| 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 | 60.8 | Low | 75.5 | Confident | 215 Ų | 215 | 108.5 Ų | 108.5 | 100% | 1.059 | 61% | 0.605 | S | S | * | * | 0 | -33.1 | 0 | -67.3 | 177.1 | -163.2 | 0 | 0 | 113.1 | |||||
| 2 | V | 64.7 | Low | 76.7 | Confident | 102 Ų | 102 | 107.1 Ų | 107.1 | 62% | 0.618 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -71.2 | -32.4 | -178.6 | -170.6 | 0 | 0 | 0 | 0 | 113.9 | F5 M6 | V2-F5 WeakPolarHBondContact O-CB 3.42Å; V2-F5 PolarHBondContact O-N 2.91Å; V2-M6 HydrophobicContact CG1-CG 4.45Å; V2-M6 HydrophobicContact CG1-SD 4.33Å; V2-M6 PolarHBondContact O-N 3.48Å |
| 3 | S | 67.6 | Low | 77.4 | Confident | 100 Ų | 100 | 104 Ų | 104 | 70% | 0.699 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -69.1 | -35.9 | -175.9 | -41.8 | 0 | 0 | 0 | 0 | 114.4 | F5 G7 | S3-F5 VanDerWaalsContact C-N 3.33Å; S3-G7 PolarHBondContact O-N 3.31Å; S3-G7 VanDerWaalsContact O-N 3.08Å |
| 4 | H | 67.6 | Low | 78 | Confident | 166 Ų | 166 | 105.6 Ų | 105.6 | 77% | 0.769 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -70.9 | -32.8 | 175 | -70.4 | -82.9 | 0 | 0 | 0 | 111.8 | S8 | H4-S8 WeakPolarHBondContact O-CB 3.38Å; H4-S8 PolarHBondContact O-N 3.47Å |
| 5 | F | 72.2 | Confident | 78.5 | Confident | 139 Ų | 139 | 105.9 Ų | 105.9 | 61% | 0.61 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -69 | -45.1 | 177.6 | -173.3 | -104.2 | 0 | 0 | 0 | 111.5 | V2 S3 G7 S8 L9 | V2-F5 WeakPolarHBondContact O-CB 3.42Å; V2-F5 PolarHBondContact O-N 2.91Å; S3-F5 VanDerWaalsContact C-N 3.33Å; F5-G7 VanDerWaalsContact C-N 3.34Å; F5-G7 PolarHBondContact O-N 3.01Å; F5-S8 PolarHBondContact O-N 3.27Å; F5-L9 HydrophobicContact CD1-CD1 3.92Å; F5-L9 HydrophobicContact CE1-CD1 3.56Å; F5-L9 HydrophobicContact CE1-CG 4.47Å; F5-L9 HydrophobicContact CZ-CD1 4.05Å; F5-L9 WeakPolarHBondContact O-CG 3.48Å; F5-L9 PolarHBondContact O-N 2.95Å; F5-L9 VanDerWaalsContact O-N 3.13Å |
| 6 | M | 72.5 | Confident | 78.8 | Confident | 130 Ų | 130 | 107.4 Ų | 107.4 | 64% | 0.64 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -66.3 | -34.6 | 174.6 | -69.6 | -174.7 | 75.9 | 0 | 0 | 112.8 | V2 S10 | V2-M6 HydrophobicContact CG1-CG 4.45Å; V2-M6 HydrophobicContact CG1-SD 4.33Å; V2-M6 PolarHBondContact O-N 3.48Å; M6-S10 WeakPolarHBondContact O-CB 3.29Å; M6-S10 PolarHBondContact O-N 3.33Å; M6-S10 VanDerWaalsContact O-N 3.12Å |
| 7 | G | 79.3 | Confident | 78.8 | Confident | 36 Ų | 36 | 107.1 Ų | 107.1 | 37% | 0.371 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -64.1 | -44.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | S3 F5 S10 V11 | S3-G7 PolarHBondContact O-N 3.31Å; S3-G7 VanDerWaalsContact O-N 3.08Å; F5-G7 VanDerWaalsContact C-N 3.34Å; F5-G7 PolarHBondContact O-N 3.01Å; G7-S10 WeakPolarHBondContact O-CB 3.34Å; G7-S10 PolarHBondContact O-N 2.96Å; G7-V11 WeakPolarHBondContact O-CG2 3.43Å; G7-V11 PolarHBondContact O-N 3.42Å |
