| 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 | 43.1 | Very low | 67.4 | Low | 238 Ų | 238 | 126.8 Ų | 126.8 | 100% | 1.172 | 72% | 0.719 | S | S | * | * | 0 | 121.1 | 0 | -70.5 | 176.5 | 173.3 | 0 | 0 | 107 | S3 | M1-S3 PolarHBondContact O-N 2.93Š| |||
| 2 | A | 51.3 | Low | 69.4 | Low | 105 Ų | 105 | 127 Ų | 127 | 87% | 0.868 | 72% | 0.717 | S | S | * | * | trans | -64 | 117.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 108.3 | K4 | A2-K4 PolarHBondContact O-N 3.09Š| ||
| 3 | S | 57.4 | Low | 71.2 | Confident | 116 Ų | 116 | 121.2 Ų | 121.2 | 81% | 0.811 | 70% | 0.695 | S | S | * | * | trans | -55.5 | 111.2 | 171.5 | -34.9 | 0 | 0 | 0 | 0 | 106.6 | M1 | M1-S3 PolarHBondContact O-N 2.93Š| ||
| 4 | K | 61 | Low | 72.7 | Confident | 180 Ų | 180 | 115.2 Ų | 115.2 | 78% | 0.783 | 66% | 0.659 | S | S | * | * | trans | -53.6 | 130.3 | 174.7 | -157.7 | 172.9 | -174.7 | 179.6 | 0 | 106.3 | A2 | A2-K4 PolarHBondContact O-N 3.09Š| ||
| 5 | P | 64.4 | Low | 74.1 | Confident | 102 Ų | 102 | 110.3 Ų | 110.3 | 66% | 0.662 | 63% | 0.632 | S | S | * | * | trans | -52.9 | 143.7 | -179 | 20.1 | -31.4 | 0 | 0 | 0 | 109.1 | V7 | P5-V7 PolarHBondContact O-N 3.48Š| ||
| 6 | P | 65.8 | Low | 75.4 | Confident | 117 Ų | 117 | 107.3 Ų | 107.3 | 76% | 0.76 | 62% | 0.619 | S | S | * | * | trans | -56.6 | 115.1 | -179.4 | 22.8 | -31.7 | 0 | 0 | 0 | 108.3 | V8 | P6-V8 PolarHBondContact O-N 3.35Å; P6-V8 VanDerWaalsContact O-N 3.13Å | ||
| 7 | V | 68.5 | Low | 76.6 | Confident | 129 Ų | 129 | 104.8 Ų | 104.8 | 78% | 0.782 | 61% | 0.609 | S | S | * | * | trans | -69.8 | 112.2 | 176.1 | 178.4 | 0 | 0 | 0 | 0 | 106.5 | P5 | P5-V7 PolarHBondContact O-N 3.48Š| ||
| 8 | V | 76.3 | Confident | 77.6 | Confident | 118 Ų | 118 | 99.8 Ų | 99.8 | 72% | 0.715 | 58% | 0.58 | S | S | * | * | trans | -86.1 | 120.8 | 175.7 | -176.4 | 0 | 0 | 0 | 0 | 107.6 | P6 Q10 | P6-V8 PolarHBondContact O-N 3.35Å; P6-V8 VanDerWaalsContact O-N 3.13Å; V8-Q10 PolarHBondContact O-N 3.36Å | ||
| 9 | L | 79.8 | Confident | 78.5 | Confident | 59 Ų | 59 | 99.6 Ų | 99.6 | 31% | 0.309 | 57% | 0.572 | S | S | . | * | trans | -64.2 | 120.2 | 171.8 | -179.3 | 65.1 | 0 | 0 | 0 | 109 | K11 L14 L47 T50 L51 | L9-K11 PolarHBondContact O-N 3.24Å; L9-K11 VanDerWaalsContact O-N 3.09Å; L9-L14 HydrophobicContact CD1-CD2 4.27Å; L9-L14 HydrophobicContact CD2-CD2 3.8Å; L9-L14 HydrophobicContact CG-CD2 4.37Å; L9-L47 HydrophobicContact CB-CD1 4.24Å; L9-L47 HydrophobicContact CD2-CD1 3.83Å; L9-T50 HydrophobicContact CD2-CG2 3.87Å; L9-L51 HydrophobicContact CD2-CD2 3.96Å; L9-L51 HydrophobicContact CD2-CG 4.4Å | ||
| 10 | Q | 87.3 | Confident | 79.4 | Confident | 148 Ų | 148 | 100.4 Ų | 100.4 | 69% | 0.692 | 57% | 0.571 | S | S | * | * | trans | -76.7 | 96.5 | 175.3 | -69 | -170.8 | -28.5 | 0 | 0 | 109.6 | V8 N12 A13 L14 | V8-Q10 PolarHBondContact O-N 3.36Å; Q10-N12 VanDerWaalsContact C-N 3.31Å; Q10-N12 PolarHBondContact O-N 2.97Å; Q10-A13 HydrophobicContact CB-CB 3.93Å; Q10-A13 PolarHBondContact O-N 2.88Å; Q10-A13 VanDerWaalsContact O-N 3.13Å; Q10-L14 PolarHBondContact O-N 3.32Å | ||
| 11 | K | 87 | Confident | 80.1 | Confident | 83 Ų | 83 | 98.7 Ų | 98.7 | 36% | 0.361 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -48.5 | -50.7 | -177.3 | 177 | 176.6 | 177.2 | -175.7 | 0 | 112.3 | L9 A13 L14 V15 F53 I54 | L9-K11 PolarHBondContact O-N 3.24Å; L9-K11 VanDerWaalsContact O-N 3.09Å; K11-A13 VanDerWaalsContact C-N 3.33Å; K11-A13 PolarHBondContact O-N 3.23Å; K11-L14 PolarHBondContact O-N 2.96Å; K11-V15 HydrophobicContact CG-CG2 4.17Å; K11-V15 WeakPolarHBondContact O-CG2 3.5Å; K11-V15 PolarHBondContact O-N 3.31Å; K11-F53 HydrophobicContact CD-CD1 4.4Å; K11-I54 HydrophobicContact CB-CD1 4.33Å; K11-I54 HydrophobicContact CD-CD1 4.48Å; K11-I54 HydrophobicContact CD-CG1 4.12Å; K11-I54 HydrophobicContact CG-CD1 3.81Å; K11-I54 HydrophobicContact CG-CG1 3.9Å |
| 12 | N | 90.6 | Very high | 82.6 | Confident | 129 Ų | 129 | 91.2 Ų | 91.2 | 69% | 0.69 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.9 | -39.1 | -175.6 | -63.4 | -1.6 | 0 | 0 | 0 | 112.1 | Q10 L14 V15 S16 | Q10-N12 VanDerWaalsContact C-N 3.31Å; Q10-N12 PolarHBondContact O-N 2.97Å; N12-L14 VanDerWaalsContact C-N 3.35Å; N12-V15 PolarHBondContact O-N 3.15Å; N12-S16 PolarHBondContact O-N 3.35Å; N12-S16 PolarHBondContact O-OG 2.96Å; N12-S16 VanDerWaalsContact O-OG 3.13Å |
| 13 | A | 92.8 | Very high | 84.7 | Confident | 52 Ų | 52 | 93.1 Ų | 93.1 | 43% | 0.43 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.8 | -38.1 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q10 K11 C17 | Q10-A13 HydrophobicContact CB-CB 3.93Å; Q10-A13 PolarHBondContact O-N 2.88Å; Q10-A13 VanDerWaalsContact O-N 3.13Å; K11-A13 VanDerWaalsContact C-N 3.33Å; K11-A13 PolarHBondContact O-N 3.23Å; A13-C17 WeakPolarHBondContact O-CB 3.34Å; A13-C17 PolarHBondContact O-N 2.9Å |
| 14 | L | 93.2 | Very high | 86.5 | Confident | 37 Ų | 37 | 92.5 Ų | 92.5 | 19% | 0.194 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -66.4 | -46.1 | 174.4 | 179.2 | 59.8 | 0 | 0 | 0 | 111.1 | L9 Q10 K11 N12 S16 C17 L18 L51 I54 F56 | L9-L14 HydrophobicContact CD1-CD2 4.27Å; L9-L14 HydrophobicContact CD2-CD2 3.8Å; L9-L14 HydrophobicContact CG-CD2 4.37Å; Q10-L14 PolarHBondContact O-N 3.32Å; K11-L14 PolarHBondContact O-N 2.96Å; N12-L14 VanDerWaalsContact C-N 3.35Å; L14-S16 PolarHBondContact O-N 3.41Å; L14-C17 WeakPolarHBondContact O-CB 3.4Å; L14-C17 PolarHBondContact O-N 3.03Å; L14-C17 VanDerWaalsContact O-N 3.14Å; L14-L18 HydrophobicContact CD1-CD1 4.42Å; L14-L18 HydrophobicContact CD1-CG 4.26Å; L14-L18 HydrophobicContact CG-CD1 4.18Å; L14-L18 HydrophobicContact CG-CG 4.45Å; L14-L18 WeakPolarHBondContact O-CG 3.36Å; L14-L18 PolarHBondContact O-N 2.82Å; L14-L51 HydrophobicContact CD2-CD2 3.84Å; L14-I54 HydrophobicContact CD2-CD1 3.86Å; L14-F56 HydrophobicContact CD2-CE2 4.35Å |
