| 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 | 54.1 | Low | 75.9 | Confident | 170 Ų | 170 | 94.3 Ų | 94.3 | 84% | 0.837 | 48% | 0.484 | S | S | * | . | 0 | -38 | 0 | -87.7 | 153.1 | 176.1 | 0 | 0 | 112.7 | D3 E4 S5 | M1-D3 VanDerWaalsContact C-N 3.3Å; M1-D3 PolarHBondContact O-N 3.43Å; M1-E4 PolarHBondContact O-N 3.41Å; M1-S5 PolarHBondContact O-N 3.12Å; M1-S5 PolarHBondContact O-OG 3.42Å | |||
| 2 | A | 60.9 | Low | 77.1 | Confident | 66 Ų | 66 | 86.4 Ų | 86.4 | 55% | 0.545 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -56.6 | -38.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | K6 | A2-K6 PolarHBondContact O-N 2.86Å; A2-K6 VanDerWaalsContact O-N 3.17Å |
| 3 | D | 68.3 | Low | 78.1 | Confident | 132 Ų | 132 | 85.5 Ų | 85.5 | 71% | 0.706 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -68.2 | -41.5 | -178.8 | -56.2 | -84 | 0 | 0 | 0 | 112.9 | M1 K6 F7 | M1-D3 VanDerWaalsContact C-N 3.3Å; M1-D3 PolarHBondContact O-N 3.43Å; D3-K6 PolarHBondContact O-N 2.9Å; D3-F7 WeakPolarHBondContact O-CB 3.45Å; D3-F7 PolarHBondContact O-N 3.36Å |
| 4 | E | 68.3 | Low | 79.2 | Confident | 133 Ų | 133 | 85.9 Ų | 85.9 | 62% | 0.621 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -65.2 | -42.4 | 178.8 | -160.6 | 117.1 | 71.7 | 0 | 0 | 110.8 | M1 K6 F7 E8 | M1-E4 PolarHBondContact O-N 3.41Å; E4-K6 PolarHBondContact O-N 3.48Å; E4-F7 PolarHBondContact O-N 3.39Å; E4-F7 VanDerWaalsContact O-N 3.16Å; E4-E8 WeakPolarHBondContact O-CB 3.07Å; E4-E8 WeakPolarHBondContact O-CG 3.39Å; E4-E8 PolarHBondContact O-N 3.43Å |
| 5 | S | 73.7 | Confident | 80.1 | Confident | 12 Ų | 12 | 82.7 Ų | 82.7 | 8% | 0.084 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -63.9 | -41.9 | 178.3 | -64.7 | 0 | 0 | 0 | 0 | 112 | M1 F7 E8 Q9 | M1-S5 PolarHBondContact O-N 3.12Å; M1-S5 PolarHBondContact O-OG 3.42Å; S5-F7 VanDerWaalsContact C-N 3.33Å; S5-F7 PolarHBondContact O-N 2.79Å; S5-E8 PolarHBondContact O-N 3Å; S5-Q9 WeakPolarHBondContact O-CB 3.37Å; S5-Q9 VanDerWaalsContact O-CG 3.28Å; S5-Q9 WeakPolarHBondContact O-CG 3.21Å; S5-Q9 PolarHBondContact O-N 2.97Å |
| 6 | K | 80.9 | Confident | 80.8 | Confident | 144 Ų | 144 | 80.9 Ų | 80.9 | 63% | 0.626 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -64.9 | -38.9 | 174.2 | -73.4 | -174.6 | -169.7 | -179.5 | 0 | 111.9 | A2 D3 E4 Q9 A10 | A2-K6 PolarHBondContact O-N 2.86Å; A2-K6 VanDerWaalsContact O-N 3.17Å; D3-K6 PolarHBondContact O-N 2.9Å; E4-K6 PolarHBondContact O-N 3.48Å; K6-Q9 PolarHBondContact O-N 3.16Å; K6-A10 VanDerWaalsContact O-CB 3.31Å; K6-A10 WeakPolarHBondContact O-CB 3.41Å; K6-A10 PolarHBondContact O-N 3.19Å |
| 7 | F | 84.8 | Confident | 81.6 | Confident | 128 Ų | 128 | 80.5 Ų | 80.5 | 56% | 0.561 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -66 | -45.8 | 177.7 | -178.3 | -98.7 | 0 | 0 | 0 | 111.7 | D3 E4 S5 A10 K11 | D3-F7 WeakPolarHBondContact O-CB 3.45Å; D3-F7 PolarHBondContact O-N 3.36Å; E4-F7 PolarHBondContact O-N 3.39Å; E4-F7 VanDerWaalsContact O-N 3.16Å; S5-F7 VanDerWaalsContact C-N 3.33Å; S5-F7 PolarHBondContact O-N 2.79Å; F7-A10 PolarHBondContact O-N 2.9Å; F7-K11 HydrophobicContact CE1-CD 4.26Å; F7-K11 VanDerWaalsContact O-CB 3.23Å; F7-K11 WeakPolarHBondContact O-CB 3.37Å; F7-K11 PolarHBondContact O-N 3.43Å |
| 8 | E | 84.3 | Confident | 82.3 | Confident | 56 Ų | 56 | 80.2 Ų | 80.2 | 26% | 0.262 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -59.9 | -46.2 | 173.3 | -72 | -160.8 | 117.8 | 0 | 0 | 110.7 | E4 S5 A10 K11 G12 D34 | E4-E8 WeakPolarHBondContact O-CB 3.07Å; E4-E8 WeakPolarHBondContact O-CG 3.39Å; E4-E8 PolarHBondContact O-N 3.43Å; S5-E8 PolarHBondContact O-N 3Å; E8-A10 PolarHBondContact O-N 2.97Å; E8-K11 PolarHBondContact O-N 3.32Å; E8-G12 PolarHBondContact O-N 2.78Å; E8-D34 VanDerWaalsContact CA-OD1 3.29Å; E8-D34 WeakPolarHBondContact CA-OD1 3.41Å; E8-D34 VanDerWaalsContact CB-OD1 3.32Å; E8-D34 WeakPolarHBondContact CB-OD1 3.31Å |
| 9 | Q | 83.4 | Confident | 83 | Confident | 48 Ų | 48 | 75.9 Ų | 75.9 | 22% | 0.224 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -58.8 | -44.6 | 174 | -75.2 | -177 | -68.4 | 0 | 0 | 112.8 | S5 K6 G12 N13 | S5-Q9 WeakPolarHBondContact O-CB 3.37Å; S5-Q9 VanDerWaalsContact O-CG 3.28Å; S5-Q9 WeakPolarHBondContact O-CG 3.21Å; S5-Q9 PolarHBondContact O-N 2.97Å; K6-Q9 PolarHBondContact O-N 3.16Å; Q9-G12 PolarHBondContact O-N 3.18Å; Q9-N13 WeakPolarHBondContact O-CB 3.4Å; Q9-N13 PolarHBondContact O-N 3.06Å |
