| 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 | 38.8 | Very low | 60.2 | Low | 235 Ų | 235 | 116.2 Ų | 116.2 | 100% | 1.158 | 66% | 0.656 | S | S | * | * | 0 | 94.8 | 0 | -78.1 | 169.1 | 147.8 | 0 | 0 | 107.9 | S3 | M1-S3 PolarHBondContact O-N 3.46Š| |||
| 2 | F | 41.5 | Very low | 61.2 | Low | 221 Ų | 221 | 107.9 Ų | 107.9 | 97% | 0.969 | 61% | 0.611 | S | S | * | * | trans | -84.7 | 104.7 | 166.9 | -105 | -95 | 0 | 0 | 0 | 106.3 | G4 | F2-G4 PolarHBondContact O-N 2.95Š| ||
| 3 | S | 50.1 | Low | 62.1 | Low | 99 Ų | 99 | 103.9 Ų | 103.9 | 69% | 0.692 | 59% | 0.593 | S | S | * | * | trans | -69.2 | 99.8 | 178.4 | -58.7 | 0 | 0 | 0 | 0 | 109.4 | M1 S5 | M1-S3 PolarHBondContact O-N 3.46Å; S3-S5 PolarHBondContact O-N 3.22Å | ||
| 4 | G | 57.7 | Low | 63.2 | Low | 64 Ų | 64 | 106.5 Ų | 106.5 | 66% | 0.66 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.6 | 6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 115 | F2 G6 | F2-G4 PolarHBondContact O-N 2.95Å; G4-G6 VanDerWaalsContact C-N 3.33Å; G4-G6 PolarHBondContact O-N 2.9Å |
| 5 | S | 61.1 | Low | 64 | Low | 77 Ų | 77 | 106.9 Ų | 106.9 | 54% | 0.538 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -71.4 | -19.7 | -175.3 | -42.9 | 0 | 0 | 0 | 0 | 114.4 | S3 E9 | S3-S5 PolarHBondContact O-N 3.22Å; S5-E9 WeakPolarHBondContact O-CB 3.42Å; S5-E9 PolarHBondContact O-N 3.27Å |
| 6 | G | 62.8 | Low | 64.5 | Low | 47 Ų | 47 | 102.8 Ų | 102.8 | 49% | 0.485 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -68.7 | -52.6 | -177 | 0 | 0 | 0 | 0 | 0 | 113.2 | G4 L8 E9 V10 | G4-G6 VanDerWaalsContact C-N 3.33Å; G4-G6 PolarHBondContact O-N 2.9Å; G6-L8 VanDerWaalsContact C-N 3.34Å; G6-E9 PolarHBondContact O-N 2.9Å; G6-V10 VanDerWaalsContact O-CG2 3.24Å; G6-V10 WeakPolarHBondContact O-CG2 3.44Å; G6-V10 PolarHBondContact O-N 2.91Å; G6-V10 VanDerWaalsContact O-N 3.12Å |
| 7 | L | 67.1 | Low | 65.1 | Low | 153 Ų | 153 | 104.7 Ų | 104.7 | 80% | 0.801 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -67.6 | -38.2 | 179.7 | -71.7 | 173.9 | 0 | 0 | 0 | 111.9 | V10 F11 | L7-V10 PolarHBondContact O-N 3.32Å; L7-F11 WeakPolarHBondContact O-CB 3.35Å; L7-F11 PolarHBondContact O-N 3.35Å |
| 8 | L | 68.5 | Low | 65.8 | Low | 43 Ų | 43 | 103.1 Ų | 103.1 | 23% | 0.225 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -65.7 | -44.2 | 177.5 | 177.8 | 63.8 | 0 | 0 | 0 | 112.3 | G6 V10 F11 C12 F53 C54 | G6-L8 VanDerWaalsContact C-N 3.34Å; L8-V10 VanDerWaalsContact C-N 3.33Å; L8-V10 PolarHBondContact O-N 3.47Å; L8-F11 PolarHBondContact O-N 3.35Å; L8-C12 WeakPolarHBondContact O-CB 3.22Å; L8-C12 PolarHBondContact O-N 2.83Å; L8-C12 PolarHBondContact O-SG 3.04Å; L8-F53 WeakPolarHBondContact CD1-O 3.45Å; L8-C54 HydrophobicContact CD2-CB 3.84Å |
| 9 | E | 67.7 | Low | 66.3 | Low | 107 Ų | 107 | 99.2 Ų | 99.2 | 50% | 0.5 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.1 | -39.6 | 176.7 | -176.4 | 165 | 83.8 | 0 | 0 | 111.4 | S5 G6 C12 C13 K41 | S5-E9 WeakPolarHBondContact O-CB 3.42Å; S5-E9 PolarHBondContact O-N 3.27Å; G6-E9 PolarHBondContact O-N 2.9Å; E9-C12 PolarHBondContact O-N 3.46Å; E9-C13 VanDerWaalsContact O-CB 3.29Å; E9-C13 WeakPolarHBondContact O-CB 3.35Å; E9-C13 PolarHBondContact O-N 3.4Å; E9-C13 PolarHBondContact O-SG 2.78Å; E9-K41 IonicContact OE2-NZ 2.85Å; E9-K41 PolarHBondContact OE2-NZ 2.92Å |