| 8 | S | 85.4 | Confident | 78.6 | Confident | 66 Ų | 66 | 107.5 Ų | 107.5 | 46% | 0.462 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -62.4 | -44.4 | 178.4 | -177 | 0 | 0 | 0 | 0 | 112.6 | H4 F5 S10 V11 L12 | H4-S8 WeakPolarHBondContact O-CB 3.38Å; H4-S8 PolarHBondContact O-N 3.47Å; F5-S8 PolarHBondContact O-N 3.27Å; S8-S10 VanDerWaalsContact C-N 3.31Å; S8-S10 PolarHBondContact O-N 3.46Å; S8-V11 PolarHBondContact O-N 3.35Å; S8-L12 WeakPolarHBondContact O-CB 3.47Å; S8-L12 WeakPolarHBondContact O-CG 3.5Å; S8-L12 PolarHBondContact O-N 3.48Å |
| 9 | L | 86 | Confident | 78.5 | Confident | 91 Ų | 91 | 103.6 Ų | 103.6 | 48% | 0.476 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -63.4 | -37.3 | 176.2 | -70 | 171.8 | 0 | 0 | 0 | 112.2 | F5 C13 | F5-L9 HydrophobicContact CD1-CD1 3.92Å; F5-L9 HydrophobicContact CE1-CD1 3.56Å; F5-L9 HydrophobicContact CE1-CG 4.47Å; F5-L9 HydrophobicContact CZ-CD1 4.05Å; F5-L9 WeakPolarHBondContact O-CG 3.48Å; F5-L9 PolarHBondContact O-N 2.95Å; F5-L9 VanDerWaalsContact O-N 3.13Å; L9-C13 WeakPolarHBondContact O-CB 3.45Å; L9-C13 PolarHBondContact O-N 3.13Å |
| 10 | S | 86.6 | Confident | 77.9 | Confident | 59 Ų | 59 | 105.2 Ų | 105.2 | 41% | 0.413 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -64.6 | -47.5 | 176.5 | -164.8 | 0 | 0 | 0 | 0 | 111 | M6 G7 S8 L12 C13 F14 | M6-S10 WeakPolarHBondContact O-CB 3.29Å; M6-S10 PolarHBondContact O-N 3.33Å; M6-S10 VanDerWaalsContact O-N 3.12Å; G7-S10 WeakPolarHBondContact O-CB 3.34Å; G7-S10 PolarHBondContact O-N 2.96Å; S8-S10 VanDerWaalsContact C-N 3.31Å; S8-S10 PolarHBondContact O-N 3.46Å; S10-L12 PolarHBondContact O-N 2.99Å; S10-C13 WeakPolarHBondContact O-CB 3.34Å; S10-C13 PolarHBondContact O-N 3.03Å; S10-F14 WeakPolarHBondContact O-CD2 3.48Å; S10-F14 PolarHBondContact O-N 3.05Å; S10-F14 WeakPolarHBondContact OG-CE2 3.16Å |
| 11 | V | 88.1 | Confident | 77.3 | Confident | 89 Ų | 89 | 107 Ų | 107 | 54% | 0.539 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -62.2 | -43.4 | 177.7 | 175.8 | 0 | 0 | 0 | 0 | 111.7 | G7 S8 C13 F14 L15 | G7-V11 WeakPolarHBondContact O-CG2 3.43Å; G7-V11 PolarHBondContact O-N 3.42Å; S8-V11 PolarHBondContact O-N 3.35Å; V11-C13 VanDerWaalsContact C-N 3.34Å; V11-C13 PolarHBondContact O-N 3Å; V11-F14 PolarHBondContact O-N 3.26Å; V11-L15 HydrophobicContact CG1-CD1 4.13Å; V11-L15 HydrophobicContact CG1-CG 4.45Å; V11-L15 WeakPolarHBondContact O-CG 3.45Å; V11-L15 PolarHBondContact O-N 3.08Å |