| 15 | V | 93.2 | Very high | 88.1 | Confident | 41 Ų | 41 | 86.2 Ų | 86.2 | 25% | 0.248 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -58.8 | -49.6 | 178 | 171.8 | 0 | 0 | 0 | 0 | 110.7 | K11 N12 C17 L18 E19 I54 | K11-V15 HydrophobicContact CG-CG2 4.17Å; K11-V15 WeakPolarHBondContact O-CG2 3.5Å; K11-V15 PolarHBondContact O-N 3.31Å; N12-V15 PolarHBondContact O-N 3.15Å; V15-C17 PolarHBondContact O-N 2.85Å; V15-L18 PolarHBondContact O-N 3.26Å; V15-E19 HydrophobicContact CG1-CG 4.36Å; V15-E19 WeakPolarHBondContact O-CG 3.48Å; V15-E19 PolarHBondContact O-N 3.13Å; V15-I54 HydrophobicContact CG2-CG2 4.01Å |
| 16 | S | 95 | Very high | 89.6 | Confident | 62 Ų | 62 | 83.9 Ų | 83.9 | 43% | 0.434 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.1 | -35.4 | 176.2 | -60.9 | 0 | 0 | 0 | 0 | 112.7 | N12 L14 E20 | N12-S16 PolarHBondContact O-N 3.35Å; N12-S16 PolarHBondContact O-OG 2.96Å; N12-S16 VanDerWaalsContact O-OG 3.13Å; L14-S16 PolarHBondContact O-N 3.41Å; S16-E20 VanDerWaalsContact O-CG 3.25Å; S16-E20 WeakPolarHBondContact O-CG 3.44Å; S16-E20 PolarHBondContact O-N 2.94Å |
| 17 | C | 94.9 | Very high | 90.9 | Very high | 65 Ų | 65 | 81.9 Ų | 81.9 | 44% | 0.439 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -65.8 | -39.1 | 173.8 | -178.1 | 0 | 0 | 0 | 0 | 112.3 | A13 L14 V15 L21 | A13-C17 WeakPolarHBondContact O-CB 3.34Å; A13-C17 PolarHBondContact O-N 2.9Å; L14-C17 WeakPolarHBondContact O-CB 3.4Å; L14-C17 PolarHBondContact O-N 3.03Å; L14-C17 VanDerWaalsContact O-N 3.14Å; V15-C17 PolarHBondContact O-N 2.85Å; C17-L21 WeakPolarHBondContact O-CB 3.41Å; C17-L21 VanDerWaalsContact O-CG 3.23Å; C17-L21 WeakPolarHBondContact O-CG 3.23Å; C17-L21 PolarHBondContact O-N 3.25Å |
| 18 | L | 95.1 | Very high | 92 | Very high | 16 Ų | 16 | 80.6 Ų | 80.6 | 8% | 0.084 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -68.3 | -41.7 | 177.8 | -64.6 | 172 | 0 | 0 | 0 | 111.3 | L14 V15 E20 L21 E22 A29 I54 F56 L80 | L14-L18 HydrophobicContact CD1-CD1 4.42Å; L14-L18 HydrophobicContact CD1-CG 4.26Å; L14-L18 HydrophobicContact CG-CD1 4.18Å; L14-L18 HydrophobicContact CG-CG 4.45Å; L14-L18 WeakPolarHBondContact O-CG 3.36Å; L14-L18 PolarHBondContact O-N 2.82Å; V15-L18 PolarHBondContact O-N 3.26Å; L18-E20 VanDerWaalsContact C-N 3.34Å; L18-E20 PolarHBondContact O-N 3.39Å; L18-L21 PolarHBondContact O-N 3.19Å; L18-E22 WeakPolarHBondContact O-CB 3.32Å; L18-E22 PolarHBondContact O-N 3.13Å; L18-A29 HydrophobicContact CD2-CB 4Å; L18-I54 HydrophobicContact CD1-CG2 4.04Å; L18-F56 HydrophobicContact CD1-CE2 3.83Å; L18-F56 HydrophobicContact CD1-CZ 4.1Å; L18-F56 HydrophobicContact CD2-CZ 4.17Å; L18-L80 HydrophobicContact CB-CD2 3.93Å; L18-L80 HydrophobicContact CD2-CD2 4.17Å; L18-L80 HydrophobicContact CG-CD2 4.43Å |
| 19 | E | 94.3 | Very high | 92.8 | Very high | 95 Ų | 95 | 75.7 Ų | 75.7 | 44% | 0.444 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -60 | -41.4 | 174.7 | -68.8 | 169 | 166.3 | 0 | 0 | 111.9 | V15 E22 Q23 | V15-E19 HydrophobicContact CG1-CG 4.36Å; V15-E19 WeakPolarHBondContact O-CG 3.48Å; V15-E19 PolarHBondContact O-N 3.13Å; E19-E22 WeakPolarHBondContact O-CB 3.46Å; E19-E22 PolarHBondContact O-N 3.4Å; E19-Q23 WeakPolarHBondContact O-CG 3.33Å; E19-Q23 PolarHBondContact O-N 3Å; E19-Q23 VanDerWaalsContact O-N 3.09Å |
| 20 | E | 96.2 | Very high | 93.5 | Very high | 116 Ų | 116 | 77.7 Ų | 77.7 | 54% | 0.542 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -68.1 | -38.9 | 175.8 | -72 | -74.2 | 179.9 | 0 | 0 | 112.2 | S16 L18 E22 Q23 C24 | S16-E20 VanDerWaalsContact O-CG 3.25Å; S16-E20 WeakPolarHBondContact O-CG 3.44Å; S16-E20 PolarHBondContact O-N 2.94Å; L18-E20 VanDerWaalsContact C-N 3.34Å; L18-E20 PolarHBondContact O-N 3.39Å; E20-E22 VanDerWaalsContact C-N 3.35Å; E20-Q23 PolarHBondContact O-N 3.26Å; E20-C24 PolarHBondContact O-N 3.14Å; E20-C24 PolarHBondContact O-SG 2.88Å |
| 21 | L | 96 | Very high | 93.8 | Very high | 64 Ų | 64 | 72.7 Ų | 72.7 | 34% | 0.335 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.2 | -42 | 175.6 | -74.1 | 171.3 | 0 | 0 | 0 | 111.2 | C17 L18 C24 G25 V26 L80 | C17-L21 WeakPolarHBondContact O-CB 3.41Å; C17-L21 VanDerWaalsContact O-CG 3.23Å; C17-L21 WeakPolarHBondContact O-CG 3.23Å; C17-L21 PolarHBondContact O-N 3.25Å; L18-L21 PolarHBondContact O-N 3.19Å; L21-C24 WeakPolarHBondContact O-CB 3.42Å; L21-C24 PolarHBondContact O-N 3.05Å; L21-C24 VanDerWaalsContact O-N 3.13Å; L21-G25 PolarHBondContact O-N 3.09Å; L21-V26 HydrophobicContact CB-CB 4.03Å; L21-V26 HydrophobicContact CB-CG1 4.48Å; L21-V26 HydrophobicContact CB-CG2 4.26Å; L21-V26 HydrophobicContact CD2-CG2 4.08Å; L21-V26 VanDerWaalsContact O-CB 3.24Å; L21-V26 WeakPolarHBondContact O-CB 3.39Å; L21-V26 WeakPolarHBondContact O-CG2 3.38Å; L21-V26 PolarHBondContact O-N 3.06Å; L21-L80 HydrophobicContact CB-CD1 4.15Å |
| 22 | E | 94.8 | Very high | 94.1 | Very high | 81 Ų | 81 | 70.8 Ų | 70.8 | 38% | 0.379 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -57.8 | -47.5 | 173.9 | -172.2 | -169.3 | 170.1 | 0 | 0 | 111.2 | L18 E19 E20 C24 G25 L80 | L18-E22 WeakPolarHBondContact O-CB 3.32Å; L18-E22 PolarHBondContact O-N 3.13Å; E19-E22 WeakPolarHBondContact O-CB 3.46Å; E19-E22 PolarHBondContact O-N 3.4Å; E20-E22 VanDerWaalsContact C-N 3.35Å; E22-C24 PolarHBondContact O-N 3.04Å; E22-G25 WeakPolarHBondContact O-CA 3.25Å; E22-G25 PolarHBondContact O-N 3.5Å; E22-L80 HydrophobicContact CB-CB 4.15Å; E22-L80 HydrophobicContact CG-CB 4.18Å; E22-L80 VanDerWaalsContact CG-O 3.23Å; E22-L80 WeakPolarHBondContact CG-O 3.36Å; E22-L80 VanDerWaalsContact OE1-O 3.06Å |
| 23 | Q | 94.8 | Very high | 94.1 | Very high | 146 Ų | 146 | 65 Ų | 65 | 68% | 0.682 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -61.5 | -29.6 | 175.9 | -71.4 | 174.9 | 41.7 | 0 | 0 | 113.2 | E19 E20 G25 | E19-Q23 WeakPolarHBondContact O-CG 3.33Å; E19-Q23 PolarHBondContact O-N 3Å; E19-Q23 VanDerWaalsContact O-N 3.09Å; E20-Q23 PolarHBondContact O-N 3.26Å; Q23-G25 PolarHBondContact O-N 2.93Å |
