108.6 | 69% | 0.687 | 64% | 0.636 | S | S | * | * | trans | -78.5 | -14.3 | 179 | -64.7 | -167.7 | -179.3 | -177.8 | 0 | 113 | A10 G14 A15 V16 | A10-K12 PolarHBondContact O-N 3.46Å; K12-G14 VanDerWaalsContact C-N 3.34Å; K12-G14 PolarHBondContact O-N 2.87Å; K12-A15 PolarHBondContact O-N 2.95Å; K12-V16 PolarHBondContact O-N 3.37Å | ||
| 13 | D | 65.3 | Low | 70.7 | Confident | 114 Ų | 114 | 105.9 Ų | 105.9 | 61% | 0.61 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -66.3 | -37.2 | -174.9 | -53.4 | -39.8 | 0 | 0 | 0 | 112.1 | H11 A15 V16 A17 | H11-D13 VanDerWaalsContact C-N 3.3Å; H11-D13 IonicContact CE1-OD2 3.64Å; H11-D13 IonicContact ND1-OD2 3.57Å; D13-A15 PolarHBondContact O-N 3.05Å; D13-V16 PolarHBondContact O-N 3.42Å; D13-A17 PolarHBondContact O-N 3.32Å |
| 14 | G | 66.1 | Low | 72.9 | Confident | 28 Ų | 28 | 102.9 Ų | 102.9 | 29% | 0.289 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -64.7 | -37.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | K12 V16 A17 V18 | K12-G14 VanDerWaalsContact C-N 3.34Å; K12-G14 PolarHBondContact O-N 2.87Å; G14-V16 VanDerWaalsContact C-N 3.32Å; G14-V16 PolarHBondContact O-N 3Å; G14-A17 PolarHBondContact O-N 3.23Å; G14-V18 WeakPolarHBondContact O-CB 3.25Å; G14-V18 WeakPolarHBondContact O-CG2 3.44Å; G14-V18 PolarHBondContact O-N 3.45Å |
| 15 | A | 70.3 | Confident | 74.9 | Confident | 71 Ų | 71 | 103.7 Ų | 103.7 | 59% | 0.587 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -68 | -34.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | K12 D13 S19 | K12-A15 PolarHBondContact O-N 2.95Å; D13-A15 PolarHBondContact O-N 3.05Å; A15-S19 PolarHBondContact O-N 3.02Å |
| 16 | V | 77.2 | Confident | 76.6 | Confident | 76 Ų | 76 | 102.1 Ų | 102.1 | 46% | 0.461 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -71 | -43 | 175.4 | 175.4 | 0 | 0 | 0 | 0 | 110.6 | K12 D13 G14 V18 S19 Y20 | K12-V16 PolarHBondContact O-N 3.37Å; D13-V16 PolarHBondContact O-N 3.42Å; G14-V16 VanDerWaalsContact C-N 3.32Å; G14-V16 PolarHBondContact O-N 3Å; V16-V18 PolarHBondContact O-N 3.38Å; V16-S19 PolarHBondContact O-N 2.85Å; V16-S19 PolarHBondContact O-OG 3.38Å; V16-Y20 HydrophobicContact CG1-CD2 3.89Å; V16-Y20 HydrophobicContact CG1-CE2 3.41Å; V16-Y20 VanDerWaalsContact CG1-CE2 3.41Å; V16-Y20 WeakPolarHBondContact O-CD2 3.2Å; V16-Y20 PolarHBondContact O-N 3.13Å |
| 17 | A | 78.5 | Confident | 78.4 | Confident | 57 Ų | 57 | 101.5 Ų | 101.5 | 47% | 0.471 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -63.6 | -40.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | D13 G14 S19 Y20 V21 | D13-A17 PolarHBondContact O-N 3.32Å; G14-A17 PolarHBondContact O-N 3.23Å; A17-S19 VanDerWaalsContact C-N 3.34Å; A17-S19 PolarHBondContact O-N 3.43Å; A17-Y20 PolarHBondContact O-N 3.03Å; A17-V21 PolarHBondContact O-N 2.89Å |
| 18 | V | 84.2 | Confident | 80 | Confident | 93 Ų | 93 | 99.5 Ų | 99.5 | 56% | 0.564 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -64.8 | -37.9 | 178 | 171.9 | 0 | 0 | 0 | 0 | 111.3 | G14 V16 V21 L22 | G14-V18 WeakPolarHBondContact O-CB 3.25Å; G14-V18 WeakPolarHBondContact O-CG2 3.44Å; G14-V18 PolarHBondContact O-N 3.45Å; V16-V18 PolarHBondContact O-N 3.38Å; V18-V21 PolarHBondContact O-N 2.92Å; V18-L22 VanDerWaalsContact O-CB 3.26Å; V18-L22 WeakPolarHBondContact O-CB 3.15Å; V18-L22 PolarHBondContact O-N 2.78Å |
| 19 | S | 85.2 | Confident | 81.5 | Confident | 53 Ų | 53 | 97 Ų | 97 | 37% | 0.371 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.1 | -37.8 | 178.2 | 71 | 0 | 0 | 0 | 0 | 112.3 | A15 V16 A17 V21 L22 V23 | A15-S19 PolarHBondContact O-N 3.02Å; V16-S19 PolarHBondContact O-N 2.85Å; V16-S19 PolarHBondContact O-OG 3.38Å; A17-S19 VanDerWaalsContact C-N 3.34Å; A17-S19 PolarHBondContact O-N 3.43Å; S19-V21 PolarHBondContact O-N 2.79Å; S19-L22 PolarHBondContact O-N 3.26Å; S19-V23 WeakPolarHBondContact O-CB 3.35Å; S19-V23 WeakPolarHBondContact O-CG2 3.34Å; S19-V23 PolarHBondContact O-N 3.08Å |
| 20 | Y | 90.5 | Very high | 83.2 | Confident | 174 Ų | 174 | 95.7 Ų | 95.7 | 68% | 0.682 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63.8 | -25.9 | 176.1 | -78.2 | -63.9 | 0 | 0 | 0 | 114 | V16 A17 P24 | V16-Y20 HydrophobicContact CG1-CD2 3.89Å; V16-Y20 HydrophobicContact CG1-CE2 3.41Å; V16-Y20 VanDerWaalsContact CG1-CE2 3.41Å; V16-Y20 WeakPolarHBondContact O-CD2 3.2Å; V16-Y20 PolarHBondContact O-N 3.13Å; A17-Y20 PolarHBondContact O-N 3.03Å; Y20-P24 WeakPolarHBondContact O-CD 3.27Å; Y20-P24 WeakPolarHBondContact O-CG 3.18Å |
| 21 | V | 92.1 | Very high | 84.9 | Confident | 105 Ų | 105 | 94.3 Ų | 94.3 | 64% | 0.636 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -89.2 | -38.5 | 175 | 180 | 0 | 0 | 0 | 0 | 111.2 | A17 V18 S19 P24 F25 | A17-V21 PolarHBondContact O-N 2.89Å; V18-V21 PolarHBondContact O-N 2.92Å; S19-V21 PolarHBondContact O-N 2.79Å; V21-P24 VanDerWaalsContact O-CD 3.32Å; V21-P24 WeakPolarHBondContact O-CD 3.23Å; V21-P24 WeakPolarHBondContact O-CG 3.38Å; V21-F25 VanDerWaalsContact O-CB 3.31Å; V21-F25 WeakPolarHBondContact O-CB 3.48Å; V21-F25 PolarHBondContact O-N 3.34Å |
| 22 | L | 92.5 | Very high | 86.7 | Confident | 99 Ų | 99 | 89.4 Ų | 89.4 | 52% | 0.518 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -70.4 | -37.7 | -176.3 | -166.6 | 66.2 | 0 | 0 | 0 | 112.4 | V18 S19 F25 L26 | V18-L22 VanDerWaalsContact O-CB 3.26Å; V18-L22 WeakPolarHBondContact O-CB 3.15Å; V18-L22 PolarHBondContact O-N 2.78Å; S19-L22 PolarHBondContact O-N 3.26Å; L22-F25 PolarHBondContact O-N 3.48Å; L22-L26 WeakPolarHBondContact O-CB 3.45Å; L22-L26 PolarHBondContact O-N 2.81Å |