| 12 | L | 89.1 | Confident | 77.4 | Confident | 92 Ų | 92 | 106 Ų | 106 | 48% | 0.482 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -60.9 | -42.3 | 175.5 | -79 | 163.1 | 0 | 0 | 0 | 112.1 | S8 S10 L15 L16 | S8-L12 WeakPolarHBondContact O-CB 3.47Å; S8-L12 WeakPolarHBondContact O-CG 3.5Å; S8-L12 PolarHBondContact O-N 3.48Å; S10-L12 PolarHBondContact O-N 2.99Å; L12-L15 PolarHBondContact O-N 2.97Å; L12-L16 VanDerWaalsContact O-CG 3.29Å; L12-L16 WeakPolarHBondContact O-CG 3.46Å; L12-L16 PolarHBondContact O-N 3.45Å |
| 13 | C | 86.1 | Confident | 77.4 | Confident | 67 Ų | 67 | 106.6 Ų | 106.6 | 45% | 0.453 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -61.9 | -44.7 | 175.6 | -171.6 | 0 | 0 | 0 | 0 | 111.6 | L9 S10 V11 L15 L16 L17 | L9-C13 WeakPolarHBondContact O-CB 3.45Å; L9-C13 PolarHBondContact O-N 3.13Å; S10-C13 WeakPolarHBondContact O-CB 3.34Å; S10-C13 PolarHBondContact O-N 3.03Å; V11-C13 VanDerWaalsContact C-N 3.34Å; V11-C13 PolarHBondContact O-N 3Å; C13-L15 PolarHBondContact O-N 2.87Å; C13-L16 PolarHBondContact O-N 3.14Å; C13-L17 WeakPolarHBondContact O-CB 3.33Å; C13-L17 VanDerWaalsContact O-CG 3.29Å; C13-L17 WeakPolarHBondContact O-CG 3.22Å; C13-L17 PolarHBondContact O-N 3.45Å |
| 14 | F | 86.3 | Confident | 76.7 | Confident | 126 Ų | 126 | 104.7 Ų | 104.7 | 55% | 0.553 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.2 | -43.4 | 175.8 | -80.5 | -68 | 0 | 0 | 0 | 112.5 | S10 V11 L16 L17 L18 | S10-F14 WeakPolarHBondContact O-CD2 3.48Å; S10-F14 PolarHBondContact O-N 3.05Å; S10-F14 WeakPolarHBondContact OG-CE2 3.16Å; V11-F14 PolarHBondContact O-N 3.26Å; F14-L16 VanDerWaalsContact C-N 3.35Å; F14-L16 PolarHBondContact O-N 2.95Å; F14-L17 PolarHBondContact O-N 3.28Å; F14-L18 WeakPolarHBondContact O-CB 3.45Å; F14-L18 WeakPolarHBondContact O-CG 3.06Å; F14-L18 PolarHBondContact O-N 3.23Å |
| 15 | L | 85.2 | Confident | 76.2 | Confident | 110 Ų | 110 | 102.3 Ų | 102.3 | 58% | 0.576 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.9 | -38.1 | 178 | -68.7 | 174.1 | 0 | 0 | 0 | 112.3 | V11 L12 C13 G19 | V11-L15 HydrophobicContact CG1-CD1 4.13Å; V11-L15 HydrophobicContact CG1-CG 4.45Å; V11-L15 WeakPolarHBondContact O-CG 3.45Å; V11-L15 PolarHBondContact O-N 3.08Å; L12-L15 PolarHBondContact O-N 2.97Å; C13-L15 PolarHBondContact O-N 2.87Å; L15-G19 PolarHBondContact O-N 3.39Å |
| 16 | L | 83.6 | Confident | 74.8 | Confident | 131 Ų | 131 | 103.7 Ų | 103.7 | 69% | 0.686 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -67.6 | -42.5 | 175.3 | -70.4 | 171.5 | 0 | 0 | 0 | 112.1 | L12 C13 F14 G19 F20 | L12-L16 VanDerWaalsContact O-CG 3.29Å; L12-L16 WeakPolarHBondContact O-CG 3.46Å; L12-L16 PolarHBondContact O-N 3.45Å; C13-L16 PolarHBondContact O-N 3.14Å; F14-L16 VanDerWaalsContact C-N 3.35Å; F14-L16 PolarHBondContact O-N 2.95Å; L16-G19 PolarHBondContact O-N 3.47Å; L16-F20 WeakPolarHBondContact O-CB 3.46Å; L16-F20 PolarHBondContact O-N 2.99Å |