| 10 | V | 71.2 | Confident | 66.6 | Low | 99 Ų | 99 | 97.3 Ų | 97.3 | 60% | 0.6 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.8 | -44.5 | 173.8 | 172.8 | 0 | 0 | 0 | 0 | 110.8 | G6 L7 L8 C13 Y14 | G6-V10 VanDerWaalsContact O-CG2 3.24Å; G6-V10 WeakPolarHBondContact O-CG2 3.44Å; G6-V10 PolarHBondContact O-N 2.91Å; G6-V10 VanDerWaalsContact O-N 3.12Å; L7-V10 PolarHBondContact O-N 3.32Å; L8-V10 VanDerWaalsContact C-N 3.33Å; L8-V10 PolarHBondContact O-N 3.47Å; V10-C13 PolarHBondContact O-N 2.83Å; V10-Y14 VanDerWaalsContact O-CB 3.26Å; V10-Y14 WeakPolarHBondContact O-CB 3.26Å; V10-Y14 PolarHBondContact O-N 2.98Å |
| 11 | F | 75.6 | Confident | 67.1 | Low | 133 Ų | 133 | 100.4 Ų | 100.4 | 58% | 0.583 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.3 | -45.5 | 177.3 | -172.1 | -93.6 | 0 | 0 | 0 | 112.1 | L7 L8 Y14 Y15 | L7-F11 WeakPolarHBondContact O-CB 3.35Å; L7-F11 PolarHBondContact O-N 3.35Å; L8-F11 PolarHBondContact O-N 3.35Å; F11-Y14 PolarHBondContact O-N 2.78Å; F11-Y15 VanDerWaalsContact O-CB 3.31Å; F11-Y15 WeakPolarHBondContact O-CB 3.26Å; F11-Y15 PolarHBondContact O-N 2.82Å |
| 12 | C | 72.3 | Confident | 68.9 | Low | 17 Ų | 17 | 93.1 Ų | 93.1 | 12% | 0.115 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -62.5 | -43.3 | 176.2 | -78.1 | 0 | 0 | 0 | 0 | 112.4 | L8 E9 Y15 L16 | L8-C12 WeakPolarHBondContact O-CB 3.22Å; L8-C12 PolarHBondContact O-N 2.83Å; L8-C12 PolarHBondContact O-SG 3.04Å; E9-C12 PolarHBondContact O-N 3.46Å; C12-Y15 PolarHBondContact O-N 2.81Å; C12-L16 WeakPolarHBondContact O-CB 3.16Å; C12-L16 PolarHBondContact O-N 3.46Å |
| 13 | C | 72.7 | Confident | 70.2 | Confident | 56 Ų | 56 | 85.3 Ų | 85.3 | 38% | 0.378 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62.8 | -43.4 | 174.8 | -76.4 | 0 | 0 | 0 | 0 | 111.7 | E9 V10 L16 Q17 | E9-C13 VanDerWaalsContact O-CB 3.29Å; E9-C13 WeakPolarHBondContact O-CB 3.35Å; E9-C13 PolarHBondContact O-N 3.4Å; E9-C13 PolarHBondContact O-SG 2.78Å; V10-C13 PolarHBondContact O-N 2.83Å; C13-L16 PolarHBondContact O-N 2.88Å; C13-Q17 WeakPolarHBondContact O-CG 3.33Å; C13-Q17 PolarHBondContact O-N 3.46Å; C13-Q17 VanDerWaalsContact O-N 3.1Å |
| 14 | Y | 77.8 | Confident | 71.1 | Confident | 140 Ų | 140 | 82.9 Ų | 82.9 | 55% | 0.549 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -64.2 | -44.8 | 177.1 | -174.2 | -105.8 | 0 | 0 | 0 | 111.7 | V10 F11 L16 Q17 I18 | V10-Y14 VanDerWaalsContact O-CB 3.26Å; V10-Y14 WeakPolarHBondContact O-CB 3.26Å; V10-Y14 PolarHBondContact O-N 2.98Å; F11-Y14 PolarHBondContact O-N 2.78Å; Y14-L16 PolarHBondContact O-N 3.24Å; Y14-Q17 PolarHBondContact O-N 3.39Å; Y14-I18 HydrophobicContact CD1-CD1 3.73Å; Y14-I18 HydrophobicContact CE1-CD1 3.24Å; Y14-I18 HydrophobicContact CE1-CG1 4.25Å; Y14-I18 PolarHBondContact O-N 3.06Å |
| 15 | Y | 75.6 | Confident | 71.8 | Confident | 112 Ų | 112 | 85.2 Ų | 85.2 | 44% | 0.439 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -59.7 | -45.3 | 175.3 | -176.8 | -101.6 | 0 | 0 | 0 | 111.6 | F11 C12 Q17 I18 V19 I44 | F11-Y15 VanDerWaalsContact O-CB 3.31Å; F11-Y15 WeakPolarHBondContact O-CB 3.26Å; F11-Y15 PolarHBondContact O-N 2.82Å; C12-Y15 PolarHBondContact O-N 2.81Å; Y15-Q17 VanDerWaalsContact C-N 3.31Å; Y15-Q17 PolarHBondContact O-N 3.25Å; Y15-I18 PolarHBondContact O-N 2.96Å; Y15-V19 HydrophobicContact CD1-CG2 3.93Å; Y15-V19 HydrophobicContact CD2-CG2 4.32Å; Y15-V19 HydrophobicContact CE1-CG2 3.51Å; Y15-V19 HydrophobicContact CE2-CG2 3.94Å; Y15-V19 HydrophobicContact CG-CG2 4.32Å; Y15-V19 WeakPolarHBondContact O-CG2 3.28Å; Y15-V19 PolarHBondContact O-N 2.92Å; Y15-I44 HydrophobicContact CD1-CD1 4.5Å |