| 23 | V | 92.1 | Very high | 88.3 | Confident | 86 Ų | 86 | 86.3 Ų | 86.3 | 52% | 0.521 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.8 | -56.3 | 178.3 | 170.2 | 0 | 0 | 0 | 0 | 112.4 | S19 F25 L26 L27 | S19-V23 WeakPolarHBondContact O-CB 3.35Å; S19-V23 WeakPolarHBondContact O-CG2 3.34Å; S19-V23 PolarHBondContact O-N 3.08Å; V23-F25 VanDerWaalsContact C-N 3.33Å; V23-F25 PolarHBondContact O-N 3.4Å; V23-L26 PolarHBondContact O-N 3.17Å; V23-L27 HydrophobicContact CG1-CD1 4.2Å; V23-L27 VanDerWaalsContact O-CG 3.32Å; V23-L27 WeakPolarHBondContact O-CG 3.48Å; V23-L27 PolarHBondContact O-N 2.96Å |
| 24 | P | 95.1 | Very high | 89.8 | Confident | 57 Ų | 57 | 83 Ų | 83 | 37% | 0.37 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.1 | -35.5 | 178.6 | 25.8 | -34.2 | 0 | 0 | 0 | 112.1 | Y20 V21 L26 L27 I28 | Y20-P24 WeakPolarHBondContact O-CD 3.27Å; Y20-P24 WeakPolarHBondContact O-CG 3.18Å; V21-P24 VanDerWaalsContact O-CD 3.32Å; V21-P24 WeakPolarHBondContact O-CD 3.23Å; V21-P24 WeakPolarHBondContact O-CG 3.38Å; P24-L26 VanDerWaalsContact C-N 3.34Å; P24-L26 PolarHBondContact O-N 3.42Å; P24-L27 PolarHBondContact O-N 2.78Å; P24-I28 WeakPolarHBondContact O-CB 3.3Å; P24-I28 WeakPolarHBondContact O-CD1 3.49Å; P24-I28 VanDerWaalsContact O-CG1 3.22Å; P24-I28 WeakPolarHBondContact O-CG1 3.4Å; P24-I28 PolarHBondContact O-N 3.44Å |
| 25 | F | 95.6 | Very high | 91.2 | Very high | 133 Ų | 133 | 85.2 Ų | 85.2 | 58% | 0.583 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.6 | -44.7 | 175.7 | 179.5 | -98.1 | 0 | 0 | 0 | 111.8 | V21 L22 V23 I28 T29 | V21-F25 VanDerWaalsContact O-CB 3.31Å; V21-F25 WeakPolarHBondContact O-CB 3.48Å; V21-F25 PolarHBondContact O-N 3.34Å; L22-F25 PolarHBondContact O-N 3.48Å; V23-F25 VanDerWaalsContact C-N 3.33Å; V23-F25 PolarHBondContact O-N 3.4Å; F25-I28 PolarHBondContact O-N 3.32Å; F25-T29 WeakPolarHBondContact O-CB 3.45Å; F25-T29 PolarHBondContact O-N 3.39Å; F25-T29 PolarHBondContact O-OG1 3Å |
| 26 | L | 94.9 | Very high | 92.4 | Very high | 92 Ų | 92 | 84.5 Ų | 84.5 | 48% | 0.482 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -69.3 | -38.3 | 179.1 | -170.8 | 140 | 0 | 0 | 0 | 111.2 | L22 V23 P24 T29 I30 | L22-L26 WeakPolarHBondContact O-CB 3.45Å; L22-L26 PolarHBondContact O-N 2.81Å; V23-L26 PolarHBondContact O-N 3.17Å; P24-L26 VanDerWaalsContact C-N 3.34Å; P24-L26 PolarHBondContact O-N 3.42Å; L26-T29 PolarHBondContact O-N 2.81Å; L26-I30 HydrophobicContact CD2-CD1 3.44Å; L26-I30 VanDerWaalsContact CD2-CD1 3.44Å; L26-I30 HydrophobicContact CD2-CG1 4.28Å; L26-I30 HydrophobicContact CG-CD1 4.26Å; L26-I30 WeakPolarHBondContact O-CB 3.2Å; L26-I30 VanDerWaalsContact O-CG1 3.29Å; L26-I30 WeakPolarHBondContact O-CG1 3.33Å; L26-I30 PolarHBondContact O-N 3.08Å |
| 27 | L | 96.4 | Very high | 93.1 | Very high | 110 Ų | 110 | 85.8 Ų | 85.8 | 58% | 0.576 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.4 | -48 | 172.5 | -72.6 | 174.7 | 0 | 0 | 0 | 112.2 | V23 P24 T29 I30 A31 | V23-L27 HydrophobicContact CG1-CD1 4.2Å; V23-L27 VanDerWaalsContact O-CG 3.32Å; V23-L27 WeakPolarHBondContact O-CG 3.48Å; V23-L27 PolarHBondContact O-N 2.96Å; P24-L27 PolarHBondContact O-N 2.78Å; L27-T29 VanDerWaalsContact C-N 3.29Å; L27-T29 PolarHBondContact O-N 2.94Å; L27-I30 PolarHBondContact O-N 2.86Å; L27-A31 VanDerWaalsContact O-CB 3.3Å; L27-A31 WeakPolarHBondContact O-CB 3.36Å; L27-A31 PolarHBondContact O-N 2.93Å |
| 28 | I | 96.4 | Very high | 93.8 | Very high | 124 Ų | 124 | 87.7 Ų | 87.7 | 64% | 0.636 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.5 | -40.6 | 177.2 | -66.5 | 164.3 | 0 | 0 | 0 | 110.2 | P24 F25 A31 G32 | P24-I28 WeakPolarHBondContact O-CB 3.3Å; P24-I28 WeakPolarHBondContact O-CD1 3.49Å; P24-I28 VanDerWaalsContact O-CG1 3.22Å; P24-I28 WeakPolarHBondContact O-CG1 3.4Å; P24-I28 PolarHBondContact O-N 3.44Å; F25-I28 PolarHBondContact O-N 3.32Å; I28-A31 PolarHBondContact O-N 3.38Å; I28-G32 PolarHBondContact O-N 3.45Å |
| 29 | T | 96.6 | Very high | 94.1 | Very high | 57 Ų | 57 | 87.2 Ų | 87.2 | 35% | 0.35 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.3 | -47.9 | 178.1 | -57.4 | 0 | 0 | 0 | 0 | 111.3 | F25 L26 L27 G32 I33 | F25-T29 WeakPolarHBondContact O-CB 3.45Å; F25-T29 PolarHBondContact O-N 3.39Å; F25-T29 PolarHBondContact O-OG1 3Å; L26-T29 PolarHBondContact O-N 2.81Å; L27-T29 VanDerWaalsContact C-N 3.29Å; L27-T29 PolarHBondContact O-N 2.94Å; T29-G32 PolarHBondContact O-N 3.32Å; T29-I33 HydrophobicContact CG2-CD1 3.91Å; T29-I33 VanDerWaalsContact O-CG1 3.28Å; T29-I33 WeakPolarHBondContact O-CG1 3.42Å; T29-I33 PolarHBondContact O-N 2.86Å |
| 30 | I | 96.9 | Very high | 94.1 | Very high | 97 Ų | 97 | 88.3 Ų | 88.3 | 50% | 0.497 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.6 | -43.4 | 177.2 | -68.6 | 174.2 | 0 | 0 | 0 | 110.5 | L26 L27 G32 I33 A34 | L26-I30 HydrophobicContact CD2-CD1 3.44Å; L26-I30 VanDerWaalsContact CD2-CD1 3.44Å; L26-I30 HydrophobicContact CD2-CG1 4.28Å; L26-I30 HydrophobicContact CG-CD1 4.26Å; L26-I30 WeakPolarHBondContact O-CB 3.2Å; L26-I30 VanDerWaalsContact O-CG1 3.29Å; L26-I30 WeakPolarHBondContact O-CG1 3.33Å; L26-I30 PolarHBondContact O-N 3.08Å; L27-I30 PolarHBondContact O-N 2.86Å; I30-G32 VanDerWaalsContact C-N 3.32Å; I30-G32 PolarHBondContact O-N 3.05Å; I30-I33 PolarHBondContact O-N 3.01Å; I30-A34 VanDerWaalsContact O-CB 3.28Å; I30-A34 WeakPolarHBondContact O-CB 3.26Å; I30-A34 PolarHBondContact O-N 3.49Å |
| 31 | A | 96.9 | Very high | 93.6 | Very high | 53 Ų | 53 | 85.3 Ų | 85.3 | 44% | 0.438 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.9 | -41 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L27 I28 T35 | L27-A31 VanDerWaalsContact O-CB 3.3Å; L27-A31 WeakPolarHBondContact O-CB 3.36Å; L27-A31 PolarHBondContact O-N 2.93Å; I28-A31 PolarHBondContact O-N 3.38Å; A31-T35 VanDerWaalsContact O-CB 3.29Å; A31-T35 WeakPolarHBondContact O-CB 3.25Å; A31-T35 PolarHBondContact O-N 3.27Å; A31-T35 PolarHBondContact O-OG1 2.64Å |