| 24 | C | 95.3 | Very high | 93.9 | Very high | 102 Ų | 102 | 66.2 Ų | 66.2 | 69% | 0.689 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.7 | -1.2 | 173.4 | -66.7 | 0 | 0 | 0 | 0 | 113.6 | E20 L21 E22 | E20-C24 PolarHBondContact O-N 3.14Å; E20-C24 PolarHBondContact O-SG 2.88Å; L21-C24 WeakPolarHBondContact O-CB 3.42Å; L21-C24 PolarHBondContact O-N 3.05Å; L21-C24 VanDerWaalsContact O-N 3.13Å; E22-C24 PolarHBondContact O-N 3.04Å |
| 25 | G | 94.6 | Very high | 93.6 | Very high | 49 Ų | 49 | 68.6 Ų | 68.6 | 51% | 0.505 | 38% | 0.382 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 81 | 25.8 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | L21 E22 Q23 N27 | L21-G25 PolarHBondContact O-N 3.09Å; E22-G25 WeakPolarHBondContact O-CA 3.25Å; E22-G25 PolarHBondContact O-N 3.5Å; Q23-G25 PolarHBondContact O-N 2.93Å; G25-N27 PolarHBondContact O-OD1 3.45Å |
| 26 | V | 95.5 | Very high | 93 | Very high | 52 Ų | 52 | 68.3 Ų | 68.3 | 32% | 0.315 | 38% | 0.381 | S | S | . | . | trans | -86.3 | 120.6 | 169.2 | -180 | 0 | 0 | 0 | 0 | 108.8 | L21 K28 L80 | L21-V26 HydrophobicContact CB-CB 4.03Å; L21-V26 HydrophobicContact CB-CG1 4.48Å; L21-V26 HydrophobicContact CB-CG2 4.26Å; L21-V26 HydrophobicContact CD2-CG2 4.08Å; L21-V26 VanDerWaalsContact O-CB 3.24Å; L21-V26 WeakPolarHBondContact O-CB 3.39Å; L21-V26 WeakPolarHBondContact O-CG2 3.38Å; L21-V26 PolarHBondContact O-N 3.06Å; V26-K28 WeakPolarHBondContact CG1-O 3.23Å; V26-L80 HydrophobicContact CG1-CD1 4.37Å | ||
| 27 | N | 93.1 | Very high | 92.1 | Very high | 76 Ų | 76 | 75 Ų | 75 | 41% | 0.406 | 41% | 0.405 | S | S | . | . | trans | -92.8 | -28.7 | -172.4 | -53.3 | 10.8 | 0 | 0 | 0 | 112.1 | G25 L80 H81 | G25-N27 PolarHBondContact O-OD1 3.45Å; N27-L80 PolarHBondContact O-N 3Å; N27-H81 VanDerWaalsContact CB-CD2 3.42Å; N27-H81 WeakPolarHBondContact CB-CD2 3.48Å; N27-H81 PolarHBondContact ND2-CD2 2.65Å; N27-H81 PolarHBondContact ND2-NE2 3Å; N27-H81 PolarHBondContact OD1-NE2 3.18Å | ||
| 28 | K | 92.7 | Very high | 90.9 | Very high | 101 Ų | 101 | 76 Ų | 76 | 44% | 0.439 | 41% | 0.413 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.9 | 136.8 | -174 | -64.2 | -172.5 | 178.2 | -171 | 0 | 110.4 | V26 Y30 T78 D79 | V26-K28 WeakPolarHBondContact CG1-O 3.23Å; K28-Y30 HydrophobicContact CB-CE2 4.33Å; K28-T78 WeakPolarHBondContact CA-O 3.22Å; K28-D79 WeakPolarHBondContact CE-OD2 3.47Å |
| 29 | A | 93.7 | Very high | 89.3 | Confident | 16 Ų | 16 | 78.2 Ų | 78.2 | 13% | 0.132 | 44% | 0.439 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.6 | 135.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | L18 F77 T78 L80 | L18-A29 HydrophobicContact CD2-CB 4Å; A29-F77 CarbonylContact O-C 3.48Å; A29-F77 VanDerWaalsContact O-CA 3.23Å; A29-F77 WeakPolarHBondContact O-CA 3.49Å; A29-T78 HydrophobicContact CB-CG2 4.01Å; A29-T78 PolarHBondContact N-O 3.2Å; A29-T78 VanDerWaalsContact N-O 3.1Å; A29-T78 PolarHBondContact O-N 3.38Å; A29-L80 HydrophobicContact CB-CD1 4.38Å |
| 30 | Y | 94.2 | Very high | 87.8 | Confident | 100 Ų | 100 | 79.3 Ų | 79.3 | 39% | 0.392 | 44% | 0.444 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.1 | 141.5 | 178.5 | -61.6 | -78.2 | 0 | 0 | 0 | 110.9 | K28 L59 P63 L66 L76 F77 | K28-Y30 HydrophobicContact CB-CE2 4.33Å; Y30-L59 HydrophobicContact CD1-CD1 3.66Å; Y30-L59 HydrophobicContact CE1-CD1 3.86Å; Y30-L59 HydrophobicContact CE1-CD2 4.22Å; Y30-P63 HydrophobicContact CE1-CG 4.49Å; Y30-L66 HydrophobicContact CD1-CD1 3.83Å; Y30-L66 HydrophobicContact CD2-CD1 4.36Å; Y30-L66 HydrophobicContact CE1-CD1 4.16Å; Y30-L66 HydrophobicContact CG-CD1 3.92Å; Y30-L76 CarbonylContact C-O 3.56Å; Y30-L76 VanDerWaalsContact CA-O 3.3Å; Y30-L76 WeakPolarHBondContact CA-O 3.47Å; Y30-F77 HydrophobicContact CD1-CB 3.51Å; Y30-F77 HydrophobicContact CE1-CB 3.57Å; Y30-F77 HydrophobicContact CE1-CG 4.46Å |
| 31 | V | 93.9 | Very high | 86.1 | Confident | 44 Ų | 44 | 78.7 Ų | 78.7 | 27% | 0.267 | 45% | 0.451 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.8 | 131.6 | 176.4 | 177 | 0 | 0 | 0 | 0 | 110 | V33 L51 F56 L75 L76 | V31-V33 HydrophobicContact CG1-CG2 4.16Å; V31-L51 HydrophobicContact CB-CD1 4.49Å; V31-L51 HydrophobicContact CG1-CD1 3.79Å; V31-F56 HydrophobicContact CB-CE1 4.3Å; V31-F56 HydrophobicContact CG2-CD1 4.24Å; V31-F56 HydrophobicContact CG2-CE1 3.53Å; V31-F56 HydrophobicContact CG2-CZ 3.92Å; V31-L75 WeakPolarHBondContact O-CA 3.29Å; V31-L76 PolarHBondContact N-O 3.04Å; V31-L76 PolarHBondContact O-N 3.05Å |
| 32 | A | 92.8 | Very high | 84.6 | Confident | 42 Ų | 42 | 84.7 Ų | 84.7 | 35% | 0.347 | 47% | 0.474 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.8 | 115.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | Y73 L75 | A32-Y73 HydrophobicContact CB-CD1 3.81Å; A32-Y73 HydrophobicContact CB-CG 3.9Å; A32-L75 HydrophobicContact CB-CD2 3.55Å |
| 33 | V | 90.3 | Very high | 83.5 | Confident | 7 Ų | 7 | 83.7 Ų | 83.7 | 4% | 0.042 | 47% | 0.473 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.9 | 123.7 | 177.5 | -179.9 | 0 | 0 | 0 | 0 | 109.3 | V31 K35 L47 L51 Y73 R74 L76 | V31-V33 HydrophobicContact CG1-CG2 4.16Å; V33-K35 PolarHBondContact O-N 3.25Å; V33-L47 HydrophobicContact CG1-CD2 4.15Å; V33-L47 HydrophobicContact CG2-CD2 4.27Å; V33-L47 HydrophobicContact CG2-CG 4.46Å; V33-L51 HydrophobicContact CG2-CD1 3.66Å; V33-Y73 CarbonylContact O-C 3.51Å; V33-Y73 WeakPolarHBondContact O-CA 2.94Å; V33-R74 PolarHBondContact N-O 3.13Å; V33-R74 PolarHBondContact O-N 2.91Å; V33-L76 HydrophobicContact CB-CD1 4.28Å; V33-L76 HydrophobicContact CG2-CD1 3.63Å |