| 17 | L | 78.1 | Confident | 73.7 | Confident | 101 Ų | 101 | 102.6 Ų | 102.6 | 53% | 0.529 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -65.9 | -43.8 | 176.9 | -70.1 | 173 | 0 | 0 | 0 | 111.9 | C13 F14 F20 Q21 | C13-L17 WeakPolarHBondContact O-CB 3.33Å; C13-L17 VanDerWaalsContact O-CG 3.29Å; C13-L17 WeakPolarHBondContact O-CG 3.22Å; C13-L17 PolarHBondContact O-N 3.45Å; F14-L17 PolarHBondContact O-N 3.28Å; L17-F20 PolarHBondContact O-N 3.36Å; L17-Q21 WeakPolarHBondContact O-CG 3.32Å; L17-Q21 PolarHBondContact O-N 3.03Å |
| 18 | L | 75.1 | Confident | 72.5 | Confident | 115 Ų | 115 | 105.1 Ų | 105.1 | 60% | 0.602 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65.3 | -40 | 176 | -70.6 | 173.9 | 0 | 0 | 0 | 111.6 | F14 Q21 F22 | F14-L18 WeakPolarHBondContact O-CB 3.45Å; F14-L18 WeakPolarHBondContact O-CG 3.06Å; F14-L18 PolarHBondContact O-N 3.23Å; L18-Q21 PolarHBondContact O-N 3.34Å; L18-F22 WeakPolarHBondContact O-CB 3.41Å; L18-F22 PolarHBondContact O-N 2.94Å |
| 19 | G | 76.6 | Confident | 70.9 | Confident | 33 Ų | 33 | 108.2 Ų | 108.2 | 34% | 0.34 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -63.5 | -39 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | L15 L16 F22 V23 | L15-G19 PolarHBondContact O-N 3.39Å; L16-G19 PolarHBondContact O-N 3.47Å; G19-F22 PolarHBondContact O-N 3.45Å; G19-V23 WeakPolarHBondContact O-CB 3.45Å; G19-V23 WeakPolarHBondContact O-CG2 3.29Å; G19-V23 PolarHBondContact O-N 3.47Å |
| 20 | F | 67.1 | Low | 69.2 | Low | 135 Ų | 135 | 111.1 Ų | 111.1 | 59% | 0.592 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -67.4 | -38.5 | 176.3 | -167 | -100.4 | 0 | 0 | 0 | 112.1 | L16 L17 F22 V23 C24 | L16-F20 WeakPolarHBondContact O-CB 3.46Å; L16-F20 PolarHBondContact O-N 2.99Å; L17-F20 PolarHBondContact O-N 3.36Å; F20-F22 VanDerWaalsContact C-N 3.3Å; F20-F22 PolarHBondContact O-N 2.88Å; F20-V23 PolarHBondContact O-N 3.36Å; F20-C24 PolarHBondContact O-N 3.37Å; F20-C24 VanDerWaalsContact O-N 3.14Å; F20-C24 PolarHBondContact O-SG 2.96Å |
| 21 | Q | 65.3 | Low | 67.5 | Low | 145 Ų | 145 | 116.2 Ų | 116.2 | 68% | 0.678 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -66.1 | -31 | 172.3 | -68.4 | -66.7 | -39.6 | 0 | 0 | 112.7 | L17 L18 | L17-Q21 WeakPolarHBondContact O-CG 3.32Å; L17-Q21 PolarHBondContact O-N 3.03Å; L18-Q21 PolarHBondContact O-N 3.34Å |
| 22 | F | 62.8 | Low | 65.9 | Low | 192 Ų | 192 | 121.8 Ų | 121.8 | 84% | 0.842 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -81.6 | -25.6 | 178.9 | -143.2 | -93.4 | 0 | 0 | 0 | 113.2 | L18 G19 F20 | L18-F22 WeakPolarHBondContact O-CB 3.41Å; L18-F22 PolarHBondContact O-N 2.94Å; G19-F22 PolarHBondContact O-N 3.45Å; F20-F22 VanDerWaalsContact C-N 3.3Å; F20-F22 PolarHBondContact O-N 2.88Å |