| 10 | A | 88.2 | Confident | 83.5 | Confident | 54 Ų | 54 | 77.4 Ų | 77.4 | 45% | 0.446 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -65.2 | -46.3 | 179 | 0 | 0 | 0 | 0 | 0 | 111.4 | K6 F7 E8 G12 N13 V14 | K6-A10 VanDerWaalsContact O-CB 3.31Å; K6-A10 WeakPolarHBondContact O-CB 3.41Å; K6-A10 PolarHBondContact O-N 3.19Å; F7-A10 PolarHBondContact O-N 2.9Å; E8-A10 PolarHBondContact O-N 2.97Å; A10-G12 VanDerWaalsContact C-N 3.34Å; A10-G12 PolarHBondContact O-N 2.9Å; A10-N13 PolarHBondContact O-N 2.79Å; A10-V14 WeakPolarHBondContact O-CG2 3.25Å; A10-V14 PolarHBondContact O-N 3.31Å |
| 11 | K | 88.2 | Confident | 84.1 | Confident | 94 Ų | 94 | 79.3 Ų | 79.3 | 41% | 0.409 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -60.2 | -44.6 | 176.1 | -175.4 | -175.2 | -178.2 | -171.8 | 0 | 111.1 | F7 E8 N13 V14 K15 | F7-K11 HydrophobicContact CE1-CD 4.26Å; F7-K11 VanDerWaalsContact O-CB 3.23Å; F7-K11 WeakPolarHBondContact O-CB 3.37Å; F7-K11 PolarHBondContact O-N 3.43Å; E8-K11 PolarHBondContact O-N 3.32Å; K11-N13 PolarHBondContact O-N 3.01Å; K11-V14 PolarHBondContact O-N 2.96Å; K11-K15 WeakPolarHBondContact O-CB 3.49Å; K11-K15 WeakPolarHBondContact O-CG 3.38Å; K11-K15 PolarHBondContact O-N 3.36Å |
| 12 | G | 90.4 | Very high | 86.1 | Confident | 0 Ų | 0 | 75.4 Ų | 75.4 | 0% | 0 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -58.8 | -45.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | E8 Q9 A10 V14 K15 E16 G31 | E8-G12 PolarHBondContact O-N 2.78Å; Q9-G12 PolarHBondContact O-N 3.18Å; A10-G12 VanDerWaalsContact C-N 3.34Å; A10-G12 PolarHBondContact O-N 2.9Å; G12-V14 PolarHBondContact O-N 3.02Å; G12-K15 PolarHBondContact O-N 3.46Å; G12-E16 WeakPolarHBondContact O-CB 3.37Å; G12-E16 PolarHBondContact O-N 3.41Å; G12-G31 CarbonylContact C-O 3.53Å; G12-G31 VanDerWaalsContact CA-O 3.24Å; G12-G31 WeakPolarHBondContact CA-O 3.3Å; G12-G31 CarbonylContact O-C 3.44Å; G12-G31 WeakPolarHBondContact O-CA 3.23Å |
| 13 | N | 89.2 | Confident | 87.7 | Confident | 74 Ų | 74 | 79.7 Ų | 79.7 | 40% | 0.396 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -64.9 | -38.9 | 178.2 | -139.6 | 66.1 | 0 | 0 | 0 | 112.5 | Q9 A10 K11 T17 K35 | Q9-N13 WeakPolarHBondContact O-CB 3.4Å; Q9-N13 PolarHBondContact O-N 3.06Å; A10-N13 PolarHBondContact O-N 2.79Å; K11-N13 PolarHBondContact O-N 3.01Å; N13-T17 WeakPolarHBondContact O-CB 3.19Å; N13-T17 PolarHBondContact O-N 2.81Å; N13-T17 PolarHBondContact O-OG1 3.33Å; N13-K35 WeakPolarHBondContact OD1-CE 3.29Å; N13-K35 PolarHBondContact OD1-NZ 2.81Å |
| 14 | V | 93.6 | Very high | 89 | Confident | 91 Ų | 91 | 76.5 Ų | 76.5 | 55% | 0.552 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -65.9 | -47.8 | 174.7 | 172.8 | 0 | 0 | 0 | 0 | 110.5 | A10 K11 G12 E16 T17 V18 | A10-V14 WeakPolarHBondContact O-CG2 3.25Å; A10-V14 PolarHBondContact O-N 3.31Å; K11-V14 PolarHBondContact O-N 2.96Å; G12-V14 PolarHBondContact O-N 3.02Å; V14-E16 PolarHBondContact O-N 3.18Å; V14-T17 PolarHBondContact O-N 3.47Å; V14-V18 HydrophobicContact CG1-CG2 4Å; V14-V18 VanDerWaalsContact O-CB 3.3Å; V14-V18 WeakPolarHBondContact O-CB 3.44Å; V14-V18 WeakPolarHBondContact O-CG2 3.12Å; V14-V18 PolarHBondContact O-N 2.8Å |
| 15 | K | 93.8 | Very high | 90.2 | Very high | 39 Ų | 39 | 77.5 Ų | 77.5 | 17% | 0.17 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -60.7 | -42.5 | 176.3 | -76.5 | -175.5 | -177.7 | -177.3 | 0 | 112.2 | K11 G12 G19 L27 E30 | K11-K15 WeakPolarHBondContact O-CB 3.49Å; K11-K15 WeakPolarHBondContact O-CG 3.38Å; K11-K15 PolarHBondContact O-N 3.36Å; G12-K15 PolarHBondContact O-N 3.46Å; K15-G19 WeakPolarHBondContact O-CA 3.38Å; K15-G19 PolarHBondContact O-N 3.19Å; K15-L27 CarbonylContact C-O 3.45Å; K15-L27 HydrophobicContact CB-CD2 4.46Å; K15-L27 HydrophobicContact CB-CG 4.37Å; K15-L27 HydrophobicContact CG-CG 4.47Å; K15-L27 WeakPolarHBondContact O-CD2 3.33Å; K15-E30 HydrophobicContact CD-CB 4.07Å; K15-E30 IonicContact NZ-OE1 3.96Å; K15-E30 PolarHBondContact NZ-OE1 2.98Å |