| 34 | P | 88.7 | Confident | 82.7 | Confident | 79 Ų | 79 | 80.7 Ų | 80.7 | 51% | 0.513 | 46% | 0.464 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -54 | 136.7 | 179.4 | -25.3 | 31.7 | 0 | 0 | 0 | 112.4 | Y73 | P34-Y73 HydrophobicContact CB-CD1 4.4Å; P34-Y73 HydrophobicContact CB-CE1 4.38Å; P34-Y73 HydrophobicContact CG-CD1 4.07Å; P34-Y73 HydrophobicContact CG-CE1 3.82Å |
| 35 | K | 86.9 | Confident | 82.2 | Confident | 87 Ų | 87 | 77.6 Ų | 77.6 | 38% | 0.378 | 44% | 0.442 | S | S | . | . | P | Polyproline II helix | trans | -69.8 | 145.7 | 169.6 | -68.7 | 178.2 | -170.4 | 170.4 | 0 | 109.7 | V33 Q37 S70 S71 D72 Y73 R74 | V33-K35 PolarHBondContact O-N 3.25Å; K35-Q37 PolarHBondContact O-N 3.35Å; K35-S70 VanDerWaalsContact CE-O 3.32Å; K35-S70 WeakPolarHBondContact CE-O 3.24Å; K35-S70 PolarHBondContact NZ-O 3.2Å; K35-S71 WeakPolarHBondContact CD-O 3.47Å; K35-S71 PolarHBondContact NZ-O 2.96Å; K35-D72 PolarHBondContact N-O 3.23Å; K35-Y73 VanDerWaalsContact CE-O 3.3Å; K35-Y73 WeakPolarHBondContact CE-O 3.42Å; K35-R74 HydrophobicContact CG-CG 3.78Å |
| 36 | P | 81 | Confident | 81.8 | Confident | 35 Ų | 35 | 80.3 Ų | 80.3 | 23% | 0.227 | 45% | 0.451 | C | S | . | . | P | Polyproline II helix | trans | -62.3 | 130.1 | 170.5 | 26.1 | -32.3 | 0 | 0 | 0 | 109.8 | S38 E40 | P36-S38 PolarHBondContact O-N 2.98Å; P36-E40 VanDerWaalsContact CG-O 3.26Å; P36-E40 WeakPolarHBondContact CG-O 3.27Å |
| 37 | Q | 75 | Confident | 81.4 | Confident | 202 Ų | 202 | 81.3 Ų | 81.3 | 94% | 0.944 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.7 | -19.1 | 176.5 | -66.9 | -174.7 | 5.1 | 0 | 0 | 112.7 | K35 G39 | K35-Q37 PolarHBondContact O-N 3.35Å; Q37-G39 PolarHBondContact O-N 3.2Å |
| 38 | S | 70.2 | Confident | 81.2 | Confident | 87 Ų | 87 | 77.7 Ų | 77.7 | 61% | 0.608 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.6 | 3.7 | -178.8 | 56.3 | 0 | 0 | 0 | 0 | 114.4 | P36 E40 | P36-S38 PolarHBondContact O-N 2.98Å; S38-E40 PolarHBondContact O-N 2.94Å; S38-E40 VanDerWaalsContact O-N 3.16Å |
| 39 | G | 61.4 | Low | 81.1 | Confident | 62 Ų | 62 | 80 Ų | 80 | 64% | 0.639 | 45% | 0.445 | S | S | * | . | S | Bend | trans | 67.8 | 13.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q37 P41 | Q37-G39 PolarHBondContact O-N 3.2Å; G39-P41 WeakPolarHBondContact O-CD 3.29Å |
| 40 | E | 62.3 | Low | 81 | Confident | 117 Ų | 117 | 81.4 Ų | 81.4 | 55% | 0.547 | 45% | 0.452 | S | S | . | . | trans | -91.5 | 93.8 | 174 | -65.9 | -159.2 | 128.1 | 0 | 0 | 110.1 | P36 S38 K42 V43 | P36-E40 VanDerWaalsContact CG-O 3.26Å; P36-E40 WeakPolarHBondContact CG-O 3.27Å; S38-E40 PolarHBondContact O-N 2.94Å; S38-E40 VanDerWaalsContact O-N 3.16Å; E40-K42 PolarHBondContact O-N 3.44Å; E40-V43 HydrophobicContact CB-CG2 3.74Å; E40-V43 WeakPolarHBondContact OE2-CG2 3.42Å | ||
| 41 | P | 61 | Low | 80.9 | Confident | 104 Ų | 104 | 76.8 Ų | 76.8 | 68% | 0.675 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -19.5 | -174.4 | 24.4 | -35.5 | 0 | 0 | 0 | 113.4 | G39 R74 | G39-P41 WeakPolarHBondContact O-CD 3.29Å; P41-R74 VanDerWaalsContact O-CZ 3.26Å; P41-R74 PolarHBondContact O-NH2 2.98Å |
| 42 | K | 64 | Low | 80.8 | Confident | 190 Ų | 190 | 79 Ų | 79 | 83% | 0.826 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.1 | -1.5 | -168.7 | -68 | -174.5 | -179.9 | -178.5 | 0 | 115.5 | E40 V44 | E40-K42 PolarHBondContact O-N 3.44Å; K42-V44 PolarHBondContact O-N 2.9Å |
| 43 | V | 72.2 | Confident | 80.8 | Confident | 59 Ų | 59 | 84.3 Ų | 84.3 | 36% | 0.358 | 46% | 0.459 | S | S | . | . | trans | -69.8 | 113 | 179.5 | -177.8 | 0 | 0 | 0 | 0 | 109.1 | E40 T45 R74 | E40-V43 HydrophobicContact CB-CG2 3.74Å; E40-V43 WeakPolarHBondContact OE2-CG2 3.42Å; V43-T45 PolarHBondContact O-N 2.93Å; V43-R74 VanDerWaalsContact O-CZ 3.26Å; V43-R74 PolarHBondContact O-NH1 3.16Å; V43-R74 PolarHBondContact O-NH2 3.46Å | ||
| 44 | V | 78.3 | Confident | 80.8 | Confident | 83 Ų | 83 | 85.4 Ų | 85.4 | 50% | 0.503 | 46% | 0.464 | S | S | . | . | trans | -80.1 | 107.1 | 169.1 | 177.2 | 0 | 0 | 0 | 0 | 106.9 | K42 L48 K49 | K42-V44 PolarHBondContact O-N 2.9Å; V44-L48 HydrophobicContact CB-CD2 4.42Å; V44-L48 HydrophobicContact CG1-CB 4.2Å; V44-L48 HydrophobicContact CG1-CD2 4.13Å; V44-L48 HydrophobicContact CG1-CG 4.36Å; V44-L48 HydrophobicContact CG2-CD2 4.39Å; V44-K49 HydrophobicContact CG1-CB 3.98Å | ||
| 45 | T | 84.5 | Confident | 81 | Confident | 37 Ų | 37 | 83.5 Ų | 83.5 | 23% | 0.227 | 46% | 0.459 | C | S | . | . | trans | -69.1 | 156.4 | 177.5 | 65.8 | 0 | 0 | 0 | 0 | 110.1 | V43 L47 L48 K49 | V43-T45 PolarHBondContact O-N 2.93Å; T45-L47 PolarHBondContact O-N 2.94Å; T45-L48 WeakPolarHBondContact O-CB 3.39Å; T45-L48 PolarHBondContact O-N 3.35Å; T45-L48 WeakPolarHBondContact OG1-CB 3.23Å; T45-L48 PolarHBondContact OG1-N 2.99Å; T45-L48 VanDerWaalsContact OG1-N 3.11Å; T45-K49 PolarHBondContact O-N 3.1Å | ||
| 46 | P | 86.1 | Confident | 81.4 | Confident | 106 Ų | 106 | 79.6 Ų | 79.6 | 69% | 0.688 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -53.7 | -37.8 | 173 | -27.4 | 35.4 | 0 | 0 | 0 | 112.5 | K49 T50 | P46-K49 PolarHBondContact O-N 2.95Å; P46-T50 PolarHBondContact O-N 2.85Å; P46-T50 PolarHBondContact O-OG1 3.26Å |
| 47 | L | 87.6 | Confident | 82 | Confident | 73 Ų | 73 | 83.8 Ų | 83.8 | 38% | 0.382 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -61.2 | -49 | 174.3 | 177.2 | 60 | 0 | 0 | 0 | 111.8 | L9 V33 T45 K49 T50 L51 | L9-L47 HydrophobicContact CB-CD1 4.24Å; L9-L47 HydrophobicContact CD2-CD1 3.83Å; V33-L47 HydrophobicContact CG1-CD2 4.15Å; V33-L47 HydrophobicContact CG2-CD2 4.27Å; V33-L47 HydrophobicContact CG2-CG 4.46Å; T45-L47 PolarHBondContact O-N 2.94Å; L47-K49 VanDerWaalsContact C-N 3.31Å; L47-K49 PolarHBondContact O-N 3.08Å; L47-T50 PolarHBondContact O-N 2.75Å; L47-L51 HydrophobicContact CD1-CD1 4.19Å; L47-L51 HydrophobicContact CD1-CG 4.28Å; L47-L51 HydrophobicContact CG-CD1 4.16Å; L47-L51 WeakPolarHBondContact O-CG 3.28Å; L47-L51 PolarHBondContact O-N 3.42Å |