| 32 | G | 96.6 | Very high | 93 | Very high | 41 Ų | 41 | 89.3 Ų | 89.3 | 42% | 0.423 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.4 | -47.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | I28 T29 I30 T35 A36 | I28-G32 PolarHBondContact O-N 3.45Å; T29-G32 PolarHBondContact O-N 3.32Å; I30-G32 VanDerWaalsContact C-N 3.32Å; I30-G32 PolarHBondContact O-N 3.05Å; G32-T35 PolarHBondContact O-N 3.21Å; G32-A36 WeakPolarHBondContact O-CB 3.17Å; G32-A36 PolarHBondContact O-N 3.18Å |
| 33 | I | 95.9 | Very high | 92 | Very high | 93 Ų | 93 | 92.7 Ų | 92.7 | 48% | 0.477 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.5 | -47.2 | 176.3 | -67.4 | 165.4 | 0 | 0 | 0 | 110.6 | T29 I30 T35 A36 L37 | T29-I33 HydrophobicContact CG2-CD1 3.91Å; T29-I33 VanDerWaalsContact O-CG1 3.28Å; T29-I33 WeakPolarHBondContact O-CG1 3.42Å; T29-I33 PolarHBondContact O-N 2.86Å; I30-I33 PolarHBondContact O-N 3.01Å; I33-T35 VanDerWaalsContact C-N 3.34Å; I33-T35 PolarHBondContact O-N 3.43Å; I33-A36 CarbonylContact O-C 3.59Å; I33-A36 PolarHBondContact O-N 2.92Å; I33-L37 HydrophobicContact CG2-CD1 3.95Å; I33-L37 HydrophobicContact CG2-CG 4.2Å; I33-L37 WeakPolarHBondContact O-CB 3.27Å; I33-L37 VanDerWaalsContact O-CG 3.29Å; I33-L37 WeakPolarHBondContact O-CG 3Å; I33-L37 PolarHBondContact O-N 3.13Å |
| 34 | A | 95.8 | Very high | 90.9 | Very high | 43 Ų | 43 | 95.3 Ų | 95.3 | 36% | 0.355 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.1 | -46.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | I30 L37 I38 | I30-A34 VanDerWaalsContact O-CB 3.28Å; I30-A34 WeakPolarHBondContact O-CB 3.26Å; I30-A34 PolarHBondContact O-N 3.49Å; A34-L37 PolarHBondContact O-N 3.12Å; A34-I38 WeakPolarHBondContact O-CD1 3.42Å; A34-I38 VanDerWaalsContact O-CG1 3.25Å; A34-I38 WeakPolarHBondContact O-CG1 3.34Å; A34-I38 PolarHBondContact O-N 3.45Å |
| 35 | T | 96.1 | Very high | 89.4 | Confident | 76 Ų | 76 | 102.3 Ų | 102.3 | 47% | 0.466 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.8 | -43.6 | 176.1 | -56.1 | 0 | 0 | 0 | 0 | 111.2 | A31 G32 I33 L37 I38 I39 | A31-T35 VanDerWaalsContact O-CB 3.29Å; A31-T35 WeakPolarHBondContact O-CB 3.25Å; A31-T35 PolarHBondContact O-N 3.27Å; A31-T35 PolarHBondContact O-OG1 2.64Å; G32-T35 PolarHBondContact O-N 3.21Å; I33-T35 VanDerWaalsContact C-N 3.34Å; I33-T35 PolarHBondContact O-N 3.43Å; T35-L37 PolarHBondContact O-N 3.28Å; T35-I38 PolarHBondContact O-N 3.05Å; T35-I39 HydrophobicContact CG2-CD1 3.74Å; T35-I39 HydrophobicContact CG2-CG1 4.42Å; T35-I39 WeakPolarHBondContact O-CB 3.16Å; T35-I39 VanDerWaalsContact O-CG1 3.26Å; T35-I39 WeakPolarHBondContact O-CG1 3.28Å; T35-I39 PolarHBondContact O-N 3.12Å |
| 36 | A | 94.5 | Very high | 87.9 | Confident | 55 Ų | 55 | 105 Ų | 105 | 46% | 0.455 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.7 | -41.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | G32 I33 I39 C40 | G32-A36 WeakPolarHBondContact O-CB 3.17Å; G32-A36 PolarHBondContact O-N 3.18Å; I33-A36 CarbonylContact O-C 3.59Å; I33-A36 PolarHBondContact O-N 2.92Å; A36-I39 PolarHBondContact O-N 2.96Å; A36-C40 WeakPolarHBondContact O-CA 3.26Å; A36-C40 WeakPolarHBondContact O-CB 3.44Å; A36-C40 PolarHBondContact O-N 3.4Å |
| 37 | L | 93.3 | Very high | 86.1 | Confident | 104 Ų | 104 | 105.1 Ų | 105.1 | 55% | 0.545 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.3 | -45.5 | 175.7 | -71.8 | 176.2 | 0 | 0 | 0 | 111.3 | I33 A34 T35 I39 C40 L41 | I33-L37 HydrophobicContact CG2-CD1 3.95Å; I33-L37 HydrophobicContact CG2-CG 4.2Å; I33-L37 WeakPolarHBondContact O-CB 3.27Å; I33-L37 VanDerWaalsContact O-CG 3.29Å; I33-L37 WeakPolarHBondContact O-CG 3Å; I33-L37 PolarHBondContact O-N 3.13Å; A34-L37 PolarHBondContact O-N 3.12Å; T35-L37 PolarHBondContact O-N 3.28Å; L37-I39 PolarHBondContact O-N 3.04Å; L37-C40 PolarHBondContact O-N 3.15Å; L37-L41 WeakPolarHBondContact O-CB 3.3Å; L37-L41 VanDerWaalsContact O-CG 3.27Å; L37-L41 WeakPolarHBondContact O-CG 3.43Å; L37-L41 PolarHBondContact O-N 3Å |
| 38 | I | 91.9 | Very high | 84.3 | Confident | 96 Ų | 96 | 104 Ų | 104 | 49% | 0.492 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.4 | -48.1 | 175.4 | -67.1 | 163.3 | 0 | 0 | 0 | 110.2 | A34 T35 C40 L41 R42 | A34-I38 WeakPolarHBondContact O-CD1 3.42Å; A34-I38 VanDerWaalsContact O-CG1 3.25Å; A34-I38 WeakPolarHBondContact O-CG1 3.34Å; A34-I38 PolarHBondContact O-N 3.45Å; T35-I38 PolarHBondContact O-N 3.05Å; I38-C40 VanDerWaalsContact C-N 3.34Å; I38-C40 PolarHBondContact O-N 2.83Å; I38-L41 PolarHBondContact O-N 2.89Å; I38-R42 WeakPolarHBondContact O-CB 3.47Å; I38-R42 VanDerWaalsContact O-CG 3.26Å; I38-R42 WeakPolarHBondContact O-CG 3.42Å; I38-R42 PolarHBondContact O-N 3.38Å |
| 39 | I | 91.1 | Very high | 82.4 | Confident | 84 Ų | 84 | 107.2 Ų | 107.2 | 43% | 0.431 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.6 | -39.7 | 177.8 | -68.9 | 169.4 | 0 | 0 | 0 | 110.8 | T35 A36 L37 R42 R43 | T35-I39 HydrophobicContact CG2-CD1 3.74Å; T35-I39 HydrophobicContact CG2-CG1 4.42Å; T35-I39 WeakPolarHBondContact O-CB 3.16Å; T35-I39 VanDerWaalsContact O-CG1 3.26Å; T35-I39 WeakPolarHBondContact O-CG1 3.28Å; T35-I39 PolarHBondContact O-N 3.12Å; A36-I39 PolarHBondContact O-N 2.96Å; L37-I39 PolarHBondContact O-N 3.04Å; I39-R42 PolarHBondContact O-N 3.5Å; I39-R43 HydrophobicContact CG2-CG 4.16Å; I39-R43 VanDerWaalsContact O-CB 3.24Å; I39-R43 WeakPolarHBondContact O-CB 3.5Å; I39-R43 WeakPolarHBondContact O-CG 3.25Å; I39-R43 PolarHBondContact O-N 3.38Å |