| 16 | L | 71.7 | Confident | 72 | Confident | 41 Ų | 41 | 89.1 Ų | 89.1 | 22% | 0.215 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -57 | -44 | 175.9 | 175.9 | 55 | 0 | 0 | 0 | 111.9 | C12 C13 Y14 V19 N20 I39 I44 | C12-L16 WeakPolarHBondContact O-CB 3.16Å; C12-L16 PolarHBondContact O-N 3.46Å; C13-L16 PolarHBondContact O-N 2.88Å; Y14-L16 PolarHBondContact O-N 3.24Å; L16-V19 PolarHBondContact O-N 2.91Å; L16-N20 WeakPolarHBondContact O-CB 3.35Å; L16-N20 PolarHBondContact O-N 3.43Å; L16-I39 HydrophobicContact CD1-CB 4.35Å; L16-I39 HydrophobicContact CD1-CG2 4.11Å; L16-I39 WeakPolarHBondContact CD1-O 3.37Å; L16-I44 HydrophobicContact CB-CD1 3.39Å; L16-I44 HydrophobicContact CD1-CD1 3.23Å; L16-I44 HydrophobicContact CD1-CG1 4.3Å; L16-I44 HydrophobicContact CD2-CD1 4.26Å; L16-I44 HydrophobicContact CG-CD1 3.72Å |
| 17 | Q | 74.3 | Confident | 72 | Confident | 136 Ų | 136 | 88.8 Ų | 88.8 | 64% | 0.636 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -63.4 | -43.7 | 177.7 | -71.9 | -179.7 | 7.5 | 0 | 0 | 112 | C13 Y14 Y15 K21 | C13-Q17 WeakPolarHBondContact O-CG 3.33Å; C13-Q17 PolarHBondContact O-N 3.46Å; C13-Q17 VanDerWaalsContact O-N 3.1Å; Y14-Q17 PolarHBondContact O-N 3.39Å; Y15-Q17 VanDerWaalsContact C-N 3.31Å; Y15-Q17 PolarHBondContact O-N 3.25Å; Q17-K21 VanDerWaalsContact O-CB 3.28Å; Q17-K21 WeakPolarHBondContact O-CB 3.19Å; Q17-K21 PolarHBondContact O-N 3.19Å |
| 18 | I | 78.9 | Confident | 72.1 | Confident | 75 Ų | 75 | 89 Ų | 89 | 39% | 0.385 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.9 | -50.3 | 177 | -69.1 | 175.1 | 0 | 0 | 0 | 110.5 | Y14 Y15 N20 K21 T22 | Y14-I18 HydrophobicContact CD1-CD1 3.73Å; Y14-I18 HydrophobicContact CE1-CD1 3.24Å; Y14-I18 HydrophobicContact CE1-CG1 4.25Å; Y14-I18 PolarHBondContact O-N 3.06Å; Y15-I18 PolarHBondContact O-N 2.96Å; I18-N20 VanDerWaalsContact C-N 3.35Å; I18-N20 PolarHBondContact O-N 2.82Å; I18-K21 PolarHBondContact O-N 3.05Å; I18-T22 WeakPolarHBondContact O-CB 3.39Å; I18-T22 PolarHBondContact O-N 3.47Å; I18-T22 PolarHBondContact O-OG1 2.87Å |
| 19 | V | 74.9 | Confident | 72.2 | Confident | 30 Ų | 30 | 92.5 Ų | 92.5 | 18% | 0.182 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -61 | -46.7 | -179.3 | 174.2 | 0 | 0 | 0 | 0 | 110.1 | Y15 L16 K21 T22 V23 I39 | Y15-V19 HydrophobicContact CD1-CG2 3.93Å; Y15-V19 HydrophobicContact CD2-CG2 4.32Å; Y15-V19 HydrophobicContact CE1-CG2 3.51Å; Y15-V19 HydrophobicContact CE2-CG2 3.94Å; Y15-V19 HydrophobicContact CG-CG2 4.32Å; Y15-V19 WeakPolarHBondContact O-CG2 3.28Å; Y15-V19 PolarHBondContact O-N 2.92Å; L16-V19 PolarHBondContact O-N 2.91Å; V19-K21 VanDerWaalsContact C-N 3.32Å; V19-K21 PolarHBondContact O-N 3.06Å; V19-T22 PolarHBondContact O-N 2.97Å; V19-V23 HydrophobicContact CG1-CG2 4.03Å; V19-V23 WeakPolarHBondContact O-CB 3.24Å; V19-V23 VanDerWaalsContact O-CG2 3.24Å; V19-V23 WeakPolarHBondContact O-CG2 3.34Å; V19-V23 PolarHBondContact O-N 3.48Å; V19-I39 HydrophobicContact CG1-CD1 3.58Å |