| 48 | L | 89.1 | Confident | 82.8 | Confident | 1 Ų | 1 | 78.3 Ų | 78.3 | 1% | 0.005 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -59.5 | -44.7 | 178.5 | -169.5 | 69.9 | 0 | 0 | 0 | 111 | V44 T45 T50 L51 M52 I58 L76 | V44-L48 HydrophobicContact CB-CD2 4.42Å; V44-L48 HydrophobicContact CG1-CB 4.2Å; V44-L48 HydrophobicContact CG1-CD2 4.13Å; V44-L48 HydrophobicContact CG1-CG 4.36Å; V44-L48 HydrophobicContact CG2-CD2 4.39Å; T45-L48 WeakPolarHBondContact O-CB 3.39Å; T45-L48 PolarHBondContact O-N 3.35Å; T45-L48 WeakPolarHBondContact OG1-CB 3.23Å; T45-L48 PolarHBondContact OG1-N 2.99Å; T45-L48 VanDerWaalsContact OG1-N 3.11Å; L48-T50 VanDerWaalsContact C-N 3.34Å; L48-T50 PolarHBondContact O-N 3.15Å; L48-L51 PolarHBondContact O-N 3.22Å; L48-M52 HydrophobicContact CG-SD 4.23Å; L48-M52 VanDerWaalsContact O-CG 3.27Å; L48-M52 WeakPolarHBondContact O-CG 3.08Å; L48-M52 PolarHBondContact O-N 3.42Å; L48-I58 HydrophobicContact CD2-CD1 4.41Å; L48-L76 HydrophobicContact CD1-CD1 3.48Å; L48-L76 VanDerWaalsContact CD1-CD1 3.48Å; L48-L76 HydrophobicContact CD1-CD2 3.59Å; L48-L76 HydrophobicContact CD1-CG 3.96Å |
| 49 | K | 89.5 | Confident | 83.8 | Confident | 148 Ų | 148 | 75.4 Ų | 75.4 | 64% | 0.643 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -60.6 | -42.7 | 176.6 | -170.3 | 176.7 | 179.6 | 179.3 | 0 | 112 | V44 T45 P46 L47 M52 F53 | V44-K49 HydrophobicContact CG1-CB 3.98Å; T45-K49 PolarHBondContact O-N 3.1Å; P46-K49 PolarHBondContact O-N 2.95Å; L47-K49 VanDerWaalsContact C-N 3.31Å; L47-K49 PolarHBondContact O-N 3.08Å; K49-M52 PolarHBondContact O-N 3.45Å; K49-F53 WeakPolarHBondContact O-CB 3.4Å; K49-F53 PolarHBondContact O-N 3.39Å |
| 50 | T | 91.2 | Very high | 84.9 | Confident | 46 Ų | 46 | 77.4 Ų | 77.4 | 28% | 0.282 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -65.2 | -44.2 | 178.3 | -61.1 | 0 | 0 | 0 | 0 | 111.7 | L9 P46 L47 L48 F53 I54 | L9-T50 HydrophobicContact CD2-CG2 3.87Å; P46-T50 PolarHBondContact O-N 2.85Å; P46-T50 PolarHBondContact O-OG1 3.26Å; L47-T50 PolarHBondContact O-N 2.75Å; L48-T50 VanDerWaalsContact C-N 3.34Å; L48-T50 PolarHBondContact O-N 3.15Å; T50-F53 PolarHBondContact O-N 3.11Å; T50-I54 HydrophobicContact CG2-CD1 3.93Å; T50-I54 WeakPolarHBondContact O-CD1 3.49Å; T50-I54 VanDerWaalsContact O-CG1 3.29Å; T50-I54 WeakPolarHBondContact O-CG1 3.42Å; T50-I54 PolarHBondContact O-N 2.88Å; T50-I54 VanDerWaalsContact O-N 3.15Å |
| 51 | L | 93.4 | Very high | 86.1 | Confident | 4 Ų | 4 | 80.2 Ų | 80.2 | 2% | 0.021 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -60.9 | -46.5 | 176.3 | -68.8 | 168.9 | 0 | 0 | 0 | 110.7 | L9 L14 V31 V33 L47 L48 F53 I54 G55 F56 L76 | L9-L51 HydrophobicContact CD2-CD2 3.96Å; L9-L51 HydrophobicContact CD2-CG 4.4Å; L14-L51 HydrophobicContact CD2-CD2 3.84Å; V31-L51 HydrophobicContact CB-CD1 4.49Å; V31-L51 HydrophobicContact CG1-CD1 3.79Å; V33-L51 HydrophobicContact CG2-CD1 3.66Å; L47-L51 HydrophobicContact CD1-CD1 4.19Å; L47-L51 HydrophobicContact CD1-CG 4.28Å; L47-L51 HydrophobicContact CG-CD1 4.16Å; L47-L51 WeakPolarHBondContact O-CG 3.28Å; L47-L51 PolarHBondContact O-N 3.42Å; L48-L51 PolarHBondContact O-N 3.22Å; L51-F53 VanDerWaalsContact C-N 3.27Å; L51-F53 PolarHBondContact O-N 2.82Å; L51-I54 PolarHBondContact O-N 2.8Å; L51-G55 PolarHBondContact O-N 2.89Å; L51-F56 HydrophobicContact CB-CB 4.04Å; L51-F56 HydrophobicContact CB-CD2 4.14Å; L51-F56 HydrophobicContact CB-CG 4.2Å; L51-F56 HydrophobicContact CD2-CD2 4.02Å; L51-F56 HydrophobicContact CD2-CE2 4.06Å; L51-F56 HydrophobicContact CD2-CG 4.49Å; L51-F56 WeakPolarHBondContact O-CB 3.5Å; L51-F56 WeakPolarHBondContact O-CD2 3.3Å; L51-F56 PolarHBondContact O-N 3.06Å; L51-F56 VanDerWaalsContact O-N 3.08Å; L51-L76 HydrophobicContact CB-CD2 4.13Å; L51-L76 HydrophobicContact CD1-CD1 4.34Å |
| 52 | M | 91.8 | Very high | 87.4 | Confident | 91 Ų | 91 | 77.8 Ų | 77.8 | 45% | 0.448 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -60.5 | -36.9 | 176.7 | -67.8 | 176.5 | 75 | 0 | 0 | 112.8 | L48 K49 I54 G55 F56 L76 | L48-M52 HydrophobicContact CG-SD 4.23Å; L48-M52 VanDerWaalsContact O-CG 3.27Å; L48-M52 WeakPolarHBondContact O-CG 3.08Å; L48-M52 PolarHBondContact O-N 3.42Å; K49-M52 PolarHBondContact O-N 3.45Å; M52-I54 PolarHBondContact O-N 3.07Å; M52-G55 PolarHBondContact O-N 3.05Å; M52-F56 VanDerWaalsContact CA-O 3.29Å; M52-F56 WeakPolarHBondContact CA-O 3.38Å; M52-L76 HydrophobicContact CG-CD2 4.19Å |
| 53 | F | 91.4 | Very high | 88.6 | Confident | 153 Ų | 153 | 69.9 Ų | 69.9 | 67% | 0.671 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -68.9 | -19.7 | 175.2 | -173 | -108.9 | 0 | 0 | 0 | 113.9 | K11 K49 T50 L51 | K11-F53 HydrophobicContact CD-CD1 4.4Å; K49-F53 WeakPolarHBondContact O-CB 3.4Å; K49-F53 PolarHBondContact O-N 3.39Å; T50-F53 PolarHBondContact O-N 3.11Å; L51-F53 VanDerWaalsContact C-N 3.27Å; L51-F53 PolarHBondContact O-N 2.82Å |
| 54 | I | 91 | Very high | 89.5 | Confident | 30 Ų | 30 | 72.1 Ų | 72.1 | 15% | 0.154 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -88.2 | -10.6 | 177.2 | -66.3 | 164.4 | 0 | 0 | 0 | 111.3 | K11 L14 V15 L18 T50 L51 M52 F56 | K11-I54 HydrophobicContact CB-CD1 4.33Å; K11-I54 HydrophobicContact CD-CD1 4.48Å; K11-I54 HydrophobicContact CD-CG1 4.12Å; K11-I54 HydrophobicContact CG-CD1 3.81Å; K11-I54 HydrophobicContact CG-CG1 3.9Å; L14-I54 HydrophobicContact CD2-CD1 3.86Å; V15-I54 HydrophobicContact CG2-CG2 4.01Å; L18-I54 HydrophobicContact CD1-CG2 4.04Å; T50-I54 HydrophobicContact CG2-CD1 3.93Å; T50-I54 WeakPolarHBondContact O-CD1 3.49Å; T50-I54 VanDerWaalsContact O-CG1 3.29Å; T50-I54 WeakPolarHBondContact O-CG1 3.42Å; T50-I54 PolarHBondContact O-N 2.88Å; T50-I54 VanDerWaalsContact O-N 3.15Å; L51-I54 PolarHBondContact O-N 2.8Å; M52-I54 PolarHBondContact O-N 3.07Å; I54-F56 HydrophobicContact CB-CD2 4.44Å; I54-F56 HydrophobicContact CG2-CD2 4.41Å; I54-F56 HydrophobicContact CG2-CE2 4.28Å |