| 40 | C | 84.4 | Confident | 80.5 | Confident | 76 Ų | 76 | 108.9 Ų | 108.9 | 51% | 0.514 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.2 | -45.7 | 177.7 | -174.7 | 0 | 0 | 0 | 0 | 110.8 | A36 L37 I38 R43 K44 | A36-C40 WeakPolarHBondContact O-CA 3.26Å; A36-C40 WeakPolarHBondContact O-CB 3.44Å; A36-C40 PolarHBondContact O-N 3.4Å; L37-C40 PolarHBondContact O-N 3.15Å; I38-C40 VanDerWaalsContact C-N 3.34Å; I38-C40 PolarHBondContact O-N 2.83Å; C40-R43 PolarHBondContact O-N 3.27Å; C40-K44 VanDerWaalsContact O-CB 3.28Å; C40-K44 WeakPolarHBondContact O-CB 3.45Å; C40-K44 PolarHBondContact O-N 3.4Å |
| 41 | L | 80.8 | Confident | 78.6 | Confident | 111 Ų | 111 | 112.5 Ų | 112.5 | 58% | 0.581 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65.1 | -41.2 | 176 | -68.4 | 173.7 | 0 | 0 | 0 | 112 | L37 I38 K44 R45 | L37-L41 WeakPolarHBondContact O-CB 3.3Å; L37-L41 VanDerWaalsContact O-CG 3.27Å; L37-L41 WeakPolarHBondContact O-CG 3.43Å; L37-L41 PolarHBondContact O-N 3Å; I38-L41 PolarHBondContact O-N 2.89Å; L41-K44 PolarHBondContact O-N 2.93Å; L41-R45 PolarHBondContact O-N 3.35Å |
| 42 | R | 80 | Confident | 76.3 | Confident | 188 Ų | 188 | 116.7 Ų | 116.7 | 71% | 0.709 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -66.4 | -39.4 | 174.8 | -70 | 180 | 87.8 | 173.5 | 7.3 | 112 | I38 I39 R46 | I38-R42 WeakPolarHBondContact O-CB 3.47Å; I38-R42 VanDerWaalsContact O-CG 3.26Å; I38-R42 WeakPolarHBondContact O-CG 3.42Å; I38-R42 PolarHBondContact O-N 3.38Å; I39-R42 PolarHBondContact O-N 3.5Å; R42-R46 PolarHBondContact O-N 3.41Å |
| 43 | R | 71.3 | Confident | 74.3 | Confident | 171 Ų | 171 | 122.8 Ų | 122.8 | 65% | 0.645 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -69.5 | -38.8 | 175.7 | -80.2 | -177.9 | 108 | 175.7 | 4.3 | 111.6 | I39 C40 R45 R46 I47 | I39-R43 HydrophobicContact CG2-CG 4.16Å; I39-R43 VanDerWaalsContact O-CB 3.24Å; I39-R43 WeakPolarHBondContact O-CB 3.5Å; I39-R43 WeakPolarHBondContact O-CG 3.25Å; I39-R43 PolarHBondContact O-N 3.38Å; C40-R43 PolarHBondContact O-N 3.27Å; R43-R45 VanDerWaalsContact C-N 3.32Å; R43-R45 PolarHBondContact O-N 3.47Å; R43-R46 CarbonylContact O-C 3.56Å; R43-R46 WeakPolarHBondContact O-CA 3.28Å; R43-R46 WeakPolarHBondContact O-CB 3.44Å; R43-R46 PolarHBondContact O-N 2.9Å; R43-I47 WeakPolarHBondContact O-CG1 3.27Å; R43-I47 PolarHBondContact O-N 2.93Å |
| 44 | K | 68.4 | Low | 72.3 | Confident | 141 Ų | 141 | 125.2 Ų | 125.2 | 61% | 0.613 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -56.3 | -46.8 | 176.3 | -163.9 | 175.5 | 179.4 | -177.8 | 0 | 110.6 | C40 L41 R46 I47 D48 | C40-K44 VanDerWaalsContact O-CB 3.28Å; C40-K44 WeakPolarHBondContact O-CB 3.45Å; C40-K44 PolarHBondContact O-N 3.4Å; L41-K44 PolarHBondContact O-N 2.93Å; K44-R46 VanDerWaalsContact C-N 3.27Å; K44-R46 PolarHBondContact O-N 3.22Å; K44-I47 PolarHBondContact O-N 3.26Å; K44-D48 PolarHBondContact O-N 3.44Å |
| 45 | R | 63.8 | Low | 70.4 | Confident | 203 Ų | 203 | 128.3 Ų | 128.3 | 77% | 0.766 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -62.8 | -26.5 | 173.4 | -64.6 | -174.5 | -171.2 | -143.1 | 2.8 | 114.3 | L41 R43 | L41-R45 PolarHBondContact O-N 3.35Å; R43-R45 VanDerWaalsContact C-N 3.32Å; R43-R45 PolarHBondContact O-N 3.47Å |
| 46 | R | 63 | Low | 68.6 | Low | 189 Ų | 189 | 130 Ų | 130 | 71% | 0.713 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -81.6 | -33.4 | 175.3 | -93.5 | -166.7 | 176.8 | -103.1 | 3.5 | 112.8 | R42 R43 K44 D48 R49 L50 | R42-R46 PolarHBondContact O-N 3.41Å; R43-R46 CarbonylContact O-C 3.56Å; R43-R46 WeakPolarHBondContact O-CA 3.28Å; R43-R46 WeakPolarHBondContact O-CB 3.44Å; R43-R46 PolarHBondContact O-N 2.9Å; K44-R46 VanDerWaalsContact C-N 3.27Å; K44-R46 PolarHBondContact O-N 3.22Å; R46-D48 VanDerWaalsContact C-N 3.32Å; R46-R49 WeakPolarHBondContact O-CB 3.28Å; R46-R49 PolarHBondContact O-N 3.14Å; R46-L50 VanDerWaalsContact O-CD1 3.3Å; R46-L50 WeakPolarHBondContact O-CD1 3.26Å; R46-L50 PolarHBondContact O-N 3.21Å; R46-L50 VanDerWaalsContact O-N 3.14Å |
| 47 | I | 58.6 | Low | 67 | Low | 95 Ų | 95 | 133.3 Ų | 133.3 | 49% | 0.487 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -67.8 | -34.9 | 179.5 | -66.1 | 169.9 | 0 | 0 | 0 | 110.9 | R43 K44 R49 L50 R51 | R43-I47 WeakPolarHBondContact O-CG1 3.27Å; R43-I47 PolarHBondContact O-N 2.93Å; K44-I47 PolarHBondContact O-N 3.26Å; I47-R49 VanDerWaalsContact C-N 3.25Å; I47-R49 PolarHBondContact O-N 3.35Å; I47-L50 PolarHBondContact O-N 2.87Å; I47-L50 VanDerWaalsContact O-N 3.09Å; I47-R51 PolarHBondContact O-N 3.23Å |
| 48 | D | 57.9 | Low | 65.2 | Low | 86 Ų | 86 | 138.1 Ų | 138.1 | 46% | 0.46 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -60.4 | -36.7 | 173.1 | -70 | -26 | 0 | 0 | 0 | 112 | K44 R46 R51 H52 | K44-D48 PolarHBondContact O-N 3.44Å; R46-D48 VanDerWaalsContact C-N 3.32Å; D48-R51 PolarHBondContact O-N 3.03Å; D48-H52 PolarHBondContact O-N 2.91Å; D48-H52 PolarHBondContact O-ND1 3.09Å |
| 49 | R | 57.2 | Low | 63.6 | Low | 193 Ų | 193 | 139.2 Ų | 139.2 | 73% | 0.728 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -70 | -32.9 | 174.4 | -68.3 | -77.4 | -172.3 | -176.8 | -1 | 112.9 | R46 I47 Q53 | R46-R49 WeakPolarHBondContact O-CB 3.28Å; R46-R49 PolarHBondContact O-N 3.14Å; I47-R49 VanDerWaalsContact C-N 3.25Å; I47-R49 PolarHBondContact O-N 3.35Å; R49-Q53 PolarHBondContact O-N 3.34Å |
| 50 | L | 55.6 | Low | 61.5 | Low | 92 Ų | 92 | 141.3 Ų | 141.3 | 48% | 0.482 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -73.3 | -35.4 | 173.6 | -88.3 | 102.7 | 0 | 0 | 0 | 112.1 | R46 I47 H52 Q53 L54 | R46-L50 VanDerWaalsContact O-CD1 3.3Å; R46-L50 WeakPolarHBondContact O-CD1 3.26Å; R46-L50 PolarHBondContact O-N 3.21Å; R46-L50 VanDerWaalsContact O-N 3.14Å; I47-L50 PolarHBondContact O-N 2.87Å; I47-L50 VanDerWaalsContact O-N 3.09Å; L50-H52 VanDerWaalsContact C-N 3.26Å; L50-H52 PolarHBondContact O-N 3.13Å; L50-Q53 PolarHBondContact O-N 3.38Å; L50-Q53 VanDerWaalsContact O-N 3.13Å; L50-L54 HydrophobicContact CD2-CD1 4.48Å; L50-L54 WeakPolarHBondContact O-CB 3.4Å; L50-L54 PolarHBondContact O-N 2.85Å |