| 20 | N | 72 | Confident | 72 | Confident | 61 Ų | 61 | 93.8 Ų | 93.8 | 33% | 0.326 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.1 | -40.6 | 178.8 | -167.1 | 21.7 | 0 | 0 | 0 | 111.5 | L16 I18 N24 | L16-N20 WeakPolarHBondContact O-CB 3.35Å; L16-N20 PolarHBondContact O-N 3.43Å; I18-N20 VanDerWaalsContact C-N 3.35Å; I18-N20 PolarHBondContact O-N 2.82Å; N20-N24 VanDerWaalsContact O-CB 3.26Å; N20-N24 WeakPolarHBondContact O-CB 3.45Å; N20-N24 VanDerWaalsContact O-CG 3.31Å; N20-N24 PolarHBondContact O-N 3.32Å; N20-N24 PolarHBondContact O-ND2 3.44Å; N20-N24 PolarHBondContact OD1-ND2 3.27Å |
| 21 | K | 76.1 | Confident | 71.4 | Confident | 162 Ų | 162 | 92 Ų | 92 | 70% | 0.704 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -64.9 | -45.5 | 175 | -172.1 | 176.6 | -178.5 | 179.9 | 0 | 111.8 | Q17 I18 V19 N24 H25 | Q17-K21 VanDerWaalsContact O-CB 3.28Å; Q17-K21 WeakPolarHBondContact O-CB 3.19Å; Q17-K21 PolarHBondContact O-N 3.19Å; I18-K21 PolarHBondContact O-N 3.05Å; V19-K21 VanDerWaalsContact C-N 3.32Å; V19-K21 PolarHBondContact O-N 3.06Å; K21-N24 PolarHBondContact O-N 2.86Å; K21-H25 VanDerWaalsContact O-CB 3.26Å; K21-H25 WeakPolarHBondContact O-CB 3.36Å; K21-H25 PolarHBondContact O-N 3.36Å |
| 22 | T | 76.6 | Confident | 70.4 | Confident | 83 Ų | 83 | 90.4 Ų | 90.4 | 51% | 0.509 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -64.7 | -44.7 | 179.2 | -62.3 | 0 | 0 | 0 | 0 | 111.5 | I18 V19 H25 W26 | I18-T22 WeakPolarHBondContact O-CB 3.39Å; I18-T22 PolarHBondContact O-N 3.47Å; I18-T22 PolarHBondContact O-OG1 2.87Å; V19-T22 PolarHBondContact O-N 2.97Å; T22-H25 PolarHBondContact O-N 3.23Å; T22-W26 VanDerWaalsContact O-CB 3.22Å; T22-W26 WeakPolarHBondContact O-CB 3.37Å; T22-W26 PolarHBondContact O-N 3.1Å |
| 23 | V | 69.4 | Low | 69.6 | Low | 57 Ų | 57 | 97.5 Ų | 97.5 | 35% | 0.345 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64 | -45.2 | 176.2 | 172 | 0 | 0 | 0 | 0 | 110 | V19 H25 W26 V27 I39 | V19-V23 HydrophobicContact CG1-CG2 4.03Å; V19-V23 WeakPolarHBondContact O-CB 3.24Å; V19-V23 VanDerWaalsContact O-CG2 3.24Å; V19-V23 WeakPolarHBondContact O-CG2 3.34Å; V19-V23 PolarHBondContact O-N 3.48Å; V23-H25 PolarHBondContact O-N 3.1Å; V23-W26 PolarHBondContact O-N 3.45Å; V23-V27 HydrophobicContact CG1-CG2 4.26Å; V23-V27 WeakPolarHBondContact O-CB 3.39Å; V23-V27 WeakPolarHBondContact O-CG2 3.31Å; V23-V27 PolarHBondContact O-N 3.31Å; V23-I39 HydrophobicContact CG2-CD1 4.17Å |
| 24 | N | 69.6 | Low | 68.6 | Low | 47 Ų | 47 | 101.1 Ų | 101.1 | 25% | 0.251 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.9 | -42.5 | 175.6 | -81 | -53.8 | 0 | 0 | 0 | 112.5 | N20 K21 V27 M28 R36 | N20-N24 VanDerWaalsContact O-CB 3.26Å; N20-N24 WeakPolarHBondContact O-CB 3.45Å; N20-N24 VanDerWaalsContact O-CG 3.31Å; N20-N24 PolarHBondContact O-N 3.32Å; N20-N24 PolarHBondContact O-ND2 3.44Å; N20-N24 PolarHBondContact OD1-ND2 3.27Å; K21-N24 PolarHBondContact O-N 2.86Å; N24-V27 PolarHBondContact O-N 2.87Å; N24-M28 WeakPolarHBondContact O-CB 3.26Å; N24-M28 PolarHBondContact O-N 2.87Å; N24-R36 VanDerWaalsContact OD1-CZ 3.26Å; N24-R36 PolarHBondContact OD1-NE 3.01Å; N24-R36 PolarHBondContact OD1-NH2 3.33Å |