| 23 | V | 65.6 | Low | 64.1 | Low | 116 Ų | 116 | 125.6 Ų | 125.6 | 70% | 0.703 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -84.5 | -28.3 | 177.5 | 162.6 | 0 | 0 | 0 | 0 | 112.5 | G19 F20 P25 | G19-V23 WeakPolarHBondContact O-CB 3.45Å; G19-V23 WeakPolarHBondContact O-CG2 3.29Å; G19-V23 PolarHBondContact O-N 3.47Å; F20-V23 PolarHBondContact O-N 3.36Å; V23-P25 WeakPolarHBondContact O-CD 3.48Å |
| 24 | C | 53 | Low | 62.7 | Low | 60 Ų | 60 | 128 Ų | 128 | 41% | 0.405 | 66% | 0.661 | S | S | . | * | S | Bend | trans | -71.9 | 110.7 | 170.8 | -69 | 0 | 0 | 0 | 0 | 109.1 | F20 Q26 | F20-C24 PolarHBondContact O-N 3.37Å; F20-C24 VanDerWaalsContact O-N 3.14Å; F20-C24 PolarHBondContact O-SG 2.96Å; C24-Q26 PolarHBondContact O-N 3.24Å |
| 25 | P | 56 | Low | 60.9 | Low | 116 Ų | 116 | 126.5 Ų | 126.5 | 75% | 0.753 | 66% | 0.664 | S | S | * | * | trans | -61 | 137.7 | 165.4 | -1 | 18.5 | 0 | 0 | 0 | 106 | V23 | V23-P25 WeakPolarHBondContact O-CD 3.48Š| ||
| 26 | Q | 43.6 | Very low | 59.1 | Low | 168 Ų | 168 | 129 Ų | 129 | 79% | 0.785 | 67% | 0.672 | S | S | * | * | trans | -17.6 | 121.2 | 168.9 | -63.9 | -75 | -24.7 | 0 | 0 | 111.9 | C24 S28 | C24-Q26 PolarHBondContact O-N 3.24Å; Q26-S28 PolarHBondContact O-N 3.05Å | ||
| 27 | P | 49.9 | Very low | 57.4 | Low | 107 Ų | 107 | 133.4 Ų | 133.4 | 70% | 0.695 | 68% | 0.68 | S | S | * | * | trans | -62.7 | 90 | 162.5 | 26.5 | -30.8 | 0 | 0 | 0 | 106.3 | T29 | P27-T29 PolarHBondContact O-N 2.94Š| ||
| 28 | S | 53 | Low | 55.5 | Low | 89 Ų | 89 | 136.7 Ų | 136.7 | 62% | 0.622 | 70% | 0.695 | S | S | * | * | trans | -73.6 | 67.4 | 176.6 | -179.1 | 0 | 0 | 0 | 0 | 108 | Q26 Q30 | Q26-S28 PolarHBondContact O-N 3.05Å; S28-Q30 PolarHBondContact O-N 3.42Å | ||
| 29 | T | 52.9 | Low | 54.2 | Low | 130 Ų | 130 | 135.2 Ų | 135.2 | 80% | 0.798 | 70% | 0.699 | S | S | * | * | trans | -71.8 | -3.4 | 164.9 | 54.2 | 0 | 0 | 0 | 0 | 111.4 | P27 H31 | P27-T29 PolarHBondContact O-N 2.94Å; T29-H31 PolarHBondContact O-N 3.22Å | ||
| 30 | Q | 49.3 | Very low | 52.8 | Low | 153 Ų | 153 | 138.1 Ų | 138.1 | 72% | 0.715 | 72% | 0.72 | S | S | * | * | trans | -79.3 | 60.7 | 161 | -65.5 | -98.7 | 30.8 | 0 | 0 | 109.2 | S28 R32 | S28-Q30 PolarHBondContact O-N 3.42Å; Q30-R32 PolarHBondContact O-N 3.12Å | ||
| 31 | H | 51 | Low | 51.9 | Low | 166 Ų | 166 | 141 Ų | 141 | 77% | 0.769 | 74% | 0.735 | S | S | * | * | trans | -58.2 | 90.4 | 143.4 | -119.4 | -117.4 | 0 | 0 | 0 | 103.4 | T29 K33 | T29-H31 PolarHBondContact O-N 3.22Å; H31-K33 PolarHBondContact O-N 3.47Å | ||