| 16 | E | 91 | Very high | 91.2 | Very high | 53 Ų | 53 | 82.7 Ų | 82.7 | 25% | 0.248 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -59.1 | -49.9 | 176 | -177.2 | 178.4 | 79.7 | 0 | 0 | 110.5 | G12 V14 G19 N20 K35 | G12-E16 WeakPolarHBondContact O-CB 3.37Å; G12-E16 PolarHBondContact O-N 3.41Å; V14-E16 PolarHBondContact O-N 3.18Å; E16-G19 PolarHBondContact O-N 2.97Å; E16-N20 WeakPolarHBondContact O-CB 3.32Å; E16-N20 PolarHBondContact O-N 3.49Å; E16-K35 IonicContact OE1-NZ 2.73Å; E16-K35 PolarHBondContact OE1-NZ 2.98Å; E16-K35 IonicContact OE2-NZ 2.75Å |
| 17 | T | 94.1 | Very high | 91.8 | Very high | 75 Ų | 75 | 78 Ų | 78 | 46% | 0.46 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -66.7 | -49.3 | -178.5 | -54.1 | 0 | 0 | 0 | 0 | 111.8 | N13 V14 G19 N20 V21 | N13-T17 WeakPolarHBondContact O-CB 3.19Å; N13-T17 PolarHBondContact O-N 2.81Å; N13-T17 PolarHBondContact O-OG1 3.33Å; V14-T17 PolarHBondContact O-N 3.47Å; T17-G19 VanDerWaalsContact C-N 3.27Å; T17-G19 PolarHBondContact O-N 2.83Å; T17-N20 PolarHBondContact O-N 2.88Å; T17-V21 HydrophobicContact CG2-CG2 4.44Å; T17-V21 WeakPolarHBondContact O-CB 3.3Å; T17-V21 WeakPolarHBondContact O-CG2 3.46Å; T17-V21 PolarHBondContact O-N 3.39Å |
| 18 | V | 94.8 | Very high | 92.1 | Very high | 74 Ų | 74 | 75 Ų | 75 | 45% | 0.448 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -63.6 | -38.5 | 178.9 | 174.9 | 0 | 0 | 0 | 0 | 110.2 | V14 V21 T22 L27 | V14-V18 HydrophobicContact CG1-CG2 4Å; V14-V18 VanDerWaalsContact O-CB 3.3Å; V14-V18 WeakPolarHBondContact O-CB 3.44Å; V14-V18 WeakPolarHBondContact O-CG2 3.12Å; V14-V18 PolarHBondContact O-N 2.8Å; V18-V21 PolarHBondContact O-N 3.26Å; V18-T22 WeakPolarHBondContact O-CB 3.32Å; V18-T22 WeakPolarHBondContact O-CG2 3.35Å; V18-T22 PolarHBondContact O-N 3.46Å; V18-L27 HydrophobicContact CB-CD2 3.74Å; V18-L27 HydrophobicContact CG1-CD2 3.62Å |
| 19 | G | 95.1 | Very high | 92.6 | Very high | 0 Ų | 0 | 77 Ų | 77 | 0% | 0 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -62.9 | -48.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | K15 E16 T17 V21 T22 D23 N24 | K15-G19 WeakPolarHBondContact O-CA 3.38Å; K15-G19 PolarHBondContact O-N 3.19Å; E16-G19 PolarHBondContact O-N 2.97Å; T17-G19 VanDerWaalsContact C-N 3.27Å; T17-G19 PolarHBondContact O-N 2.83Å; G19-V21 PolarHBondContact O-N 3.16Å; G19-T22 PolarHBondContact O-N 3.31Å; G19-D23 CarbonylContact O-C 3.57Å; G19-D23 WeakPolarHBondContact O-CA 3.24Å; G19-D23 PolarHBondContact O-N 2.93Å; G19-N24 PolarHBondContact O-N 3.5Å |
| 20 | N | 93.2 | Very high | 92.9 | Very high | 105 Ų | 105 | 79.2 Ų | 79.2 | 56% | 0.561 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -62.2 | -42 | 174.7 | 179.1 | 96.3 | 0 | 0 | 0 | 111.9 | E16 T17 D23 | E16-N20 WeakPolarHBondContact O-CB 3.32Å; E16-N20 PolarHBondContact O-N 3.49Å; T17-N20 PolarHBondContact O-N 2.88Å; N20-D23 PolarHBondContact O-N 2.81Å |
| 21 | V | 95.3 | Very high | 93.1 | Very high | 117 Ų | 117 | 76.6 Ų | 76.6 | 71% | 0.709 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -67.3 | -38.8 | 179.7 | 170 | 0 | 0 | 0 | 0 | 112.1 | T17 V18 G19 D23 | T17-V21 HydrophobicContact CG2-CG2 4.44Å; T17-V21 WeakPolarHBondContact O-CB 3.3Å; T17-V21 WeakPolarHBondContact O-CG2 3.46Å; T17-V21 PolarHBondContact O-N 3.39Å; V18-V21 PolarHBondContact O-N 3.26Å; G19-V21 PolarHBondContact O-N 3.16Å; V21-D23 VanDerWaalsContact C-N 3.33Å |
| 22 | T | 95.8 | Very high | 93.2 | Very high | 89 Ų | 89 | 78.4 Ų | 78.4 | 55% | 0.546 | 41% | 0.413 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.6 | 9.4 | -179.9 | -162.1 | 0 | 0 | 0 | 0 | 113.5 | V18 G19 N24 | V18-T22 WeakPolarHBondContact O-CB 3.32Å; V18-T22 WeakPolarHBondContact O-CG2 3.35Å; V18-T22 PolarHBondContact O-N 3.46Å; G19-T22 PolarHBondContact O-N 3.31Å; T22-N24 HydrophobicContact CG2-CB 3.39Å; T22-N24 PolarHBondContact O-N 3.23Å; T22-N24 VanDerWaalsContact O-N 3.12Å |
| 23 | D | 94.4 | Very high | 93.1 | Very high | 156 Ų | 156 | 84.9 Ų | 84.9 | 83% | 0.834 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.5 | 30.2 | -175 | -134.9 | -85.5 | 0 | 0 | 0 | 113.3 | G19 N20 V21 K25 | G19-D23 CarbonylContact O-C 3.57Å; G19-D23 WeakPolarHBondContact O-CA 3.24Å; G19-D23 PolarHBondContact O-N 2.93Å; N20-D23 PolarHBondContact O-N 2.81Å; V21-D23 VanDerWaalsContact C-N 3.33Å; D23-K25 PolarHBondContact O-N 3.48Å |