| 51 | R | 57.2 | Low | 60.2 | Low | 172 Ų | 172 | 142 Ų | 142 | 65% | 0.649 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -61.4 | -34.9 | 173.3 | -77.8 | -175.7 | 153.2 | -166 | -8.2 | 112.2 | I47 D48 L55 | I47-R51 PolarHBondContact O-N 3.23Å; D48-R51 PolarHBondContact O-N 3.03Å; R51-L55 WeakPolarHBondContact O-CB 3.33Å; R51-L55 PolarHBondContact O-N 2.76Å |
| 52 | H | 48.3 | Very low | 58.9 | Low | 141 Ų | 141 | 141.3 Ų | 141.3 | 65% | 0.653 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -79.8 | -11.3 | 175.4 | -72.6 | 59.8 | 0 | 0 | 0 | 114.7 | D48 L50 | D48-H52 PolarHBondContact O-N 2.91Å; D48-H52 PolarHBondContact O-ND1 3.09Å; L50-H52 VanDerWaalsContact C-N 3.26Å; L50-H52 PolarHBondContact O-N 3.13Å |
| 53 | Q | 55.1 | Low | 57.9 | Low | 170 Ų | 170 | 135 Ų | 135 | 79% | 0.794 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -98.3 | -13.5 | 171.5 | -76.4 | -178.2 | 7.2 | 0 | 0 | 112.8 | R49 L50 | R49-Q53 PolarHBondContact O-N 3.34Å; L50-Q53 PolarHBondContact O-N 3.38Å; L50-Q53 VanDerWaalsContact O-N 3.13Å |
| 54 | L | 54.8 | Low | 57.1 | Low | 144 Ų | 144 | 133.2 Ų | 133.2 | 75% | 0.754 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -111.8 | -13.8 | 178.5 | -80.3 | 144.5 | 0 | 0 | 0 | 114 | L50 | L50-L54 HydrophobicContact CD2-CD1 4.48Å; L50-L54 WeakPolarHBondContact O-CB 3.4Å; L50-L54 PolarHBondContact O-N 2.85Å |
| 55 | L | 55.6 | Low | 56.4 | Low | 107 Ų | 107 | 131.6 Ų | 131.6 | 56% | 0.56 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -100.1 | 117.2 | 155.4 | -96.1 | 124.1 | 0 | 0 | 0 | 107.6 | R51 V57 | R51-L55 WeakPolarHBondContact O-CB 3.33Å; R51-L55 PolarHBondContact O-N 2.76Å; L55-V57 PolarHBondContact O-N 3.37Å; L55-V57 VanDerWaalsContact O-N 3.15Å |
| 56 | P | 58.1 | Low | 56 | Low | 112 Ų | 112 | 127.5 Ų | 127.5 | 73% | 0.727 | 62% | 0.624 | S | S | * | * | trans | -59.8 | 121.6 | 172 | 26.4 | -31.2 | 0 | 0 | 0 | 107.9 | Y58 | P56-Y58 PolarHBondContact O-N 2.89Š| ||
| 57 | V | 59.6 | Low | 55.7 | Low | 124 Ų | 124 | 124 Ų | 124 | 75% | 0.752 | 62% | 0.616 | S | S | * | * | trans | 14.2 | 79.9 | 162.5 | -171.4 | 0 | 0 | 0 | 0 | 114 | L55 T59 | L55-V57 PolarHBondContact O-N 3.37Å; L55-V57 VanDerWaalsContact O-N 3.15Å; V57-T59 WeakPolarHBondContact CG1-OG1 3.24Å | ||
| 58 | Y | 56 | Low | 55.6 | Low | 206 Ų | 206 | 125.5 Ų | 125.5 | 81% | 0.808 | 62% | 0.621 | S | S | * | * | trans | -85.3 | 102.7 | 144.5 | -100.4 | -89.6 | 0 | 0 | 0 | 105.2 | P56 Y60 | P56-Y58 PolarHBondContact O-N 2.89Å; Y58-Y60 VanDerWaalsContact C-N 3.35Å; Y58-Y60 PolarHBondContact O-N 2.74Å | ||
| 59 | T | 58.2 | Low | 55.7 | Low | 119 Ų | 119 | 125.4 Ų | 125.4 | 73% | 0.73 | 62% | 0.623 | S | S | * | * | trans | -62.9 | 98.1 | 173.7 | -35.7 | 0 | 0 | 0 | 0 | 107.1 | V57 D61 | V57-T59 WeakPolarHBondContact CG1-OG1 3.24Å; T59-D61 PolarHBondContact O-N 2.93Å; T59-D61 VanDerWaalsContact O-N 3.12Å | ||
| 60 | Y | 47.4 | Very low | 55.8 | Low | 127 Ų | 127 | 121.4 Ų | 121.4 | 50% | 0.498 | 61% | 0.612 | S | S | . | * | trans | -61.7 | 111.7 | 168.2 | 171.2 | -85.6 | 0 | 0 | 0 | 107.5 | Y58 P62 E65 | Y58-Y60 VanDerWaalsContact C-N 3.35Å; Y58-Y60 PolarHBondContact O-N 2.74Å; Y60-P62 HydrophobicContact CE1-CB 4.33Å; Y60-E65 HydrophobicContact CE2-CG 3.78Å; Y60-E65 WeakPolarHBondContact CE2-OE1 3.48Å; Y60-E65 WeakPolarHBondContact OH-CG 3.43Å; Y60-E65 PolarHBondContact OH-OE1 3.37Å; Y60-E65 PolarHBondContact OH-OE2 3.4Å | ||
| 61 | D | 57.2 | Low | 55.9 | Low | 91 Ų | 91 | 121 Ų | 121 | 49% | 0.487 | 61% | 0.608 | S | S | . | * | trans | -87.9 | 118 | 171.9 | -172.7 | -5.2 | 0 | 0 | 0 | 107.3 | T59 A63 E64 | T59-D61 PolarHBondContact O-N 2.93Å; T59-D61 VanDerWaalsContact O-N 3.12Å; D61-A63 PolarHBondContact O-N 3.2Å; D61-A63 PolarHBondContact OD1-N 2.8Å; D61-E64 PolarHBondContact O-N 2.87Å | ||
| 62 | P | 54.1 | Low | 56 | Low | 96 Ų | 96 | 119.8 Ų | 119.8 | 62% | 0.623 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -59.8 | -3.3 | 178.4 | 24.7 | -34.5 | 0 | 0 | 0 | 114.2 | Y60 | Y60-P62 HydrophobicContact CE1-CB 4.33Å |
| 63 | A | 58 | Low | 56.6 | Low | 57 Ų | 57 | 118.3 Ų | 118.3 | 47% | 0.471 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -72.5 | -26 | 166.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | D61 H67 | D61-A63 PolarHBondContact O-N 3.2Å; D61-A63 PolarHBondContact OD1-N 2.8Å; A63-H67 PolarHBondContact O-N 3.5Å |
| 64 | E | 55.3 | Low | 56.9 | Low | 132 Ų | 132 | 115 Ų | 115 | 62% | 0.617 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -76.6 | -39.2 | -175.5 | -68.9 | -158.2 | 151.2 | 0 | 0 | 113.1 | D61 L66 H67 E68 | D61-E64 PolarHBondContact O-N 2.87Å; E64-L66 VanDerWaalsContact C-N 3.34Å; E64-L66 PolarHBondContact O-N 3.42Å; E64-H67 PolarHBondContact O-N 3.25Å; E64-E68 PolarHBondContact O-N 2.73Å |
| 65 | E | 53.3 | Low | 57.1 | Low | 107 Ų | 107 | 114.8 Ų | 114.8 | 50% | 0.5 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -69.4 | -29.3 | 176.8 | -87.7 | -172.4 | -167.9 | 0 | 0 | 113.1 | Y60 H67 V69 | Y60-E65 HydrophobicContact CE2-CG 3.78Å; Y60-E65 WeakPolarHBondContact CE2-OE1 3.48Å; Y60-E65 WeakPolarHBondContact OH-CG 3.43Å; Y60-E65 PolarHBondContact OH-OE1 3.37Å; Y60-E65 PolarHBondContact OH-OE2 3.4Å; E65-H67 VanDerWaalsContact C-N 3.32Å; E65-V69 VanDerWaalsContact O-CG2 3.25Å; E65-V69 WeakPolarHBondContact O-CG2 3.29Å; E65-V69 PolarHBondContact O-N 2.75Å; E65-V69 VanDerWaalsContact O-N 3.13Å |
| 66 | L | 55.9 | Low | 57.3 | Low | 117 Ų | 117 | 118.5 Ų | 118.5 | 61% | 0.613 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -66.6 | -39.5 | 174.6 | -161.8 | 86.8 | 0 | 0 | 0 | 110.7 | E64 V69 E70 | E64-L66 VanDerWaalsContact C-N 3.34Å; E64-L66 PolarHBondContact O-N 3.42Å; L66-V69 PolarHBondContact O-N 2.89Å; L66-E70 PolarHBondContact O-N 3.33Å |