| 32 | R | 54.3 | Low | 51.2 | Low | 205 Ų | 205 | 136.9 Ų | 136.9 | 77% | 0.774 | 73% | 0.731 | S | S | * | * | trans | -60 | 89.4 | 172.3 | -176.2 | 159.2 | 177.6 | 117.7 | -7 | 103.8 | Q30 V34 | Q30-R32 PolarHBondContact O-N 3.12Å; R32-V34 VanDerWaalsContact C-N 3.27Å; R32-V34 PolarHBondContact O-N 2.86Å | ||
| 33 | K | 51.7 | Low | 50.6 | Low | 173 Ų | 173 | 132 Ų | 132 | 75% | 0.752 | 73% | 0.726 | S | S | * | * | trans | -50.9 | 106.7 | 171 | -170.3 | 155.3 | -173.5 | 172.6 | 0 | 102.1 | H31 P35 | H31-K33 PolarHBondContact O-N 3.47Å; K33-P35 WeakPolarHBondContact O-CD 3.46Å | ||
| 34 | V | 56.7 | Low | 49.9 | Very low | 117 Ų | 117 | 132 Ų | 132 | 71% | 0.709 | 73% | 0.729 | S | S | * | * | trans | -44.9 | 118.5 | 174.2 | 176.2 | 0 | 0 | 0 | 0 | 103.2 | R32 Q36 | R32-V34 VanDerWaalsContact C-N 3.27Å; R32-V34 PolarHBondContact O-N 2.86Å; V34-Q36 PolarHBondContact O-N 2.95Å | ||
| 35 | P | 48.5 | Very low | 50.3 | Low | 95 Ų | 95 | 138.9 Ų | 138.9 | 62% | 0.617 | 76% | 0.755 | S | S | * | * | trans | -50.1 | 114.3 | -179.4 | -24.9 | 31.9 | 0 | 0 | 0 | 104.9 | K33 R37 | K33-P35 WeakPolarHBondContact O-CD 3.46Å; P35-R37 PolarHBondContact O-N 3.03Å | ||
| 36 | Q | 46.8 | Very low | 50.1 | Low | 161 Ų | 161 | 140.7 Ų | 140.7 | 75% | 0.752 | 76% | 0.758 | S | S | * | * | trans | -51.7 | 116.6 | 171.4 | -78.2 | -83.5 | -26.6 | 0 | 0 | 102.9 | V34 M38 | V34-Q36 PolarHBondContact O-N 2.95Å; Q36-M38 VanDerWaalsContact C-N 3.3Å; Q36-M38 PolarHBondContact O-N 2.83Å | ||
| 37 | R | 48.3 | Very low | 51.3 | Low | 225 Ų | 225 | 140.2 Ų | 140.2 | 85% | 0.849 | 76% | 0.761 | S | S | * | * | trans | -48.5 | 106.4 | 179.6 | -178.3 | 179.4 | -161.7 | 141.7 | 3.3 | 104.4 | P35 A39 | P35-R37 PolarHBondContact O-N 3.03Å; R37-A39 PolarHBondContact O-N 3.37Å | ||
| 38 | M | 38.6 | Very low | 51.6 | Low | 170 Ų | 170 | 138.9 Ų | 138.9 | 84% | 0.837 | 77% | 0.767 | S | S | * | * | trans | -50.1 | 120.8 | -172.8 | -69.4 | 171.1 | 174.5 | 0 | 0 | 104.8 | Q36 A40 | Q36-M38 VanDerWaalsContact C-N 3.3Å; Q36-M38 PolarHBondContact O-N 2.83Å; M38-A40 VanDerWaalsContact C-N 3.33Å; M38-A40 PolarHBondContact O-N 2.69Å | ||
| 39 | A | 47.8 | Very low | 51.7 | Low | 83 Ų | 83 | 138 Ų | 138 | 69% | 0.686 | 77% | 0.772 | S | S | * | * | trans | -53.7 | 112.9 | 168.8 | 0 | 0 | 0 | 0 | 0 | 103.7 | R37 E41 | R37-A39 PolarHBondContact O-N 3.37Å; A39-E41 PolarHBondContact O-N 2.75Å | ||
| 40 | A | 45.8 | Very low | 52 | Low | 94 Ų | 94 | 136.3 Ų | 136.3 | 78% | 0.777 | 78% | 0.781 | S | S | * | * | trans | -65.9 | 85.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 105.8 | M38 G42 | M38-A40 VanDerWaalsContact C-N 3.33Å; M38-A40 PolarHBondContact O-N 2.69Å; A40-G42 VanDerWaalsContact C-N 3.34Å; A40-G42 PolarHBondContact O-N 2.79Å | ||