| 55 | G | 92.8 | Very high | 90.1 | Very high | 39 Ų | 39 | 74.5 Ų | 74.5 | 40% | 0.402 | 41% | 0.406 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 110.6 | 12.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | L51 M52 T78 | L51-G55 PolarHBondContact O-N 2.89Å; M52-G55 PolarHBondContact O-N 3.05Å; G55-T78 WeakPolarHBondContact O-CB 3.48Å; G55-T78 PolarHBondContact O-OG1 2.96Å |
| 56 | F | 95.1 | Very high | 90.4 | Very high | 5 Ų | 5 | 74.1 Ų | 74.1 | 2% | 0.022 | 40% | 0.403 | C | S | . | . | trans | -81.8 | 136.3 | 171 | -73.7 | -96.9 | 0 | 0 | 0 | 111.9 | L14 L18 V31 L51 M52 I54 L76 F77 T78 | L14-F56 HydrophobicContact CD2-CE2 4.35Å; L18-F56 HydrophobicContact CD1-CE2 3.83Å; L18-F56 HydrophobicContact CD1-CZ 4.1Å; L18-F56 HydrophobicContact CD2-CZ 4.17Å; V31-F56 HydrophobicContact CB-CE1 4.3Å; V31-F56 HydrophobicContact CG2-CD1 4.24Å; V31-F56 HydrophobicContact CG2-CE1 3.53Å; V31-F56 HydrophobicContact CG2-CZ 3.92Å; L51-F56 HydrophobicContact CB-CB 4.04Å; L51-F56 HydrophobicContact CB-CD2 4.14Å; L51-F56 HydrophobicContact CB-CG 4.2Å; L51-F56 HydrophobicContact CD2-CD2 4.02Å; L51-F56 HydrophobicContact CD2-CE2 4.06Å; L51-F56 HydrophobicContact CD2-CG 4.49Å; L51-F56 WeakPolarHBondContact O-CB 3.5Å; L51-F56 WeakPolarHBondContact O-CD2 3.3Å; L51-F56 PolarHBondContact O-N 3.06Å; L51-F56 VanDerWaalsContact O-N 3.08Å; M52-F56 VanDerWaalsContact CA-O 3.29Å; M52-F56 WeakPolarHBondContact CA-O 3.38Å; I54-F56 HydrophobicContact CB-CD2 4.44Å; I54-F56 HydrophobicContact CG2-CD2 4.41Å; I54-F56 HydrophobicContact CG2-CE2 4.28Å; F56-L76 HydrophobicContact CB-CB 4.1Å; F56-L76 HydrophobicContact CB-CD2 3.86Å; F56-L76 HydrophobicContact CD1-CB 4.09Å; F56-F77 CarbonylContact C-O 3.45Å; F56-F77 VanDerWaalsContact CA-O 3.28Å; F56-F77 WeakPolarHBondContact CA-O 3.42Å; F56-T78 HydrophobicContact CD1-CG2 3.95Å; F56-T78 HydrophobicContact CD2-CG2 4.4Å; F56-T78 HydrophobicContact CE1-CG2 3.54Å; F56-T78 HydrophobicContact CE2-CG2 4.05Å; F56-T78 HydrophobicContact CG-CG2 4.36Å; F56-T78 HydrophobicContact CZ-CG2 3.6Å | ||
| 57 | E | 93.6 | Very high | 90.7 | Very high | 123 Ų | 123 | 73.5 Ų | 73.5 | 58% | 0.575 | 39% | 0.392 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -108.6 | 149.8 | 173.9 | -62.7 | -173.9 | -175.1 | 0 | 0 | 110.7 | L59 L76 F77 | E57-L59 PolarHBondContact O-N 2.96Å; E57-L76 CarbonylContact O-C 3.53Å; E57-L76 WeakPolarHBondContact O-CA 3.34Å; E57-L76 WeakPolarHBondContact O-CB 3.17Å; E57-F77 HydrophobicContact CB-CD1 4.08Å; E57-F77 HydrophobicContact CB-CE1 3.67Å; E57-F77 HydrophobicContact CB-CZ 4.33Å; E57-F77 PolarHBondContact N-O 3.13Å; E57-F77 PolarHBondContact O-N 2.86Å |
| 58 | I | 92.1 | Very high | 90.9 | Very high | 86 Ų | 86 | 74.4 Ų | 74.4 | 44% | 0.441 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.1 | 126.8 | 172.8 | -61.6 | 174.7 | 0 | 0 | 0 | 107.8 | L48 A60 L76 | L48-I58 HydrophobicContact CD2-CD1 4.41Å; I58-A60 PolarHBondContact O-N 3.06Å; I58-A60 VanDerWaalsContact O-N 3.15Å; I58-L76 HydrophobicContact CG1-CD2 4.37Å; I58-L76 HydrophobicContact CG1-CG 4.41Å |
| 59 | L | 91.1 | Very high | 91 | Very high | 27 Ų | 27 | 77.5 Ų | 77.5 | 14% | 0.141 | 42% | 0.421 | C | S | . | . | trans | -66 | 113.7 | 173.7 | -79.6 | 157.3 | 0 | 0 | 0 | 110.3 | Y30 E57 L62 L66 L75 F77 | Y30-L59 HydrophobicContact CD1-CD1 3.66Å; Y30-L59 HydrophobicContact CE1-CD1 3.86Å; Y30-L59 HydrophobicContact CE1-CD2 4.22Å; E57-L59 PolarHBondContact O-N 2.96Å; L59-L62 HydrophobicContact CB-CD2 3.76Å; L59-L62 HydrophobicContact CD1-CD2 4.17Å; L59-L66 HydrophobicContact CD1-CD1 4.45Å; L59-L75 HydrophobicContact CB-CB 4.38Å; L59-L75 HydrophobicContact CD1-CB 3.71Å; L59-L75 PolarHBondContact N-O 3.28Å; L59-F77 HydrophobicContact CD1-CB 4.13Å; L59-F77 HydrophobicContact CD2-CB 4.07Å; L59-F77 HydrophobicContact CD2-CD1 3.58Å; L59-F77 HydrophobicContact CD2-CE1 4.23Å; L59-F77 HydrophobicContact CD2-CG 3.9Å; L59-F77 HydrophobicContact CG-CB 3.96Å; L59-F77 HydrophobicContact CG-CD1 3.67Å; L59-F77 HydrophobicContact CG-CG 4.12Å | ||
| 60 | A | 85.9 | Confident | 91.1 | Very high | 104 Ų | 104 | 72.2 Ų | 72.2 | 86% | 0.86 | 40% | 0.403 | S | S | * | . | S | Bend | trans | -78.5 | -41.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | I58 | I58-A60 PolarHBondContact O-N 3.06Å; I58-A60 VanDerWaalsContact O-N 3.15Å |
| 61 | E | 87.5 | Confident | 91 | Very high | 175 Ų | 175 | 73.4 Ų | 73.4 | 82% | 0.818 | 41% | 0.413 | S | S | * | . | S | Bend | trans | -110 | 128.4 | 174.3 | -67 | -176.6 | -175.2 | 0 | 0 | 109.2 | ||
| 62 | L | 87.7 | Confident | 90.8 | Very high | 54 Ų | 54 | 78.1 Ų | 78.1 | 28% | 0.283 | 44% | 0.438 | S | S | . | . | trans | -98.2 | 129.6 | -172.8 | -68.4 | 175.4 | 0 | 0 | 0 | 110.9 | L59 I67 L75 | L59-L62 HydrophobicContact CB-CD2 3.76Å; L59-L62 HydrophobicContact CD1-CD2 4.17Å; L62-I67 HydrophobicContact CB-CG1 4.18Å; L62-L75 HydrophobicContact CD1-CD1 4.29Å; L62-L75 HydrophobicContact CD2-CB 3.91Å; L62-L75 HydrophobicContact CD2-CD1 3.36Å; L62-L75 HydrophobicContact CD2-CG 4.16Å; L62-L75 HydrophobicContact CG-CD1 4.42Å | ||
| 63 | P | 89 | Confident | 90.8 | Very high | 23 Ų | 23 | 78 Ų | 78 | 15% | 0.149 | 43% | 0.433 | C | S | . | . | trans | -54.8 | 138.8 | 167.2 | -22.6 | 32.4 | 0 | 0 | 0 | 110.3 | Y30 E65 L66 I67 | Y30-P63 HydrophobicContact CE1-CG 4.49Å; P63-E65 HydrophobicContact CB-CG 4.23Å; P63-E65 WeakPolarHBondContact CB-OE1 3.37Å; P63-E65 WeakPolarHBondContact CB-OE2 3.26Å; P63-E65 PolarHBondContact O-N 2.74Å; P63-L66 HydrophobicContact CB-CG 4.34Å; P63-L66 HydrophobicContact CG-CD1 4.09Å; P63-L66 HydrophobicContact CG-CG 4.43Å; P63-L66 PolarHBondContact O-N 3.4Å; P63-I67 PolarHBondContact O-N 3.33Å | ||