| 24 | N | 95.5 | Very high | 93 | Very high | 64 Ų | 64 | 82.7 Ų | 82.7 | 34% | 0.342 | 43% | 0.431 | S | S | . | . | trans | -94.8 | 95.2 | 178.9 | -174.9 | -17.3 | 0 | 0 | 0 | 110.2 | G19 T22 N26 L27 E28 | G19-N24 PolarHBondContact O-N 3.5Å; T22-N24 HydrophobicContact CG2-CB 3.39Å; T22-N24 PolarHBondContact O-N 3.23Å; T22-N24 VanDerWaalsContact O-N 3.12Å; N24-N26 PolarHBondContact O-N 2.93Å; N24-N26 WeakPolarHBondContact OD1-CB 3.44Å; N24-N26 PolarHBondContact OD1-N 2.76Å; N24-L27 HydrophobicContact CB-CB 4.07Å; N24-L27 PolarHBondContact O-N 3.49Å; N24-L27 VanDerWaalsContact O-N 3.16Å; N24-L27 PolarHBondContact OD1-N 2.75Å; N24-E28 PolarHBondContact O-N 3.44Å | ||
| 25 | K | 94.1 | Very high | 92.5 | Very high | 155 Ų | 155 | 81.1 Ų | 81.1 | 67% | 0.674 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -49.5 | -38.7 | 175.3 | -158.4 | 83 | 173.3 | 174.5 | 0 | 113.4 | D23 N29 | D23-K25 PolarHBondContact O-N 3.48Å; K25-N29 VanDerWaalsContact O-CB 3.25Å; K25-N29 WeakPolarHBondContact O-CB 3.34Å; K25-N29 PolarHBondContact O-N 3.37Å |
| 26 | N | 94.3 | Very high | 92.1 | Very high | 120 Ų | 120 | 82 Ų | 82 | 64% | 0.642 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -70 | -46.1 | -177.2 | -62.6 | 7.2 | 0 | 0 | 0 | 110.3 | N24 N29 E30 | N24-N26 PolarHBondContact O-N 2.93Å; N24-N26 WeakPolarHBondContact OD1-CB 3.44Å; N24-N26 PolarHBondContact OD1-N 2.76Å; N26-N29 PolarHBondContact O-N 3.25Å; N26-E30 WeakPolarHBondContact O-CB 3.49Å; N26-E30 PolarHBondContact O-N 2.94Å |
| 27 | L | 93.5 | Very high | 91.6 | Very high | 47 Ų | 47 | 82.5 Ų | 82.5 | 25% | 0.246 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -66.5 | -40 | 179.7 | -150.9 | 105.5 | 0 | 0 | 0 | 111.2 | K15 V18 N24 G31 | K15-L27 CarbonylContact C-O 3.45Å; K15-L27 HydrophobicContact CB-CD2 4.46Å; K15-L27 HydrophobicContact CB-CG 4.37Å; K15-L27 HydrophobicContact CG-CG 4.47Å; K15-L27 WeakPolarHBondContact O-CD2 3.33Å; V18-L27 HydrophobicContact CB-CD2 3.74Å; V18-L27 HydrophobicContact CG1-CD2 3.62Å; N24-L27 HydrophobicContact CB-CB 4.07Å; N24-L27 PolarHBondContact O-N 3.49Å; N24-L27 VanDerWaalsContact O-N 3.16Å; N24-L27 PolarHBondContact OD1-N 2.75Å; L27-G31 PolarHBondContact O-N 3.44Å |
| 28 | E | 92.9 | Very high | 90.9 | Very high | 64 Ų | 64 | 79 Ų | 79 | 30% | 0.299 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -58.6 | -50.1 | 172.7 | 179.8 | -173.5 | 91.8 | 0 | 0 | 111.2 | N24 G31 K32 | N24-E28 PolarHBondContact O-N 3.44Å; E28-G31 PolarHBondContact O-N 2.88Å; E28-K32 PolarHBondContact O-N 2.89Å |
| 29 | N | 93.9 | Very high | 90.2 | Very high | 99 Ų | 99 | 81.4 Ų | 81.4 | 53% | 0.529 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -66.6 | -41.9 | -176.9 | -165 | 68.5 | 0 | 0 | 0 | 112.2 | K25 N26 G31 K32 E33 | K25-N29 VanDerWaalsContact O-CB 3.25Å; K25-N29 WeakPolarHBondContact O-CB 3.34Å; K25-N29 PolarHBondContact O-N 3.37Å; N26-N29 PolarHBondContact O-N 3.25Å; N29-G31 VanDerWaalsContact C-N 3.31Å; N29-G31 PolarHBondContact O-N 2.96Å; N29-K32 PolarHBondContact O-N 2.88Å; N29-E33 WeakPolarHBondContact O-CB 3.41Å; N29-E33 PolarHBondContact O-N 3.3Å |
| 30 | E | 90 | Very high | 89.5 | Confident | 93 Ų | 93 | 84 Ų | 84 | 44% | 0.435 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -57.5 | -45.6 | 170.9 | -82.5 | -168 | 66.6 | 0 | 0 | 111.3 | K15 N26 K32 E33 D34 | K15-E30 HydrophobicContact CD-CB 4.07Å; K15-E30 IonicContact NZ-OE1 3.96Å; K15-E30 PolarHBondContact NZ-OE1 2.98Å; N26-E30 WeakPolarHBondContact O-CB 3.49Å; N26-E30 PolarHBondContact O-N 2.94Å; E30-K32 VanDerWaalsContact C-N 3.31Å; E30-K32 PolarHBondContact O-N 3.48Å; E30-E33 PolarHBondContact O-N 3.33Å; E30-D34 WeakPolarHBondContact O-CB 3.28Å; E30-D34 PolarHBondContact O-N 2.87Å |