| 25 | H | 72.5 | Confident | 67.4 | Low | 113 Ų | 113 | 97.3 Ų | 97.3 | 52% | 0.523 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.5 | -42.8 | 176.9 | -173.9 | -108.2 | 0 | 0 | 0 | 111.7 | K21 T22 V23 M28 L29 | K21-H25 VanDerWaalsContact O-CB 3.26Å; K21-H25 WeakPolarHBondContact O-CB 3.36Å; K21-H25 PolarHBondContact O-N 3.36Å; T22-H25 PolarHBondContact O-N 3.23Å; V23-H25 PolarHBondContact O-N 3.1Å; H25-M28 WeakPolarHBondContact O-CB 3.43Å; H25-M28 PolarHBondContact O-N 3.43Å; H25-L29 WeakPolarHBondContact O-CG 3.39Å; H25-L29 PolarHBondContact O-N 2.91Å |
| 26 | W | 65 | Low | 66.4 | Low | 160 Ų | 160 | 100.5 Ų | 100.5 | 61% | 0.606 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.8 | -44.1 | 175.4 | -176.7 | -86.6 | 0 | 0 | 0 | 111.9 | T22 V23 M28 L29 K30 | T22-W26 VanDerWaalsContact O-CB 3.22Å; T22-W26 WeakPolarHBondContact O-CB 3.37Å; T22-W26 PolarHBondContact O-N 3.1Å; V23-W26 PolarHBondContact O-N 3.45Å; W26-M28 VanDerWaalsContact C-N 3.31Å; W26-M28 PolarHBondContact O-N 2.81Å; W26-L29 PolarHBondContact O-N 3.42Å; W26-K30 HydrophobicContact CD2-CG 4.46Å; W26-K30 HydrophobicContact CG-CG 4.49Å; W26-K30 HydrophobicContact CZ2-CG 4.46Å; W26-K30 WeakPolarHBondContact O-CB 3.19Å; W26-K30 WeakPolarHBondContact O-CG 3.13Å; W26-K30 PolarHBondContact O-N 2.85Å |
| 27 | V | 63 | Low | 65.9 | Low | 39 Ų | 39 | 106.3 Ų | 106.3 | 24% | 0.236 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -62.6 | -40 | 175.5 | 170.2 | 0 | 0 | 0 | 0 | 110.6 | V23 N24 K30 G31 | V23-V27 HydrophobicContact CG1-CG2 4.26Å; V23-V27 WeakPolarHBondContact O-CB 3.39Å; V23-V27 WeakPolarHBondContact O-CG2 3.31Å; V23-V27 PolarHBondContact O-N 3.31Å; N24-V27 PolarHBondContact O-N 2.87Å; V27-K30 PolarHBondContact O-N 3.16Å; V27-G31 PolarHBondContact O-N 3.41Å |
| 28 | M | 68.3 | Low | 65.3 | Low | 158 Ų | 158 | 104.1 Ų | 104.1 | 78% | 0.778 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -62.5 | -42.2 | 174.3 | -172.6 | 176.6 | -174.7 | 0 | 0 | 111.8 | N24 H25 W26 | N24-M28 WeakPolarHBondContact O-CB 3.26Å; N24-M28 PolarHBondContact O-N 2.87Å; H25-M28 WeakPolarHBondContact O-CB 3.43Å; H25-M28 PolarHBondContact O-N 3.43Å; W26-M28 VanDerWaalsContact C-N 3.31Å; W26-M28 PolarHBondContact O-N 2.81Å |
| 29 | L | 70.4 | Confident | 64.6 | Low | 117 Ų | 117 | 102.5 Ų | 102.5 | 61% | 0.613 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -71.3 | -33 | 178.6 | -72.6 | 175.3 | 0 | 0 | 0 | 113.7 | H25 W26 | H25-L29 WeakPolarHBondContact O-CG 3.39Å; H25-L29 PolarHBondContact O-N 2.91Å; W26-L29 PolarHBondContact O-N 3.42Å |
| 30 | K | 65.1 | Low | 64 | Low | 134 Ų | 134 | 105 Ų | 105 | 58% | 0.583 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -90.9 | 3.5 | -176.1 | -65.5 | -62.5 | -175.2 | -179.7 | 0 | 114.1 | W26 V27 S32 | W26-K30 HydrophobicContact CD2-CG 4.46Å; W26-K30 HydrophobicContact CG-CG 4.49Å; W26-K30 HydrophobicContact CZ2-CG 4.46Å; W26-K30 WeakPolarHBondContact O-CB 3.19Å; W26-K30 WeakPolarHBondContact O-CG 3.13Å; W26-K30 PolarHBondContact O-N 2.85Å; V27-K30 PolarHBondContact O-N 3.16Å; K30-S32 PolarHBondContact O-N 3Å |
| 31 | G | 56.8 | Low | 63.7 | Low | 60 Ų | 60 | 106.9 Ų | 106.9 | 62% | 0.619 | 56% | 0.557 | S | S | * | * | S | Bend | trans | 72.7 | -11.8 | 159.6 | 0 | 0 | 0 | 0 | 0 | 117.7 | V27 | V27-G31 PolarHBondContact O-N 3.41Š|
| 32 | S | 56 | Low | 63.3 | Low | 101 Ų | 101 | 106 Ų | 106 | 71% | 0.706 | 56% | 0.556 | S | S | * | * | trans | -178.8 | 114.1 | 168.8 | -84.4 | 0 | 0 | 0 | 0 | 111.7 | K30 | K30-S32 PolarHBondContact O-N 3Š| ||