| 67 | H | 55.3 | Low | 57.5 | Low | 117 Ų | 117 | 119.3 Ų | 119.3 | 54% | 0.542 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -68.9 | -41.1 | 178.9 | -157.9 | 61.8 | 0 | 0 | 0 | 111.4 | A63 E64 E65 V69 E70 Q71 | A63-H67 PolarHBondContact O-N 3.5Å; E64-H67 PolarHBondContact O-N 3.25Å; E65-H67 VanDerWaalsContact C-N 3.32Å; H67-V69 VanDerWaalsContact C-N 3.35Å; H67-V69 PolarHBondContact O-N 3.47Å; H67-E70 PolarHBondContact O-N 3.33Å; H67-Q71 WeakPolarHBondContact O-CB 3.29Å; H67-Q71 PolarHBondContact O-N 2.78Å |
| 68 | E | 57.7 | Low | 57.7 | Low | 125 Ų | 125 | 116.9 Ų | 116.9 | 58% | 0.584 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -63.6 | -37.5 | 176.2 | -70.3 | -174.8 | 176 | 0 | 0 | 112.6 | E64 Q71 E72 | E64-E68 PolarHBondContact O-N 2.73Å; E68-Q71 PolarHBondContact O-N 3.42Å; E68-E72 WeakPolarHBondContact O-CB 3.44Å; E68-E72 PolarHBondContact O-N 2.9Å |
| 69 | V | 58.7 | Low | 58 | Low | 84 Ų | 84 | 111.6 Ų | 111.6 | 51% | 0.509 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -72.6 | -40.8 | 177.8 | 174.8 | 0 | 0 | 0 | 0 | 112.1 | E65 L66 H67 Q71 L73 | E65-V69 VanDerWaalsContact O-CG2 3.25Å; E65-V69 WeakPolarHBondContact O-CG2 3.29Å; E65-V69 PolarHBondContact O-N 2.75Å; E65-V69 VanDerWaalsContact O-N 3.13Å; L66-V69 PolarHBondContact O-N 2.89Å; H67-V69 VanDerWaalsContact C-N 3.35Å; H67-V69 PolarHBondContact O-N 3.47Å; V69-Q71 VanDerWaalsContact C-N 3.31Å; V69-L73 HydrophobicContact CG1-CD1 4.27Å; V69-L73 WeakPolarHBondContact O-CB 3.06Å; V69-L73 VanDerWaalsContact O-CG 3.25Å; V69-L73 WeakPolarHBondContact O-CG 3.48Å; V69-L73 PolarHBondContact O-N 3.45Å |
| 70 | E | 59.8 | Low | 58.4 | Low | 109 Ų | 109 | 109.7 Ų | 109.7 | 51% | 0.509 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.6 | -40.4 | 172.2 | -76.9 | -173.9 | 161.3 | 0 | 0 | 111 | L66 H67 L73 L74 | L66-E70 PolarHBondContact O-N 3.33Å; H67-E70 PolarHBondContact O-N 3.33Å; E70-L73 PolarHBondContact O-N 2.8Å; E70-L74 VanDerWaalsContact O-CG 3.27Å; E70-L74 WeakPolarHBondContact O-CG 3.49Å; E70-L74 PolarHBondContact O-N 3.32Å |
| 71 | Q | 58.9 | Low | 59.2 | Low | 83 Ų | 83 | 112.6 Ų | 112.6 | 39% | 0.388 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -70.5 | -41.3 | -179.9 | -146.5 | -176.9 | -8.8 | 0 | 0 | 111.8 | H67 E68 V69 L73 L74 W75 | H67-Q71 WeakPolarHBondContact O-CB 3.29Å; H67-Q71 PolarHBondContact O-N 2.78Å; E68-Q71 PolarHBondContact O-N 3.42Å; V69-Q71 VanDerWaalsContact C-N 3.31Å; Q71-L73 VanDerWaalsContact C-N 3.31Å; Q71-L73 PolarHBondContact O-N 3.38Å; Q71-L74 PolarHBondContact O-N 2.81Å; Q71-W75 PolarHBondContact O-N 3.28Å |
| 72 | E | 57.7 | Low | 59.8 | Low | 148 Ų | 148 | 112.2 Ų | 112.2 | 69% | 0.692 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.5 | -35.5 | 172.2 | -88.6 | -166.3 | 157.8 | 0 | 0 | 112.6 | E68 R76 | E68-E72 WeakPolarHBondContact O-CB 3.44Å; E68-E72 PolarHBondContact O-N 2.9Å; E72-R76 VanDerWaalsContact O-CB 3.26Å; E72-R76 WeakPolarHBondContact O-CB 3.3Å; E72-R76 PolarHBondContact O-N 3.41Å |
| 73 | L | 62.7 | Low | 60.5 | Low | 109 Ų | 109 | 112.1 Ų | 112.1 | 57% | 0.571 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -66.3 | -42.2 | 173.3 | -74.9 | 169.7 | 0 | 0 | 0 | 111.6 | V69 E70 Q71 R76 E77 | V69-L73 HydrophobicContact CG1-CD1 4.27Å; V69-L73 WeakPolarHBondContact O-CB 3.06Å; V69-L73 VanDerWaalsContact O-CG 3.25Å; V69-L73 WeakPolarHBondContact O-CG 3.48Å; V69-L73 PolarHBondContact O-N 3.45Å; E70-L73 PolarHBondContact O-N 2.8Å; Q71-L73 VanDerWaalsContact C-N 3.31Å; Q71-L73 PolarHBondContact O-N 3.38Å; L73-R76 PolarHBondContact O-N 3.44Å; L73-E77 PolarHBondContact O-N 2.88Å |
| 74 | L | 59.6 | Low | 61.1 | Low | 102 Ų | 102 | 115.6 Ų | 115.6 | 53% | 0.534 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -64.6 | -46.5 | 176 | -71.3 | 169.7 | 0 | 0 | 0 | 111.9 | E70 Q71 R76 E77 E78 | E70-L74 VanDerWaalsContact O-CG 3.27Å; E70-L74 WeakPolarHBondContact O-CG 3.49Å; E70-L74 PolarHBondContact O-N 3.32Å; Q71-L74 PolarHBondContact O-N 2.81Å; L74-R76 VanDerWaalsContact C-N 3.3Å; L74-R76 PolarHBondContact O-N 3.33Å; L74-E77 PolarHBondContact O-N 2.97Å; L74-E77 VanDerWaalsContact O-N 3.13Å; L74-E78 WeakPolarHBondContact O-CG 3.2Å; L74-E78 PolarHBondContact O-N 2.89Å |
| 75 | W | 59.4 | Low | 61.8 | Low | 138 Ų | 138 | 111.3 Ų | 111.3 | 52% | 0.523 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.5 | -39.1 | 175.1 | -70.7 | 119.8 | 0 | 0 | 0 | 112.4 | Q71 E78 D79 | Q71-W75 PolarHBondContact O-N 3.28Å; W75-E78 WeakPolarHBondContact CA-OE1 3.32Å; W75-E78 VanDerWaalsContact CD2-OE1 3.24Å; W75-E78 HydrophobicContact CE3-CG 4.01Å; W75-E78 PolarHBondContact N-OE1 3.45Å; W75-E78 VanDerWaalsContact O-CG 3.3Å; W75-E78 WeakPolarHBondContact O-CG 3.41Å; W75-D79 VanDerWaalsContact O-CB 3.28Å; W75-D79 WeakPolarHBondContact O-CB 3.2Å; W75-D79 PolarHBondContact O-N 2.86Å |
| 76 | R | 60 | Low | 62.7 | Low | 186 Ų | 186 | 113.5 Ų | 113.5 | 70% | 0.702 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -69.1 | -36.5 | 176.4 | -171 | 169.2 | 179.8 | -171.6 | -1.4 | 112.2 | E72 L73 L74 T80 | E72-R76 VanDerWaalsContact O-CB 3.26Å; E72-R76 WeakPolarHBondContact O-CB 3.3Å; E72-R76 PolarHBondContact O-N 3.41Å; L73-R76 PolarHBondContact O-N 3.44Å; L74-R76 VanDerWaalsContact C-N 3.3Å; L74-R76 PolarHBondContact O-N 3.33Å; R76-T80 WeakPolarHBondContact O-CG2 3.28Å; R76-T80 PolarHBondContact O-N 3.44Å; R76-T80 PolarHBondContact O-OG1 2.85Å |