| 31 | G | 92.2 | Very high | 88.9 | Confident | 0 Ų | 0 | 84.6 Ų | 84.6 | 0% | 0 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -61.1 | -41.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | G12 L27 E28 N29 K35 | G12-G31 CarbonylContact C-O 3.53Å; G12-G31 VanDerWaalsContact CA-O 3.24Å; G12-G31 WeakPolarHBondContact CA-O 3.3Å; G12-G31 CarbonylContact O-C 3.44Å; G12-G31 WeakPolarHBondContact O-CA 3.23Å; L27-G31 PolarHBondContact O-N 3.44Å; E28-G31 PolarHBondContact O-N 2.88Å; N29-G31 VanDerWaalsContact C-N 3.31Å; N29-G31 PolarHBondContact O-N 2.96Å; G31-K35 WeakPolarHBondContact O-CB 3.32Å; G31-K35 PolarHBondContact O-N 3.25Å; G31-K35 VanDerWaalsContact O-N 3.16Å |
| 32 | K | 89.5 | Confident | 88 | Confident | 132 Ų | 132 | 83.3 Ų | 83.3 | 57% | 0.574 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -66.4 | -40.9 | 176.2 | -166 | -179.2 | -175 | -169.6 | 0 | 112.3 | E28 N29 E30 A36 | E28-K32 PolarHBondContact O-N 2.89Å; N29-K32 PolarHBondContact O-N 2.88Å; E30-K32 VanDerWaalsContact C-N 3.31Å; E30-K32 PolarHBondContact O-N 3.48Å; K32-A36 WeakPolarHBondContact O-CB 3.41Å; K32-A36 PolarHBondContact O-N 2.87Å |
| 33 | E | 89.7 | Confident | 87.3 | Confident | 136 Ų | 136 | 86.4 Ų | 86.4 | 64% | 0.636 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -66.7 | -46.1 | 178.5 | -170 | 172.3 | 96 | 0 | 0 | 111.9 | N29 E30 K35 A36 S37 | N29-E33 WeakPolarHBondContact O-CB 3.41Å; N29-E33 PolarHBondContact O-N 3.3Å; E30-E33 PolarHBondContact O-N 3.33Å; E33-K35 VanDerWaalsContact C-N 3.32Å; E33-K35 PolarHBondContact O-N 3.36Å; E33-A36 PolarHBondContact O-N 3.37Å; E33-S37 WeakPolarHBondContact O-CB 3.3Å; E33-S37 PolarHBondContact O-N 2.8Å |
| 34 | D | 86.1 | Confident | 86.8 | Confident | 28 Ų | 28 | 83 Ų | 83 | 15% | 0.15 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -56.9 | -46.4 | 176.6 | -140.3 | -86.3 | 0 | 0 | 0 | 110.3 | E8 E30 A36 S37 G38 | E8-D34 VanDerWaalsContact CA-OD1 3.29Å; E8-D34 WeakPolarHBondContact CA-OD1 3.41Å; E8-D34 VanDerWaalsContact CB-OD1 3.32Å; E8-D34 WeakPolarHBondContact CB-OD1 3.31Å; E30-D34 WeakPolarHBondContact O-CB 3.28Å; E30-D34 PolarHBondContact O-N 2.87Å; D34-A36 PolarHBondContact O-N 3.46Å; D34-S37 PolarHBondContact O-N 3.48Å; D34-G38 PolarHBondContact O-N 3.5Å |
| 35 | K | 83.1 | Confident | 86.2 | Confident | 57 Ų | 57 | 84.1 Ų | 84.1 | 25% | 0.248 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -64.8 | -39.7 | 177.4 | -176.5 | 174.3 | 177.4 | 174.5 | 0 | 113 | N13 E16 G31 E33 K39 | N13-K35 WeakPolarHBondContact OD1-CE 3.29Å; N13-K35 PolarHBondContact OD1-NZ 2.81Å; E16-K35 IonicContact OE1-NZ 2.73Å; E16-K35 PolarHBondContact OE1-NZ 2.98Å; E16-K35 IonicContact OE2-NZ 2.75Å; G31-K35 WeakPolarHBondContact O-CB 3.32Å; G31-K35 PolarHBondContact O-N 3.25Å; G31-K35 VanDerWaalsContact O-N 3.16Å; E33-K35 VanDerWaalsContact C-N 3.32Å; E33-K35 PolarHBondContact O-N 3.36Å; K35-K39 PolarHBondContact O-N 3.16Å |
| 36 | A | 85.1 | Confident | 85.6 | Confident | 57 Ų | 57 | 80.5 Ų | 80.5 | 47% | 0.471 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -70.1 | -44.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | K32 E33 D34 K39 A40 | K32-A36 WeakPolarHBondContact O-CB 3.41Å; K32-A36 PolarHBondContact O-N 2.87Å; E33-A36 PolarHBondContact O-N 3.37Å; D34-A36 PolarHBondContact O-N 3.46Å; A36-K39 PolarHBondContact O-N 2.92Å; A36-A40 VanDerWaalsContact O-CB 3.3Å; A36-A40 WeakPolarHBondContact O-CB 3.42Å; A36-A40 PolarHBondContact O-N 3.02Å |
| 37 | S | 81.8 | Confident | 85.1 | Confident | 65 Ų | 65 | 76.9 Ų | 76.9 | 46% | 0.455 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -60.4 | -47.1 | 177.4 | -171.3 | 0 | 0 | 0 | 0 | 111.1 | E33 D34 K39 A40 K41 | E33-S37 WeakPolarHBondContact O-CB 3.3Å; E33-S37 PolarHBondContact O-N 2.8Å; D34-S37 PolarHBondContact O-N 3.48Å; S37-K39 PolarHBondContact O-N 3.17Å; S37-A40 PolarHBondContact O-N 2.95Å; S37-K41 VanDerWaalsContact O-CB 3.3Å; S37-K41 WeakPolarHBondContact O-CB 3.49Å; S37-K41 PolarHBondContact O-N 3.5Å |
| 38 | G | 78.8 | Confident | 84.8 | Confident | 0 Ų | 0 | 81.4 Ų | 81.4 | 0% | 0 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -58.3 | -47.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | D34 K41 E42 | D34-G38 PolarHBondContact O-N 3.5Å; G38-K41 PolarHBondContact O-N 3.24Å; G38-E42 WeakPolarHBondContact O-CB 3.35Å; G38-E42 PolarHBondContact O-N 3.37Å |