| 33 | F | 54.8 | Low | 62.8 | Low | 166 Ų | 166 | 105.8 Ų | 105.8 | 73% | 0.728 | 55% | 0.551 | S | S | * | * | trans | -132 | 105.4 | 155.2 | -123.2 | -89.9 | 0 | 0 | 0 | 107.5 | G35 | F33-G35 PolarHBondContact O-N 3.11Š| ||
| 34 | P | 51.5 | Low | 62.6 | Low | 131 Ų | 131 | 103.7 Ų | 103.7 | 85% | 0.851 | 54% | 0.538 | S | S | * | . | S | Bend | trans | -75.2 | 94 | 173.4 | 30.3 | -29.7 | 0 | 0 | 0 | 107.7 | ||
| 35 | G | 52.3 | Low | 62.4 | Low | 61 Ų | 61 | 105.1 Ų | 105.1 | 63% | 0.629 | 55% | 0.545 | S | S | * | . | trans | 158.9 | 41.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 116 | F33 K37 | F33-G35 PolarHBondContact O-N 3.11Å; G35-K37 PolarHBondContact O-N 3.36Å | ||
| 36 | R | 55.5 | Low | 62 | Low | 179 Ų | 179 | 103.7 Ų | 103.7 | 68% | 0.675 | 55% | 0.548 | S | S | * | . | trans | -53.6 | 101.9 | 169.2 | -95.8 | -172.8 | -177.7 | 152.6 | 2.6 | 109.4 | N24 V38 | N24-R36 VanDerWaalsContact OD1-CZ 3.26Å; N24-R36 PolarHBondContact OD1-NE 3.01Å; N24-R36 PolarHBondContact OD1-NH2 3.33Å; R36-V38 PolarHBondContact O-N 3.43Å | ||
| 37 | K | 60.8 | Low | 61.8 | Low | 163 Ų | 163 | 99.6 Ų | 99.6 | 71% | 0.709 | 54% | 0.538 | S | S | * | . | trans | -74.7 | 109.3 | 145.8 | -81.7 | -174.1 | 173.7 | -172.7 | 0 | 105.7 | G35 I39 | G35-K37 PolarHBondContact O-N 3.36Å; K37-I39 PolarHBondContact O-N 3.26Å | ||
| 38 | V | 61.9 | Low | 61.5 | Low | 89 Ų | 89 | 105 Ų | 105 | 54% | 0.539 | 56% | 0.561 | S | S | . | * | trans | -54.8 | 113.8 | 156.2 | 175.2 | 0 | 0 | 0 | 0 | 104.7 | R36 N40 | R36-V38 PolarHBondContact O-N 3.43Å; V38-N40 PolarHBondContact O-N 3.05Å | ||
| 39 | I | 63.7 | Low | 60.8 | Low | 42 Ų | 42 | 106.1 Ų | 106.1 | 22% | 0.215 | 56% | 0.557 | C | S | . | * | trans | -67 | 106.2 | 177.2 | -64.7 | 169.2 | 0 | 0 | 0 | 105.3 | L16 V19 V23 K37 D43 I44 | L16-I39 HydrophobicContact CD1-CB 4.35Å; L16-I39 HydrophobicContact CD1-CG2 4.11Å; L16-I39 WeakPolarHBondContact CD1-O 3.37Å; V19-I39 HydrophobicContact CG1-CD1 3.58Å; V23-I39 HydrophobicContact CG2-CD1 4.17Å; K37-I39 PolarHBondContact O-N 3.26Å; I39-D43 HydrophobicContact CG2-CB 3.97Å; I39-I44 HydrophobicContact CG2-CD1 4.05Å; I39-I44 HydrophobicContact CG2-CG1 3.66Å | ||
| 40 | N | 63.3 | Low | 60 | Low | 81 Ų | 81 | 101.5 Ų | 101.5 | 43% | 0.433 | 53% | 0.534 | S | S | . | . | trans | -78.7 | 161.6 | 178.4 | -74.9 | -25.8 | 0 | 0 | 0 | 109.7 | V38 E42 D43 I44 | V38-N40 PolarHBondContact O-N 3.05Å; N40-E42 PolarHBondContact O-N 3.08Å; N40-E42 VanDerWaalsContact O-N 3.1Å; N40-D43 PolarHBondContact O-N 3.27Å; N40-I44 PolarHBondContact O-N 3.18Å | ||
| 41 | K | 65.3 | Low | 59.8 | Low | 102 Ų | 102 | 101.1 Ų | 101.1 | 44% | 0.443 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -51.8 | -34.3 | 172.8 | -171.3 | 179.2 | -177.5 | 177.1 | 0 | 110.9 | E9 I44 L45 | E9-K41 IonicContact OE2-NZ 2.85Å; E9-K41 PolarHBondContact OE2-NZ 2.92Å; K41-I44 PolarHBondContact O-N 3.33Å; K41-L45 HydrophobicContact CD-CD1 4.47Å; K41-L45 HydrophobicContact CG-CD1 3.98Å; K41-L45 HydrophobicContact CG-CG 4.32Å; K41-L45 VanDerWaalsContact O-CG 3.3Å; K41-L45 WeakPolarHBondContact O-CG 3.39Å; K41-L45 PolarHBondContact O-N 2.77Å |