| 77 | E | 62.3 | Low | 63.2 | Low | 128 Ų | 128 | 110.5 Ų | 110.5 | 60% | 0.598 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -71.1 | -43.2 | 177.9 | -155.4 | 169.6 | -162.1 | 0 | 0 | 111.2 | L73 L74 T80 R81 | L73-E77 PolarHBondContact O-N 2.88Å; L74-E77 PolarHBondContact O-N 2.97Å; L74-E77 VanDerWaalsContact O-N 3.13Å; E77-T80 PolarHBondContact O-N 2.86Å; E77-T80 PolarHBondContact O-OG1 3.37Å; E77-R81 WeakPolarHBondContact O-CG 3.29Å; E77-R81 PolarHBondContact O-N 3.32Å; E77-R81 VanDerWaalsContact O-N 3.08Å |
| 78 | E | 63.1 | Low | 63.6 | Low | 73 Ų | 73 | 113.7 Ų | 113.7 | 34% | 0.341 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67.6 | -39.7 | 174.2 | 64 | -159.8 | 131.3 | 0 | 0 | 113 | L74 W75 T80 R81 I82 | L74-E78 WeakPolarHBondContact O-CG 3.2Å; L74-E78 PolarHBondContact O-N 2.89Å; W75-E78 WeakPolarHBondContact CA-OE1 3.32Å; W75-E78 VanDerWaalsContact CD2-OE1 3.24Å; W75-E78 HydrophobicContact CE3-CG 4.01Å; W75-E78 PolarHBondContact N-OE1 3.45Å; W75-E78 VanDerWaalsContact O-CG 3.3Å; W75-E78 WeakPolarHBondContact O-CG 3.41Å; E78-T80 VanDerWaalsContact C-N 3.34Å; E78-T80 PolarHBondContact O-N 3.46Å; E78-R81 PolarHBondContact O-N 3.24Å; E78-I82 WeakPolarHBondContact O-CB 3.22Å; E78-I82 WeakPolarHBondContact O-CD1 3.17Å; E78-I82 WeakPolarHBondContact O-CG1 3.34Å; E78-I82 PolarHBondContact O-N 2.97Å |
| 79 | D | 63.1 | Low | 64 | Low | 95 Ų | 95 | 110 Ų | 110 | 51% | 0.508 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.2 | -41.6 | 172.9 | -91.3 | -19.1 | 0 | 0 | 0 | 111.7 | W75 R81 I82 V83 | W75-D79 VanDerWaalsContact O-CB 3.28Å; W75-D79 WeakPolarHBondContact O-CB 3.2Å; W75-D79 PolarHBondContact O-N 2.86Å; D79-R81 VanDerWaalsContact C-N 3.3Å; D79-R81 PolarHBondContact O-N 3.28Å; D79-I82 PolarHBondContact O-N 3.31Å; D79-V83 VanDerWaalsContact O-CB 3.27Å; D79-V83 WeakPolarHBondContact O-CB 3.49Å; D79-V83 WeakPolarHBondContact O-CG2 3.22Å; D79-V83 PolarHBondContact O-N 2.86Å |
| 80 | T | 66 | Low | 64.2 | Low | 79 Ų | 79 | 112.8 Ų | 112.8 | 49% | 0.485 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.4 | -34.4 | 176.7 | 60.6 | 0 | 0 | 0 | 0 | 112.6 | R76 E77 E78 Q84 | R76-T80 WeakPolarHBondContact O-CG2 3.28Å; R76-T80 PolarHBondContact O-N 3.44Å; R76-T80 PolarHBondContact O-OG1 2.85Å; E77-T80 PolarHBondContact O-N 2.86Å; E77-T80 PolarHBondContact O-OG1 3.37Å; E78-T80 VanDerWaalsContact C-N 3.34Å; E78-T80 PolarHBondContact O-N 3.46Å; T80-Q84 WeakPolarHBondContact O-CB 3.33Å; T80-Q84 PolarHBondContact O-N 3.34Å |
| 81 | R | 64.7 | Low | 64.2 | Low | 188 Ų | 188 | 115 Ų | 115 | 71% | 0.709 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -72.5 | -40 | 174.4 | -69.1 | -173.8 | 76.4 | -162.8 | 2.3 | 112.3 | E77 E78 D79 Q84 G85 | E77-R81 WeakPolarHBondContact O-CG 3.29Å; E77-R81 PolarHBondContact O-N 3.32Å; E77-R81 VanDerWaalsContact O-N 3.08Å; E78-R81 PolarHBondContact O-N 3.24Å; D79-R81 VanDerWaalsContact C-N 3.3Å; D79-R81 PolarHBondContact O-N 3.28Å; R81-Q84 PolarHBondContact O-N 3.25Å; R81-G85 PolarHBondContact O-N 3.38Å |
| 82 | I | 69.3 | Low | 64.1 | Low | 83 Ų | 83 | 118.7 Ų | 118.7 | 43% | 0.426 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63.4 | -51.6 | 175.1 | -69.4 | 164.5 | 0 | 0 | 0 | 108.6 | E78 D79 Q84 G85 W86 | E78-I82 WeakPolarHBondContact O-CB 3.22Å; E78-I82 WeakPolarHBondContact O-CD1 3.17Å; E78-I82 WeakPolarHBondContact O-CG1 3.34Å; E78-I82 PolarHBondContact O-N 2.97Å; D79-I82 PolarHBondContact O-N 3.31Å; I82-Q84 VanDerWaalsContact C-N 3.3Å; I82-Q84 PolarHBondContact O-N 2.92Å; I82-G85 CarbonylContact O-C 3.53Å; I82-G85 WeakPolarHBondContact O-CA 2.96Å; I82-G85 PolarHBondContact O-N 3.02Å; I82-W86 PolarHBondContact O-N 3.48Å |
| 83 | V | 69.8 | Low | 64 | Low | 94 Ų | 94 | 118.8 Ų | 118.8 | 57% | 0.57 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -57.6 | -40.2 | 176.2 | 171.7 | 0 | 0 | 0 | 0 | 111.5 | D79 W86 A87 | D79-V83 VanDerWaalsContact O-CB 3.27Å; D79-V83 WeakPolarHBondContact O-CB 3.49Å; D79-V83 WeakPolarHBondContact O-CG2 3.22Å; D79-V83 PolarHBondContact O-N 2.86Å; V83-W86 PolarHBondContact O-N 3.35Å; V83-A87 VanDerWaalsContact O-CB 3.23Å; V83-A87 WeakPolarHBondContact O-CB 3.31Å; V83-A87 PolarHBondContact O-N 3.43Å |
| 84 | Q | 70.1 | Confident | 63.7 | Low | 131 Ų | 131 | 121.9 Ų | 121.9 | 61% | 0.612 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -63.5 | -40.5 | 171.2 | -96 | -169.9 | -8.6 | 0 | 0 | 113 | T80 R81 I82 A87 R88 | T80-Q84 WeakPolarHBondContact O-CB 3.33Å; T80-Q84 PolarHBondContact O-N 3.34Å; R81-Q84 PolarHBondContact O-N 3.25Å; I82-Q84 VanDerWaalsContact C-N 3.3Å; I82-Q84 PolarHBondContact O-N 2.92Å; Q84-A87 PolarHBondContact O-N 2.7Å; Q84-R88 WeakPolarHBondContact O-CB 3.49Å; Q84-R88 WeakPolarHBondContact O-CG 3.04Å; Q84-R88 PolarHBondContact O-N 3.18Å |
| 85 | G | 69.4 | Low | 63.5 | Low | 41 Ų | 41 | 121.3 Ų | 121.3 | 42% | 0.423 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -63 | -44.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | R81 I82 R88 S89 | R81-G85 PolarHBondContact O-N 3.38Å; I82-G85 CarbonylContact O-C 3.53Å; I82-G85 WeakPolarHBondContact O-CA 2.96Å; I82-G85 PolarHBondContact O-N 3.02Å; G85-R88 PolarHBondContact O-N 3.31Å; G85-S89 PolarHBondContact O-N 3.43Å |
| 86 | W | 73 | Confident | 63.4 | Low | 153 Ų | 153 | 122 Ų | 122 | 58% | 0.58 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -64.7 | -45.8 | 172.7 | -77.5 | 96.5 | 0 | 0 | 0 | 111.6 | I82 V83 R88 S89 Y90 | I82-W86 PolarHBondContact O-N 3.48Å; V83-W86 PolarHBondContact O-N 3.35Å; W86-R88 VanDerWaalsContact C-N 3.28Å; W86-R88 PolarHBondContact O-N 3.47Å; W86-S89 PolarHBondContact O-N 3.46Å; W86-S89 VanDerWaalsContact O-N 3.08Å; W86-S89 PolarHBondContact O-OG 3.37Å; W86-Y90 HydrophobicContact CB-CD2 4.42Å; W86-Y90 HydrophobicContact CB-CE2 4.18Å; W86-Y90 AromaticContact CE3-CE2 3.89Å; W86-Y90 HydrophobicContact CE3-CE2 3.89Å; W86-Y90 WeakPolarHBondContact O-CD2 3.26Å; W86-Y90 PolarHBondContact O-N 3.48Å |