| 64 | P | 91.1 | Very high | 90.7 | Very high | 107 Ų | 107 | 72.4 Ų | 72.4 | 70% | 0.695 | 41% | 0.408 | S | S | * | . | G | 310 helix | trans | -49.9 | -36.6 | -177.6 | -29.3 | 35.5 | 0 | 0 | 0 | 114.3 | L66 I67 | P64-L66 VanDerWaalsContact C-N 3.28Å; P64-L66 PolarHBondContact O-N 2.94Å; P64-I67 HydrophobicContact CB-CD1 4.49Å; P64-I67 PolarHBondContact O-N 3.01Å |
| 65 | E | 90.1 | Very high | 90.9 | Very high | 132 Ų | 132 | 71.4 Ų | 71.4 | 62% | 0.617 | 40% | 0.403 | S | S | * | . | G | 310 helix | trans | -68.4 | -21.9 | 178.8 | 65.7 | -84.5 | -162.9 | 0 | 0 | 114.1 | P63 | P63-E65 HydrophobicContact CB-CG 4.23Å; P63-E65 WeakPolarHBondContact CB-OE1 3.37Å; P63-E65 WeakPolarHBondContact CB-OE2 3.26Å; P63-E65 PolarHBondContact O-N 2.74Å |
| 66 | L | 91.7 | Very high | 90.9 | Very high | 30 Ų | 30 | 69.6 Ų | 69.6 | 16% | 0.157 | 38% | 0.384 | C | S | . | . | G | 310 helix | trans | -101.5 | -7.1 | 179.8 | -56.7 | -174.1 | 0 | 0 | 0 | 113.4 | Y30 L59 P63 P64 S68 L69 L75 | Y30-L66 HydrophobicContact CD1-CD1 3.83Å; Y30-L66 HydrophobicContact CD2-CD1 4.36Å; Y30-L66 HydrophobicContact CE1-CD1 4.16Å; Y30-L66 HydrophobicContact CG-CD1 3.92Å; L59-L66 HydrophobicContact CD1-CD1 4.45Å; P63-L66 HydrophobicContact CB-CG 4.34Å; P63-L66 HydrophobicContact CG-CD1 4.09Å; P63-L66 HydrophobicContact CG-CG 4.43Å; P63-L66 PolarHBondContact O-N 3.4Å; P64-L66 VanDerWaalsContact C-N 3.28Å; P64-L66 PolarHBondContact O-N 2.94Å; L66-S68 PolarHBondContact O-N 2.61Å; L66-S68 VanDerWaalsContact O-N 3.17Å; L66-L69 HydrophobicContact CD2-CD1 4.29Å; L66-L69 WeakPolarHBondContact O-CB 3.36Å; L66-L69 PolarHBondContact O-N 3.44Å; L66-L75 HydrophobicContact CB-CD1 3.79Å; L66-L75 WeakPolarHBondContact O-CD1 3.47Å |
| 67 | I | 91.7 | Very high | 90.9 | Very high | 92 Ų | 92 | 71.5 Ų | 71.5 | 47% | 0.472 | 39% | 0.392 | S | S | . | . | G | 310 helix | trans | -55.5 | -37.9 | -177.4 | -68.6 | 177.5 | 0 | 0 | 0 | 111.6 | L62 P63 P64 L69 S70 | L62-I67 HydrophobicContact CB-CG1 4.18Å; P63-I67 PolarHBondContact O-N 3.33Å; P64-I67 HydrophobicContact CB-CD1 4.49Å; P64-I67 PolarHBondContact O-N 3.01Å; I67-L69 PolarHBondContact O-N 2.86Å; I67-S70 VanDerWaalsContact O-CB 3.22Å; I67-S70 WeakPolarHBondContact O-CB 3.32Å; I67-S70 PolarHBondContact O-N 3.39Å; I67-S70 PolarHBondContact O-OG 3.17Å |
| 68 | S | 92.2 | Very high | 91 | Very high | 92 Ų | 92 | 66.3 Ų | 66.3 | 64% | 0.643 | 37% | 0.369 | S | S | * | . | G | 310 helix | trans | -61.2 | -26.2 | -179.9 | 60 | 0 | 0 | 0 | 0 | 113.6 | L66 S71 | L66-S68 PolarHBondContact O-N 2.61Å; L66-S68 VanDerWaalsContact O-N 3.17Å; S68-S71 PolarHBondContact O-OG 3.22Å |
| 69 | L | 92.3 | Very high | 91 | Very high | 66 Ų | 66 | 65.1 Ų | 65.1 | 35% | 0.346 | 36% | 0.363 | S | S | . | . | G | 310 helix | trans | -82.8 | -17.8 | 177.5 | -59.4 | 175.3 | 0 | 0 | 0 | 112.2 | L66 I67 S71 D72 Y73 L75 | L66-L69 HydrophobicContact CD2-CD1 4.29Å; L66-L69 WeakPolarHBondContact O-CB 3.36Å; L66-L69 PolarHBondContact O-N 3.44Å; I67-L69 PolarHBondContact O-N 2.86Å; L69-S71 PolarHBondContact O-N 3.07Å; L69-D72 PolarHBondContact O-N 3.35Å; L69-Y73 HydrophobicContact CB-CD2 4.25Å; L69-Y73 HydrophobicContact CD2-CD2 4.39Å; L69-Y73 HydrophobicContact CD2-CE2 4.48Å; L69-Y73 WeakPolarHBondContact O-CB 3.3Å; L69-Y73 WeakPolarHBondContact O-CD2 3.32Å; L69-Y73 PolarHBondContact O-N 2.82Å; L69-L75 HydrophobicContact CB-CD1 4.25Å; L69-L75 HydrophobicContact CB-CD2 4Å; L69-L75 HydrophobicContact CD1-CD2 4.23Å |
| 70 | S | 89.8 | Confident | 91.1 | Very high | 38 Ų | 38 | 64.6 Ų | 64.6 | 27% | 0.266 | 36% | 0.361 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.5 | -17.4 | -172.3 | 75.5 | 0 | 0 | 0 | 0 | 114.4 | K35 I67 | K35-S70 VanDerWaalsContact CE-O 3.32Å; K35-S70 WeakPolarHBondContact CE-O 3.24Å; K35-S70 PolarHBondContact NZ-O 3.2Å; I67-S70 VanDerWaalsContact O-CB 3.22Å; I67-S70 WeakPolarHBondContact O-CB 3.32Å; I67-S70 PolarHBondContact O-N 3.39Å; I67-S70 PolarHBondContact O-OG 3.17Å |
| 71 | S | 89 | Confident | 91 | Very high | 71 Ų | 71 | 64.6 Ų | 64.6 | 50% | 0.497 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.3 | -52.2 | 173.3 | 45.9 | 0 | 0 | 0 | 0 | 110.4 | K35 S68 L69 | K35-S71 WeakPolarHBondContact CD-O 3.47Å; K35-S71 PolarHBondContact NZ-O 2.96Å; S68-S71 PolarHBondContact O-OG 3.22Å; L69-S71 PolarHBondContact O-N 3.07Å |
| 72 | D | 90.1 | Very high | 89.7 | Confident | 102 Ų | 102 | 66.4 Ų | 66.4 | 55% | 0.545 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.4 | -17.9 | -166.2 | -58.2 | -63.6 | 0 | 0 | 0 | 113.2 | K35 L69 | K35-D72 PolarHBondContact N-O 3.23Å; L69-D72 PolarHBondContact O-N 3.35Å |
| 73 | Y | 91.3 | Very high | 89.8 | Confident | 89 Ų | 89 | 67 Ų | 67 | 35% | 0.349 | 36% | 0.362 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.2 | 148.9 | -174.6 | -57.4 | -93.4 | 0 | 0 | 0 | 112.1 | A32 V33 P34 K35 L69 | A32-Y73 HydrophobicContact CB-CD1 3.81Å; A32-Y73 HydrophobicContact CB-CG 3.9Å; V33-Y73 CarbonylContact O-C 3.51Å; V33-Y73 WeakPolarHBondContact O-CA 2.94Å; P34-Y73 HydrophobicContact CB-CD1 4.4Å; P34-Y73 HydrophobicContact CB-CE1 4.38Å; P34-Y73 HydrophobicContact CG-CD1 4.07Å; P34-Y73 HydrophobicContact CG-CE1 3.82Å; K35-Y73 VanDerWaalsContact CE-O 3.3Å; K35-Y73 WeakPolarHBondContact CE-O 3.42Å; L69-Y73 HydrophobicContact CB-CD2 4.25Å; L69-Y73 HydrophobicContact CD2-CD2 4.39Å; L69-Y73 HydrophobicContact CD2-CE2 4.48Å; L69-Y73 WeakPolarHBondContact O-CB 3.3Å; L69-Y73 WeakPolarHBondContact O-CD2 3.32Å; L69-Y73 PolarHBondContact O-N 2.82Å |
| 74 | R | 90.3 | Very high | 89.9 | Confident | 36 Ų | 36 | 69.3 Ų | 69.3 | 14% | 0.136 | 37% | 0.373 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.9 | 123.3 | 158.6 | -57.2 | -169.5 | -164 | 165.7 | 11 | 107 | V33 K35 P41 V43 | V33-R74 PolarHBondContact N-O 3.13Å; V33-R74 PolarHBondContact O-N 2.91Å; K35-R74 HydrophobicContact CG-CG 3.78Å; P41-R74 VanDerWaalsContact O-CZ 3.26Å; P41-R74 PolarHBondContact O-NH2 2.98Å; V43-R74 VanDerWaalsContact O-CZ 3.26Å; V43-R74 PolarHBondContact O-NH1 3.16Å; V43-R74 PolarHBondContact O-NH2 3.46Å |