| 39 | K | 79.3 | Confident | 84.4 | Confident | 126 Ų | 126 | 84.8 Ų | 84.8 | 55% | 0.548 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -65.5 | -42 | 177.2 | -75.9 | -166.6 | 176.2 | -152.4 | 0 | 113.1 | K35 A36 S37 K41 E42 F43 | K35-K39 PolarHBondContact O-N 3.16Å; A36-K39 PolarHBondContact O-N 2.92Å; S37-K39 PolarHBondContact O-N 3.17Å; K39-K41 VanDerWaalsContact C-N 3.35Å; K39-E42 PolarHBondContact O-N 2.78Å; K39-F43 WeakPolarHBondContact O-CB 3.47Å; K39-F43 PolarHBondContact O-N 3.45Å |
| 40 | A | 81.4 | Confident | 83.9 | Confident | 54 Ų | 54 | 87.2 Ų | 87.2 | 45% | 0.446 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -64.6 | -42.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | A36 S37 F43 V44 | A36-A40 VanDerWaalsContact O-CB 3.3Å; A36-A40 WeakPolarHBondContact O-CB 3.42Å; A36-A40 PolarHBondContact O-N 3.02Å; S37-A40 PolarHBondContact O-N 2.95Å; A40-F43 PolarHBondContact O-N 3.41Å; A40-V44 WeakPolarHBondContact O-CB 3.22Å; A40-V44 WeakPolarHBondContact O-CG2 3.22Å; A40-V44 PolarHBondContact O-N 3.5Å |
| 41 | K | 79.3 | Confident | 83.8 | Confident | 118 Ų | 118 | 85 Ų | 85 | 51% | 0.513 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -62 | -47.5 | 176.6 | -157.7 | -179.8 | -153.9 | 175.9 | 0 | 111.1 | S37 G38 K39 F43 V44 E45 | S37-K41 VanDerWaalsContact O-CB 3.3Å; S37-K41 WeakPolarHBondContact O-CB 3.49Å; S37-K41 PolarHBondContact O-N 3.5Å; G38-K41 PolarHBondContact O-N 3.24Å; K39-K41 VanDerWaalsContact C-N 3.35Å; K41-F43 VanDerWaalsContact C-N 3.34Å; K41-F43 PolarHBondContact O-N 2.99Å; K41-V44 PolarHBondContact O-N 2.83Å; K41-E45 VanDerWaalsContact O-CB 3.24Å; K41-E45 WeakPolarHBondContact O-CB 3.33Å; K41-E45 PolarHBondContact O-N 2.88Å |
| 42 | E | 76.8 | Confident | 83.5 | Confident | 90 Ų | 90 | 89.1 Ų | 89.1 | 42% | 0.421 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -60.5 | -43.5 | 177.4 | -163.8 | -175.9 | 101.3 | 0 | 0 | 111.5 | G38 K39 N46 | G38-E42 WeakPolarHBondContact O-CB 3.35Å; G38-E42 PolarHBondContact O-N 3.37Å; K39-E42 PolarHBondContact O-N 2.78Å; E42-N46 WeakPolarHBondContact O-CB 3.21Å; E42-N46 PolarHBondContact O-N 3.42Å; E42-N46 PolarHBondContact O-ND2 3.05Å |
| 43 | F | 82 | Confident | 83.3 | Confident | 153 Ų | 153 | 87.1 Ų | 87.1 | 67% | 0.671 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -65.9 | -45.4 | 177.7 | -174.4 | -95.3 | 0 | 0 | 0 | 112.6 | K39 A40 K41 A47 | K39-F43 WeakPolarHBondContact O-CB 3.47Å; K39-F43 PolarHBondContact O-N 3.45Å; A40-F43 PolarHBondContact O-N 3.41Å; K41-F43 VanDerWaalsContact C-N 3.34Å; K41-F43 PolarHBondContact O-N 2.99Å; F43-A47 WeakPolarHBondContact O-CB 3.24Å; F43-A47 PolarHBondContact O-N 2.83Å |
| 44 | V | 84 | Confident | 83.2 | Confident | 86 Ų | 86 | 87.1 Ų | 87.1 | 52% | 0.521 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -66.1 | -39.8 | 179.2 | 170.2 | 0 | 0 | 0 | 0 | 111.1 | A40 K41 A47 K48 | A40-V44 WeakPolarHBondContact O-CB 3.22Å; A40-V44 WeakPolarHBondContact O-CG2 3.22Å; A40-V44 PolarHBondContact O-N 3.5Å; K41-V44 PolarHBondContact O-N 2.83Å; V44-A47 PolarHBondContact O-N 3.44Å; V44-K48 WeakPolarHBondContact O-CB 3.35Å; V44-K48 PolarHBondContact O-N 3.34Å |
| 45 | E | 82.1 | Confident | 83.3 | Confident | 87 Ų | 87 | 91 Ų | 91 | 41% | 0.407 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -66.9 | -47.5 | 178.7 | -153.6 | -177.2 | 117.7 | 0 | 0 | 110.6 | K41 A47 K48 E49 | K41-E45 VanDerWaalsContact O-CB 3.24Å; K41-E45 WeakPolarHBondContact O-CB 3.33Å; K41-E45 PolarHBondContact O-N 2.88Å; E45-A47 VanDerWaalsContact C-N 3.34Å; E45-A47 PolarHBondContact O-N 2.88Å; E45-K48 PolarHBondContact O-N 2.87Å; E45-E49 WeakPolarHBondContact O-CB 3.45Å; E45-E49 PolarHBondContact O-N 3.39Å |
| 46 | N | 82.1 | Confident | 83.5 | Confident | 78 Ų | 78 | 93.6 Ų | 93.6 | 42% | 0.417 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59.3 | -41.9 | 173.5 | -84.6 | -77.6 | 0 | 0 | 0 | 112.6 | E42 K50 | E42-N46 WeakPolarHBondContact O-CB 3.21Å; E42-N46 PolarHBondContact O-N 3.42Å; E42-N46 PolarHBondContact O-ND2 3.05Å; N46-K50 WeakPolarHBondContact O-CB 3.23Å; N46-K50 WeakPolarHBondContact O-CG 3.36Å; N46-K50 PolarHBondContact O-N 3.33Å |