| 42 | E | 67.3 | Low | 59.6 | Low | 144 Ų | 144 | 104.8 Ų | 104.8 | 67% | 0.673 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.6 | -38.7 | 177.6 | -63.3 | 178.2 | 100.6 | 0 | 0 | 113.8 | N40 I44 L45 S46 | N40-E42 PolarHBondContact O-N 3.08Å; N40-E42 VanDerWaalsContact O-N 3.1Å; E42-I44 VanDerWaalsContact C-N 3.28Å; E42-I44 PolarHBondContact O-N 2.96Å; E42-L45 PolarHBondContact O-N 3.47Å; E42-S46 VanDerWaalsContact O-CB 3.29Å; E42-S46 WeakPolarHBondContact O-CB 3.27Å; E42-S46 PolarHBondContact O-N 3.46Å; E42-S46 PolarHBondContact O-OG 2.89Å |
| 43 | D | 65.6 | Low | 59.4 | Low | 78 Ų | 78 | 107.5 Ų | 107.5 | 42% | 0.417 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64.4 | -35.4 | 173.9 | -84.6 | -91.8 | 0 | 0 | 0 | 111.2 | I39 N40 | I39-D43 HydrophobicContact CG2-CB 3.97Å; N40-D43 PolarHBondContact O-N 3.27Å |
| 44 | I | 65 | Low | 59.2 | Low | 13 Ų | 13 | 104.7 Ų | 104.7 | 7% | 0.067 | 54% | 0.536 | C | S | . | . | H | α-helix | trans | -72.8 | -45.7 | 177.5 | -65.9 | -176.5 | 0 | 0 | 0 | 111.1 | Y15 L16 I39 N40 K41 E42 S46 N47 V50 | Y15-I44 HydrophobicContact CD1-CD1 4.5Å; L16-I44 HydrophobicContact CB-CD1 3.39Å; L16-I44 HydrophobicContact CD1-CD1 3.23Å; L16-I44 HydrophobicContact CD1-CG1 4.3Å; L16-I44 HydrophobicContact CD2-CD1 4.26Å; L16-I44 HydrophobicContact CG-CD1 3.72Å; I39-I44 HydrophobicContact CG2-CD1 4.05Å; I39-I44 HydrophobicContact CG2-CG1 3.66Å; N40-I44 PolarHBondContact O-N 3.18Å; K41-I44 PolarHBondContact O-N 3.33Å; E42-I44 VanDerWaalsContact C-N 3.28Å; E42-I44 PolarHBondContact O-N 2.96Å; I44-S46 PolarHBondContact O-N 2.91Å; I44-N47 WeakPolarHBondContact O-CB 3.29Å; I44-N47 PolarHBondContact O-N 3.27Å; I44-V50 HydrophobicContact CG2-CG1 4.13Å; I44-V50 HydrophobicContact CG2-CG2 3.97Å; I44-V50 WeakPolarHBondContact O-CB 3.41Å; I44-V50 WeakPolarHBondContact O-CG2 3.29Å |
| 45 | L | 65.5 | Low | 59.6 | Low | 76 Ų | 76 | 103.4 Ų | 103.4 | 40% | 0.398 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67.9 | -22.2 | 178.3 | -68.1 | 174.6 | 0 | 0 | 0 | 112.9 | K41 E42 N47 K51 | K41-L45 HydrophobicContact CD-CD1 4.47Å; K41-L45 HydrophobicContact CG-CD1 3.98Å; K41-L45 HydrophobicContact CG-CG 4.32Å; K41-L45 VanDerWaalsContact O-CG 3.3Å; K41-L45 WeakPolarHBondContact O-CG 3.39Å; K41-L45 PolarHBondContact O-N 2.77Å; E42-L45 PolarHBondContact O-N 3.47Å; L45-N47 VanDerWaalsContact C-N 3.29Å; L45-K51 VanDerWaalsContact O-CE 3.27Å; L45-K51 WeakPolarHBondContact O-CE 3.43Å |
| 46 | S | 65.7 | Low | 60 | Low | 84 Ų | 84 | 105.6 Ų | 105.6 | 59% | 0.587 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.2 | -10.7 | 175.6 | -62.9 | 0 | 0 | 0 | 0 | 113.7 | E42 I44 | E42-S46 VanDerWaalsContact O-CB 3.29Å; E42-S46 WeakPolarHBondContact O-CB 3.27Å; E42-S46 PolarHBondContact O-N 3.46Å; E42-S46 PolarHBondContact O-OG 2.89Å; I44-S46 PolarHBondContact O-N 2.91Å |
| 47 | N | 59.6 | Low | 60.2 | Low | 73 Ų | 73 | 101.6 Ų | 101.6 | 39% | 0.39 | 51% | 0.506 | S | S | . | . | trans | -80.1 | 122.3 | -180 | -166.7 | -45.7 | 0 | 0 | 0 | 110.9 | I44 L45 Y49 V50 K51 | I44-N47 WeakPolarHBondContact O-CB 3.29Å; I44-N47 PolarHBondContact O-N 3.27Å; L45-N47 VanDerWaalsContact C-N 3.29Å; N47-Y49 PolarHBondContact O-N 3.49Å; N47-Y49 VanDerWaalsContact O-N 3.16Å; N47-Y49 WeakPolarHBondContact OD1-CB 3.13Å; N47-Y49 WeakPolarHBondContact OD1-CD2 3.3Å; N47-Y49 PolarHBondContact OD1-N 3.49Å; N47-V50 HydrophobicContact CB-CB 4.46Å; N47-V50 HydrophobicContact CB-CG2 4.09Å; N47-V50 PolarHBondContact O-N 2.85Å; N47-K51 PolarHBondContact O-N 2.95Å; N47-K51 VanDerWaalsContact O-N 3.08Å | ||