| 75 | L | 93.7 | Very high | 89.8 | Confident | 9 Ų | 9 | 67.2 Ų | 67.2 | 5% | 0.047 | 36% | 0.355 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.6 | 132.4 | -178.8 | -60.7 | 174.7 | 0 | 0 | 0 | 108.9 | V31 A32 L59 L62 L66 L69 | V31-L75 WeakPolarHBondContact O-CA 3.29Å; A32-L75 HydrophobicContact CB-CD2 3.55Å; L59-L75 HydrophobicContact CB-CB 4.38Å; L59-L75 HydrophobicContact CD1-CB 3.71Å; L59-L75 PolarHBondContact N-O 3.28Å; L62-L75 HydrophobicContact CD1-CD1 4.29Å; L62-L75 HydrophobicContact CD2-CB 3.91Å; L62-L75 HydrophobicContact CD2-CD1 3.36Å; L62-L75 HydrophobicContact CD2-CG 4.16Å; L62-L75 HydrophobicContact CG-CD1 4.42Å; L66-L75 HydrophobicContact CB-CD1 3.79Å; L66-L75 WeakPolarHBondContact O-CD1 3.47Å; L69-L75 HydrophobicContact CB-CD1 4.25Å; L69-L75 HydrophobicContact CB-CD2 4Å; L69-L75 HydrophobicContact CD1-CD2 4.23Å |
| 76 | L | 94.6 | Very high | 89.8 | Confident | 0 Ų | 0 | 63.4 Ų | 63.4 | 0% | 0 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118 | 153.3 | 173.2 | -63.3 | 95.2 | 0 | 0 | 0 | 109.5 | Y30 V31 V33 L48 L51 M52 F56 E57 I58 | Y30-L76 CarbonylContact C-O 3.56Å; Y30-L76 VanDerWaalsContact CA-O 3.3Å; Y30-L76 WeakPolarHBondContact CA-O 3.47Å; V31-L76 PolarHBondContact N-O 3.04Å; V31-L76 PolarHBondContact O-N 3.05Å; V33-L76 HydrophobicContact CB-CD1 4.28Å; V33-L76 HydrophobicContact CG2-CD1 3.63Å; L48-L76 HydrophobicContact CD1-CD1 3.48Å; L48-L76 VanDerWaalsContact CD1-CD1 3.48Å; L48-L76 HydrophobicContact CD1-CD2 3.59Å; L48-L76 HydrophobicContact CD1-CG 3.96Å; L51-L76 HydrophobicContact CB-CD2 4.13Å; L51-L76 HydrophobicContact CD1-CD1 4.34Å; M52-L76 HydrophobicContact CG-CD2 4.19Å; F56-L76 HydrophobicContact CB-CB 4.1Å; F56-L76 HydrophobicContact CB-CD2 3.86Å; F56-L76 HydrophobicContact CD1-CB 4.09Å; E57-L76 CarbonylContact O-C 3.53Å; E57-L76 WeakPolarHBondContact O-CA 3.34Å; E57-L76 WeakPolarHBondContact O-CB 3.17Å; I58-L76 HydrophobicContact CG1-CD2 4.37Å; I58-L76 HydrophobicContact CG1-CG 4.41Å |
| 77 | F | 94.7 | Very high | 89.7 | Confident | 45 Ų | 45 | 65.5 Ų | 65.5 | 20% | 0.197 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.3 | 158.2 | 171.9 | 85.4 | -72.6 | 0 | 0 | 0 | 110.5 | A29 Y30 F56 E57 L59 | A29-F77 CarbonylContact O-C 3.48Å; A29-F77 VanDerWaalsContact O-CA 3.23Å; A29-F77 WeakPolarHBondContact O-CA 3.49Å; Y30-F77 HydrophobicContact CD1-CB 3.51Å; Y30-F77 HydrophobicContact CE1-CB 3.57Å; Y30-F77 HydrophobicContact CE1-CG 4.46Å; F56-F77 CarbonylContact C-O 3.45Å; F56-F77 VanDerWaalsContact CA-O 3.28Å; F56-F77 WeakPolarHBondContact CA-O 3.42Å; E57-F77 HydrophobicContact CB-CD1 4.08Å; E57-F77 HydrophobicContact CB-CE1 3.67Å; E57-F77 HydrophobicContact CB-CZ 4.33Å; E57-F77 PolarHBondContact N-O 3.13Å; E57-F77 PolarHBondContact O-N 2.86Å; L59-F77 HydrophobicContact CD1-CB 4.13Å; L59-F77 HydrophobicContact CD2-CB 4.07Å; L59-F77 HydrophobicContact CD2-CD1 3.58Å; L59-F77 HydrophobicContact CD2-CE1 4.23Å; L59-F77 HydrophobicContact CD2-CG 3.9Å; L59-F77 HydrophobicContact CG-CB 3.96Å; L59-F77 HydrophobicContact CG-CD1 3.67Å; L59-F77 HydrophobicContact CG-CG 4.12Å |
| 78 | T | 94.8 | Very high | 89.6 | Confident | 14 Ų | 14 | 63.7 Ų | 63.7 | 9% | 0.086 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.1 | 141.9 | 165.7 | -170.3 | 0 | 0 | 0 | 0 | 107.3 | K28 A29 G55 F56 L80 | K28-T78 WeakPolarHBondContact CA-O 3.22Å; A29-T78 HydrophobicContact CB-CG2 4.01Å; A29-T78 PolarHBondContact N-O 3.2Å; A29-T78 VanDerWaalsContact N-O 3.1Å; A29-T78 PolarHBondContact O-N 3.38Å; G55-T78 WeakPolarHBondContact O-CB 3.48Å; G55-T78 PolarHBondContact O-OG1 2.96Å; F56-T78 HydrophobicContact CD1-CG2 3.95Å; F56-T78 HydrophobicContact CD2-CG2 4.4Å; F56-T78 HydrophobicContact CE1-CG2 3.54Å; F56-T78 HydrophobicContact CE2-CG2 4.05Å; F56-T78 HydrophobicContact CG-CG2 4.36Å; F56-T78 HydrophobicContact CZ-CG2 3.6Å; T78-L80 HydrophobicContact CG2-CD2 3.83Å; T78-L80 HydrophobicContact CG2-CG 4.46Å |
| 79 | D | 93.2 | Very high | 89.4 | Confident | 61 Ų | 61 | 61.7 Ų | 61.7 | 33% | 0.326 | 32% | 0.321 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.6 | 130.3 | 167.6 | -153.1 | -47.7 | 0 | 0 | 0 | 107.5 | K28 H81 | K28-D79 WeakPolarHBondContact CE-OD2 3.47Å; D79-H81 PolarHBondContact OD1-N 3.2Å |
| 80 | L | 92.1 | Very high | 89.1 | Confident | 17 Ų | 17 | 61.4 Ų | 61.4 | 9% | 0.089 | 32% | 0.319 | C | S | . | . | S | Bend | trans | -96.1 | -5.2 | -178.7 | -62 | -179 | 0 | 0 | 0 | 111.8 | L18 L21 E22 V26 N27 A29 T78 | L18-L80 HydrophobicContact CB-CD2 3.93Å; L18-L80 HydrophobicContact CD2-CD2 4.17Å; L18-L80 HydrophobicContact CG-CD2 4.43Å; L21-L80 HydrophobicContact CB-CD1 4.15Å; E22-L80 HydrophobicContact CB-CB 4.15Å; E22-L80 HydrophobicContact CG-CB 4.18Å; E22-L80 VanDerWaalsContact CG-O 3.23Å; E22-L80 WeakPolarHBondContact CG-O 3.36Å; E22-L80 VanDerWaalsContact OE1-O 3.06Å; V26-L80 HydrophobicContact CG1-CD1 4.37Å; N27-L80 PolarHBondContact O-N 3Å; A29-L80 HydrophobicContact CB-CD1 4.38Å; T78-L80 HydrophobicContact CG2-CD2 3.83Å; T78-L80 HydrophobicContact CG2-CG 4.46Å |
| 81 | H | 84 | Confident | 89.1 | Confident | 104 Ų | 104 | 63.3 Ų | 63.3 | 48% | 0.481 | 32% | 0.324 | S | S | . | . | trans | -94.3 | 3.2 | -176.7 | -87.3 | -36.6 | 0 | 0 | 0 | 115.9 | N27 D79 | N27-H81 VanDerWaalsContact CB-CD2 3.42Å; N27-H81 WeakPolarHBondContact CB-CD2 3.48Å; N27-H81 PolarHBondContact ND2-CD2 2.65Å; N27-H81 PolarHBondContact ND2-NE2 3Å; N27-H81 PolarHBondContact OD1-NE2 3.18Å; D79-H81 PolarHBondContact OD1-N 3.2Å | ||
| 82 | D | 61.4 | Low | 89.1 | Confident | 212 Ų | 212 | 62.6 Ų | 62.6 | 100% | 1.134 | 31% | 0.308 | S | S | * | . | trans | -86.2 | 0 | 178.9 | -99.3 | -13.2 | 0 | 0 | 0 | 113.5 |
Retrieved 82 of 82 residues in 114.5 ms
(Link to these results)