| 47 | A | 84.3 | Confident | 83.4 | Confident | 44 Ų | 44 | 97 Ų | 97 | 36% | 0.364 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.9 | -43.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | F43 V44 E45 A51 | F43-A47 WeakPolarHBondContact O-CB 3.24Å; F43-A47 PolarHBondContact O-N 2.83Å; V44-A47 PolarHBondContact O-N 3.44Å; E45-A47 VanDerWaalsContact C-N 3.34Å; E45-A47 PolarHBondContact O-N 2.88Å; A47-A51 VanDerWaalsContact O-CB 3.23Å; A47-A51 WeakPolarHBondContact O-CB 3.28Å; A47-A51 PolarHBondContact O-N 2.85Å |
| 48 | K | 85.7 | Confident | 83.6 | Confident | 143 Ų | 143 | 98 Ų | 98 | 62% | 0.622 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -65.2 | -42.1 | 177.5 | -175.5 | -175.9 | -75.4 | -174.2 | 0 | 111.1 | V44 E45 A51 T52 | V44-K48 WeakPolarHBondContact O-CB 3.35Å; V44-K48 PolarHBondContact O-N 3.34Å; E45-K48 PolarHBondContact O-N 2.87Å; K48-A51 PolarHBondContact O-N 3.43Å; K48-T52 VanDerWaalsContact O-CB 3.28Å; K48-T52 WeakPolarHBondContact O-CB 3.38Å; K48-T52 PolarHBondContact O-N 2.73Å; K48-T52 PolarHBondContact O-OG1 3.29Å |
| 49 | E | 84.2 | Confident | 83.7 | Confident | 134 Ų | 134 | 105.6 Ų | 105.6 | 63% | 0.626 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -61.4 | -50.5 | 176.8 | -173.4 | 177.2 | 83.5 | 0 | 0 | 110.8 | E45 A51 T52 D53 | E45-E49 WeakPolarHBondContact O-CB 3.45Å; E45-E49 PolarHBondContact O-N 3.39Å; E49-A51 PolarHBondContact O-N 3Å; E49-T52 PolarHBondContact O-N 3.47Å; E49-D53 PolarHBondContact O-N 3.34Å |
| 50 | K | 83.9 | Confident | 83.4 | Confident | 151 Ų | 151 | 101.7 Ų | 101.7 | 66% | 0.657 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.6 | -42.7 | 176.2 | -76.3 | 177 | -176.8 | -72.6 | 0 | 113 | N46 T52 F54 | N46-K50 WeakPolarHBondContact O-CB 3.23Å; N46-K50 WeakPolarHBondContact O-CG 3.36Å; N46-K50 PolarHBondContact O-N 3.33Å; K50-T52 VanDerWaalsContact C-N 3.35Å; K50-F54 WeakPolarHBondContact O-CB 3.49Å; K50-F54 PolarHBondContact O-N 3.26Å |
| 51 | A | 87.9 | Confident | 82.4 | Confident | 47 Ų | 47 | 106 Ų | 106 | 39% | 0.388 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.4 | -41.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | A47 K48 E49 F54 I55 | A47-A51 VanDerWaalsContact O-CB 3.23Å; A47-A51 WeakPolarHBondContact O-CB 3.28Å; A47-A51 PolarHBondContact O-N 2.85Å; K48-A51 PolarHBondContact O-N 3.43Å; E49-A51 PolarHBondContact O-N 3Å; A51-F54 PolarHBondContact O-N 2.94Å; A51-I55 WeakPolarHBondContact O-CB 3.23Å; A51-I55 WeakPolarHBondContact O-CD1 3.33Å; A51-I55 VanDerWaalsContact O-CG1 3.23Å; A51-I55 WeakPolarHBondContact O-CG1 3.31Å; A51-I55 PolarHBondContact O-N 3.38Å |
| 52 | T | 85.6 | Confident | 81.2 | Confident | 86 Ų | 86 | 109.7 Ų | 109.7 | 53% | 0.528 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.8 | -47.7 | 177.2 | -56.7 | 0 | 0 | 0 | 0 | 110.8 | K48 E49 K50 F54 I55 D56 | K48-T52 VanDerWaalsContact O-CB 3.28Å; K48-T52 WeakPolarHBondContact O-CB 3.38Å; K48-T52 PolarHBondContact O-N 2.73Å; K48-T52 PolarHBondContact O-OG1 3.29Å; E49-T52 PolarHBondContact O-N 3.47Å; K50-T52 VanDerWaalsContact C-N 3.35Å; T52-F54 VanDerWaalsContact C-N 3.31Å; T52-F54 PolarHBondContact O-N 3.42Å; T52-I55 PolarHBondContact O-N 2.89Å; T52-D56 VanDerWaalsContact O-CB 3.31Å; T52-D56 WeakPolarHBondContact O-CB 3.36Å; T52-D56 PolarHBondContact O-N 2.87Å |
| 53 | D | 86.4 | Confident | 80.2 | Confident | 89 Ų | 89 | 108.6 Ų | 108.6 | 48% | 0.476 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -60 | -40.4 | 177.2 | -171.9 | -92.6 | 0 | 0 | 0 | 112.2 | E49 K57 | E49-D53 PolarHBondContact O-N 3.34Å; D53-K57 PolarHBondContact O-N 3.35Å; D53-K57 IonicContact OD1-NZ 3.06Å; D53-K57 PolarHBondContact OD1-NZ 2.73Å |
| 54 | F | 87.7 | Confident | 78.6 | Confident | 137 Ų | 137 | 113.4 Ų | 113.4 | 60% | 0.601 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -68.1 | -46.9 | 177.5 | -176.7 | -97.3 | 0 | 0 | 0 | 112.5 | K50 A51 T52 D56 K57 V58 | K50-F54 WeakPolarHBondContact O-CB 3.49Å; K50-F54 PolarHBondContact O-N 3.26Å; A51-F54 PolarHBondContact O-N 2.94Å; T52-F54 VanDerWaalsContact C-N 3.31Å; T52-F54 PolarHBondContact O-N 3.42Å; F54-D56 VanDerWaalsContact C-N 3.27Å; F54-D56 PolarHBondContact O-N 3.39Å; F54-K57 PolarHBondContact O-N 3.39Å; F54-V58 HydrophobicContact CD1-CG2 4.15Å; F54-V58 HydrophobicContact CE1-CG2 3.71Å; F54-V58 HydrophobicContact CE2-CG2 4.21Å; F54-V58 HydrophobicContact CZ-CG2 3.74Å; F54-V58 WeakPolarHBondContact O-CG2 3.18Å; F54-V58 PolarHBondContact O-N 2.85Å |