| 48 | E | 56.6 | Low | 60.2 | Low | 154 Ų | 154 | 97.9 Ų | 97.9 | 72% | 0.72 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -55.5 | -31.7 | 179 | -75.5 | -175.5 | 89.6 | 0 | 0 | 113.2 | V50 K51 L52 | E48-V50 VanDerWaalsContact C-N 3.31Å; E48-V50 PolarHBondContact O-N 3.45Å; E48-K51 PolarHBondContact O-N 3.28Å; E48-L52 PolarHBondContact O-N 2.94Å; E48-L52 VanDerWaalsContact O-N 3.11Å |
| 49 | Y | 55.2 | Low | 60.1 | Low | 180 Ų | 180 | 98.5 Ų | 98.5 | 71% | 0.706 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.3 | -34.5 | 175.2 | -73.2 | -86.1 | 0 | 0 | 0 | 112.4 | N47 L52 F53 | N47-Y49 PolarHBondContact O-N 3.49Å; N47-Y49 VanDerWaalsContact O-N 3.16Å; N47-Y49 WeakPolarHBondContact OD1-CB 3.13Å; N47-Y49 WeakPolarHBondContact OD1-CD2 3.3Å; N47-Y49 PolarHBondContact OD1-N 3.49Å; Y49-L52 WeakPolarHBondContact O-CB 3.24Å; Y49-F53 WeakPolarHBondContact O-CD2 3.19Å |
| 50 | V | 53.6 | Low | 59.8 | Low | 21 Ų | 21 | 102.3 Ų | 102.3 | 13% | 0.127 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -78.6 | -35.1 | 178.2 | -179.8 | 0 | 0 | 0 | 0 | 110.5 | I44 N47 E48 L52 F53 C54 | I44-V50 HydrophobicContact CG2-CG1 4.13Å; I44-V50 HydrophobicContact CG2-CG2 3.97Å; I44-V50 WeakPolarHBondContact O-CB 3.41Å; I44-V50 WeakPolarHBondContact O-CG2 3.29Å; N47-V50 HydrophobicContact CB-CB 4.46Å; N47-V50 HydrophobicContact CB-CG2 4.09Å; N47-V50 PolarHBondContact O-N 2.85Å; E48-V50 VanDerWaalsContact C-N 3.31Å; E48-V50 PolarHBondContact O-N 3.45Å; V50-L52 PolarHBondContact O-N 3.39Å; V50-F53 PolarHBondContact O-N 3.04Å; V50-C54 PolarHBondContact O-N 3.12Å |
| 51 | K | 60.5 | Low | 59.6 | Low | 125 Ų | 125 | 103.8 Ų | 103.8 | 54% | 0.543 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.7 | -25 | 171.6 | -68.8 | -178.2 | -179.3 | 173.6 | 0 | 113.1 | L45 N47 E48 F53 | L45-K51 VanDerWaalsContact O-CE 3.27Å; L45-K51 WeakPolarHBondContact O-CE 3.43Å; N47-K51 PolarHBondContact O-N 2.95Å; N47-K51 VanDerWaalsContact O-N 3.08Å; E48-K51 PolarHBondContact O-N 3.28Å; K51-F53 PolarHBondContact O-N 3.5Å |
| 52 | L | 52.7 | Low | 59.1 | Low | 137 Ų | 137 | 103.9 Ų | 103.9 | 72% | 0.717 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.2 | -15.7 | 174.9 | -118.4 | 135.2 | 0 | 0 | 0 | 113.4 | E48 Y49 V50 | E48-L52 PolarHBondContact O-N 2.94Å; E48-L52 VanDerWaalsContact O-N 3.11Å; Y49-L52 WeakPolarHBondContact O-CB 3.24Å; V50-L52 PolarHBondContact O-N 3.39Å |
| 53 | F | 50.9 | Low | 58.4 | Low | 159 Ų | 159 | 100.6 Ų | 100.6 | 70% | 0.697 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -116.5 | -2.7 | -179.9 | -62.8 | -79.5 | 0 | 0 | 0 | 114 | L8 Y49 V50 K51 | L8-F53 WeakPolarHBondContact CD1-O 3.45Å; Y49-F53 WeakPolarHBondContact O-CD2 3.19Å; V50-F53 PolarHBondContact O-N 3.04Å; K51-F53 PolarHBondContact O-N 3.5Å |
| 54 | C | 50.6 | Low | 57.8 | Low | 107 Ų | 107 | 102.6 Ų | 102.6 | 72% | 0.723 | 52% | 0.516 | S | S | * | . | trans | -101.4 | 0 | 174.2 | -69 | 0 | 0 | 0 | 0 | 112.1 | L8 V50 | L8-C54 HydrophobicContact CD2-CB 3.84Å; V50-C54 PolarHBondContact O-N 3.12Å |
Retrieved 54 of 54 residues in 33.7 ms
(Link to these results)