| 87 | A | 67.4 | Low | 63.3 | Low | 55 Ų | 55 | 121.4 Ų | 121.4 | 46% | 0.455 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -59.2 | -39.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | V83 Q84 Q91 | V83-A87 VanDerWaalsContact O-CB 3.23Å; V83-A87 WeakPolarHBondContact O-CB 3.31Å; V83-A87 PolarHBondContact O-N 3.43Å; Q84-A87 PolarHBondContact O-N 2.7Å; A87-Q91 WeakPolarHBondContact O-CB 3.32Å; A87-Q91 PolarHBondContact O-N 3.41Å |
| 88 | R | 63.4 | Low | 63.1 | Low | 183 Ų | 183 | 119.2 Ų | 119.2 | 69% | 0.691 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -66.8 | -38.2 | 173.5 | -78 | -167.3 | 179.7 | -172.4 | 2.4 | 112.7 | Q84 G85 W86 Q91 Q92 | Q84-R88 WeakPolarHBondContact O-CB 3.49Å; Q84-R88 WeakPolarHBondContact O-CG 3.04Å; Q84-R88 PolarHBondContact O-N 3.18Å; G85-R88 PolarHBondContact O-N 3.31Å; W86-R88 VanDerWaalsContact C-N 3.28Å; W86-R88 PolarHBondContact O-N 3.47Å; R88-Q91 PolarHBondContact O-N 3.39Å; R88-Q92 PolarHBondContact O-N 3.29Å |
| 89 | S | 64.6 | Low | 62.5 | Low | 48 Ų | 48 | 124 Ų | 124 | 34% | 0.336 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -69.2 | -38.5 | 177.7 | 72.8 | 0 | 0 | 0 | 0 | 112.3 | G85 W86 Q92 Q93 | G85-S89 PolarHBondContact O-N 3.43Å; W86-S89 PolarHBondContact O-N 3.46Å; W86-S89 VanDerWaalsContact O-N 3.08Å; W86-S89 PolarHBondContact O-OG 3.37Å; S89-Q92 PolarHBondContact O-N 2.9Å; S89-Q93 PolarHBondContact O-N 3.06Å; S89-Q93 VanDerWaalsContact O-N 3.12Å |
| 90 | Y | 63.2 | Low | 62.4 | Low | 143 Ų | 143 | 127.4 Ų | 127.4 | 56% | 0.561 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -62.5 | -41.2 | 171.6 | -74.9 | -66 | 0 | 0 | 0 | 112.1 | W86 Q92 Q93 | W86-Y90 HydrophobicContact CB-CD2 4.42Å; W86-Y90 HydrophobicContact CB-CE2 4.18Å; W86-Y90 AromaticContact CE3-CE2 3.89Å; W86-Y90 HydrophobicContact CE3-CE2 3.89Å; W86-Y90 WeakPolarHBondContact O-CD2 3.26Å; W86-Y90 PolarHBondContact O-N 3.48Å; Y90-Q92 VanDerWaalsContact C-N 3.28Å; Y90-Q92 PolarHBondContact O-N 3.21Å; Y90-Q93 PolarHBondContact O-N 3.15Å |
| 91 | Q | 60.2 | Low | 61.8 | Low | 155 Ų | 155 | 126.9 Ų | 126.9 | 72% | 0.724 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -64.2 | -35.4 | 175.6 | -164.1 | -168.5 | -43.7 | 0 | 0 | 111.6 | A87 R88 Q93 | A87-Q91 WeakPolarHBondContact O-CB 3.32Å; A87-Q91 PolarHBondContact O-N 3.41Å; R88-Q91 PolarHBondContact O-N 3.39Å; Q91-Q93 VanDerWaalsContact C-N 3.33Å; Q91-Q93 PolarHBondContact O-N 2.96Å |
| 92 | Q | 57 | Low | 61 | Low | 160 Ų | 160 | 124.7 Ų | 124.7 | 75% | 0.748 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -73.5 | -20.9 | 178 | -119.7 | 179.1 | -47.5 | 0 | 0 | 113.9 | R88 S89 Y90 P95 | R88-Q92 PolarHBondContact O-N 3.29Å; S89-Q92 PolarHBondContact O-N 2.9Å; Y90-Q92 VanDerWaalsContact C-N 3.28Å; Y90-Q92 PolarHBondContact O-N 3.21Å; Q92-P95 WeakPolarHBondContact O-CD 3.18Å |
| 93 | Q | 55.7 | Low | 59.7 | Low | 151 Ų | 151 | 129.1 Ų | 129.1 | 71% | 0.706 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.8 | 6.3 | 178.7 | -74.2 | -170.8 | -20.1 | 0 | 0 | 114.6 | S89 Y90 Q91 P95 | S89-Q93 PolarHBondContact O-N 3.06Å; S89-Q93 VanDerWaalsContact O-N 3.12Å; Y90-Q93 PolarHBondContact O-N 3.15Å; Q91-Q93 VanDerWaalsContact C-N 3.33Å; Q91-Q93 PolarHBondContact O-N 2.96Å; Q93-P95 WeakPolarHBondContact O-CD 3.45Å |
| 94 | Q | 57.1 | Low | 59.2 | Low | 174 Ų | 174 | 130.9 Ų | 130.9 | 81% | 0.813 | 70% | 0.702 | S | S | * | * | trans | -96.6 | 48.2 | 166.7 | -72.4 | -171.8 | -9.6 | 0 | 0 | 114.9 | ||||
| 95 | P | 54.4 | Low | 58.7 | Low | 89 Ų | 89 | 130.9 Ų | 130.9 | 58% | 0.578 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -88.2 | 124.8 | 151.8 | 31.4 | -18.6 | 0 | 0 | 0 | 108.5 | Q92 Q93 | Q92-P95 WeakPolarHBondContact O-CD 3.18Å; Q93-P95 WeakPolarHBondContact O-CD 3.45Å |
| 96 | L | 58.2 | Low | 58.1 | Low | 154 Ų | 154 | 135.9 Ų | 135.9 | 81% | 0.806 | 72% | 0.723 | S | S | * | * | trans | 79 | 56.4 | 156 | -58.1 | 156.5 | 0 | 0 | 0 | 117.3 | ||||
| 97 | L | 57.9 | Low | 57.2 | Low | 173 Ų | 173 | 134.9 Ų | 134.9 | 91% | 0.906 | 73% | 0.731 | S | S | * | * | trans | -108.1 | 52.7 | 144.1 | -152 | 163 | 0 | 0 | 0 | 109.5 | ||||
| 98 | S | 57.5 | Low | 56.5 | Low | 82 Ų | 82 | 139.9 Ų | 139.9 | 57% | 0.573 | 75% | 0.749 | S | S | * | * | trans | -89 | 90.8 | 155.6 | 50.9 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 99 | K | 51.4 | Low | 56.1 | Low | 172 Ų | 172 | 137 Ų | 137 | 75% | 0.748 | 75% | 0.752 | S | S | * | * | 62.1 | 67.1 | 100.2 | -167.6 | 178.6 | 164.7 | 178.4 | 0 | 111.6 | A101 | K99-A101 HydrophobicContact CG-CB 3.83Å; K99-A101 PolarHBondContact O-N 3.26Å | |||
| 100 | D | 59.2 | Low | 55.5 | Low | 167 Ų | 167 | 143.4 Ų | 143.4 | 89% | 0.893 | 78% | 0.782 | S | S | * | * | trans | -74.8 | 78.2 | 146.8 | -65.5 | -32.5 | 0 | 0 | 0 | 107.2 | T102 | D100-T102 PolarHBondContact O-N 3.2Š| ||
| 101 | A | 54.9 | Low | 54.9 | Low | 68 Ų | 68 | 143.4 Ų | 143.4 | 56% | 0.562 | 80% | 0.799 | S | S | * | * | trans | -79.8 | 102.5 | 162.1 | 0 | 0 | 0 | 0 | 0 | 106.6 | K99 A103 | K99-A101 HydrophobicContact CG-CB 3.83Å; K99-A101 PolarHBondContact O-N 3.26Å; A101-A103 PolarHBondContact O-N 3Å | ||
| 102 | T | 47.6 | Very low | 54.4 | Low | 142 Ų | 142 | 142.4 Ų | 142.4 | 87% | 0.871 | 81% | 0.806 | S | S | * | * | trans | -31 | 120.3 | 166.5 | 49.5 | 0 | 0 | 0 | 0 | 114.3 | D100 | D100-T102 PolarHBondContact O-N 3.2Š| ||
| 103 | A | 42.3 | Very low | 54.2 | Low | 177 Ų | 177 | 140.8 Ų | 140.8 | 100% | 1.463 | 81% | 0.811 | S | S | * | * | trans | -160.8 | 0 | 144.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | A101 | A101-A103 PolarHBondContact O-N 3Š|
Retrieved 103 of 103 residues in 177.9 ms
(Link to these results)