| 55 | I | 87.9 | Confident | 78.3 | Confident | 109 Ų | 109 | 114.8 Ų | 114.8 | 56% | 0.559 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -61.5 | -40.9 | 177.3 | -70.3 | 166.2 | 0 | 0 | 0 | 110 | A51 T52 V58 K59 | A51-I55 WeakPolarHBondContact O-CB 3.23Å; A51-I55 WeakPolarHBondContact O-CD1 3.33Å; A51-I55 VanDerWaalsContact O-CG1 3.23Å; A51-I55 WeakPolarHBondContact O-CG1 3.31Å; A51-I55 PolarHBondContact O-N 3.38Å; T52-I55 PolarHBondContact O-N 2.89Å; I55-V58 PolarHBondContact O-N 2.94Å; I55-K59 WeakPolarHBondContact O-CB 3.42Å; I55-K59 PolarHBondContact O-N 2.96Å |
| 56 | D | 86.4 | Confident | 78.1 | Confident | 112 Ų | 112 | 116.2 Ų | 116.2 | 60% | 0.599 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -64.4 | -45.9 | 177.4 | -165.3 | -103.4 | 0 | 0 | 0 | 111.7 | T52 F54 V58 K59 G60 | T52-D56 VanDerWaalsContact O-CB 3.31Å; T52-D56 WeakPolarHBondContact O-CB 3.36Å; T52-D56 PolarHBondContact O-N 2.87Å; F54-D56 VanDerWaalsContact C-N 3.27Å; F54-D56 PolarHBondContact O-N 3.39Å; D56-V58 PolarHBondContact O-N 3.16Å; D56-K59 PolarHBondContact O-N 2.74Å; D56-G60 PolarHBondContact O-N 3.27Å |
| 57 | K | 83.7 | Confident | 77.9 | Confident | 129 Ų | 129 | 118.3 Ų | 118.3 | 56% | 0.561 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -56.2 | -47.1 | 171.9 | -89.7 | -162.8 | -170.3 | 82.9 | 0 | 113 | D53 F54 K59 N61 | D53-K57 PolarHBondContact O-N 3.35Å; D53-K57 IonicContact OD1-NZ 3.06Å; D53-K57 PolarHBondContact OD1-NZ 2.73Å; F54-K57 PolarHBondContact O-N 3.39Å; K57-K59 VanDerWaalsContact C-N 3.34Å; K57-N61 PolarHBondContact O-N 3.44Å; K57-N61 VanDerWaalsContact O-N 3.16Å |
| 58 | V | 86.1 | Confident | 77.5 | Confident | 86 Ų | 86 | 122.7 Ų | 122.7 | 52% | 0.521 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -67.3 | -38.1 | -178.5 | 171.5 | 0 | 0 | 0 | 0 | 111 | F54 I55 D56 | F54-V58 HydrophobicContact CD1-CG2 4.15Å; F54-V58 HydrophobicContact CE1-CG2 3.71Å; F54-V58 HydrophobicContact CE2-CG2 4.21Å; F54-V58 HydrophobicContact CZ-CG2 3.74Å; F54-V58 WeakPolarHBondContact O-CG2 3.18Å; F54-V58 PolarHBondContact O-N 2.85Å; I55-V58 PolarHBondContact O-N 2.94Å; D56-V58 PolarHBondContact O-N 3.16Å |
| 59 | K | 82 | Confident | 77 | Confident | 159 Ų | 159 | 121.4 Ų | 121.4 | 69% | 0.691 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -75 | -38 | 179.1 | -166 | 177.3 | -176.6 | -176 | 0 | 111.9 | I55 D56 K57 K62 | I55-K59 WeakPolarHBondContact O-CB 3.42Å; I55-K59 PolarHBondContact O-N 2.96Å; D56-K59 PolarHBondContact O-N 2.74Å; K57-K59 VanDerWaalsContact C-N 3.34Å; K59-K62 PolarHBondContact O-N 3.15Å; K59-K62 VanDerWaalsContact O-N 3.15Å |
| 60 | G | 71.7 | Confident | 76.5 | Confident | 43 Ų | 43 | 120.6 Ų | 120.6 | 44% | 0.443 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -60.7 | -42.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | D56 K62 G63 | D56-G60 PolarHBondContact O-N 3.27Å; G60-K62 PolarHBondContact O-N 3.08Å; G60-G63 PolarHBondContact O-N 3.01Å; G60-G63 VanDerWaalsContact O-N 3.08Å |
| 61 | N | 60.3 | Low | 76 | Confident | 145 Ų | 145 | 118.4 Ų | 118.4 | 78% | 0.775 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | -2.8 | 176.3 | -84.9 | 11.6 | 0 | 0 | 0 | 115.1 | K57 | K57-N61 PolarHBondContact O-N 3.44Å; K57-N61 VanDerWaalsContact O-N 3.16Å |
| 62 | K | 54.5 | Low | 75.1 | Confident | 195 Ų | 195 | 123.9 Ų | 123.9 | 85% | 0.848 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.1 | 3.6 | 175 | -159.5 | 140.9 | -176.2 | 161.9 | 0 | 113.1 | K59 G60 | K59-K62 PolarHBondContact O-N 3.15Å; K59-K62 VanDerWaalsContact O-N 3.15Å; G60-K62 PolarHBondContact O-N 3.08Å |
| 63 | G | 56.4 | Low | 74.2 | Confident | 68 Ų | 68 | 127.1 Ų | 127.1 | 70% | 0.701 | 66% | 0.663 | S | S | * | * | trans | -110.6 | -7.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | G60 | G60-G63 PolarHBondContact O-N 3.01Å; G60-G63 VanDerWaalsContact O-N 3.08Å | ||
| 64 | E | 47.1 | Very low | 73.1 | Confident | 253 Ų | 253 | 130.5 Ų | 130.5 | 100% | 1.182 | 68% | 0.68 | S | S | * | * | trans | -103.8 | 0 | 173.2 | -69.3 | -167.9 | 100.9 | 0 | 0 | 112.3 |
Retrieved 64 of 64 residues in 16.3 ms
(Link to these results)