| 41 | E | 50 | Low | 52.7 | Low | 195 Ų | 195 | 132.3 Ų | 132.3 | 91% | 0.911 | 78% | 0.78 | S | S | * | * | trans | -69.8 | 101.7 | 152.8 | -90.4 | 173.9 | 112.2 | 0 | 0 | 105.3 | A39 | A39-E41 PolarHBondContact O-N 2.75Š| ||
| 42 | G | 49.5 | Very low | 53.5 | Low | 59 Ų | 59 | 126.2 Ų | 126.2 | 61% | 0.608 | 76% | 0.758 | S | S | * | * | trans | 139.5 | 76.2 | -176.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | A40 P44 | A40-G42 VanDerWaalsContact C-N 3.34Å; A40-G42 PolarHBondContact O-N 2.79Å; G42-P44 WeakPolarHBondContact O-CD 3.44Å | ||
| 43 | A | 49.7 | Very low | 54.4 | Low | 89 Ų | 89 | 121.9 Ų | 121.9 | 74% | 0.736 | 76% | 0.757 | S | S | * | * | trans | -71.3 | 123.1 | 156.4 | 0 | 0 | 0 | 0 | 0 | 106.9 | E45 | A43-E45 PolarHBondContact O-N 2.77Š| ||
| 44 | P | 52.1 | Low | 55.6 | Low | 116 Ų | 116 | 116.1 Ų | 116.1 | 75% | 0.753 | 75% | 0.746 | S | S | * | * | trans | -64.4 | 121.7 | 160.2 | 25.9 | -28.7 | 0 | 0 | 0 | 107.2 | G42 D46 | G42-P44 WeakPolarHBondContact O-CD 3.44Å; P44-D46 VanDerWaalsContact C-N 3.29Å; P44-D46 PolarHBondContact O-N 3.35Å | ||
| 45 | E | 61.1 | Low | 56.9 | Low | 206 Ų | 206 | 111.6 Ų | 111.6 | 96% | 0.963 | 72% | 0.719 | S | S | * | * | trans | -68.7 | 92.3 | 166 | -59.9 | -177.8 | 123.8 | 0 | 0 | 106.7 | A43 | A43-E45 PolarHBondContact O-N 2.77Š| ||
| 46 | D | 52.3 | Low | 58.5 | Low | 153 Ų | 153 | 113.3 Ų | 113.3 | 82% | 0.818 | 71% | 0.713 | S | S | * | * | trans | -105.4 | 123 | 174.4 | -169.9 | 49.4 | 0 | 0 | 0 | 109.6 | P44 | P44-D46 VanDerWaalsContact C-N 3.29Å; P44-D46 PolarHBondContact O-N 3.35Å | ||
| 47 | D | 67.5 | Low | 60.2 | Low | 159 Ų | 159 | 106 Ų | 106 | 85% | 0.85 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -69 | 126.8 | -175 | -171.5 | -105.7 | 0 | 0 | 0 | 110.7 | ||
| 48 | G | 57.3 | Low | 61.7 | Low | 78 Ų | 78 | 97 Ų | 97 | 80% | 0.804 | 66% | 0.655 | S | S | * | * | S | Bend | trans | 107.9 | 71.9 | 164.6 | 0 | 0 | 0 | 0 | 0 | 117 | ||
| 49 | G | 54 | Low | 63.8 | Low | 72 Ų | 72 | 95.2 Ų | 95.2 | 74% | 0.742 | 64% | 0.639 | S | S | * | * | trans | 144.6 | 90.9 | 162.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | G51 | G49-G51 PolarHBondContact O-N 2.98Š| ||
| 50 | G | 60.4 | Low | 65.4 | Low | 94 Ų | 94 | 92.8 Ų | 92.8 | 97% | 0.969 | 62% | 0.622 | S | S | * | * | trans | -65 | 58.6 | -174.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | A52 | G50-A52 PolarHBondContact O-N 3.08Š| ||
| 51 | G | 62.7 | Low | 67.2 | Low | 69 Ų | 69 | 94 Ų | 94 | 71% | 0.711 | 62% | 0.622 | S | S | * | * | trans | -91.8 | 84.7 | 167.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | G49 | G49-G51 PolarHBondContact O-N 2.98Š| ||
| 52 | A | 69.4 | Low | 68.8 | Low | 37 Ų | 37 | 91.6 Ų | 91.6 | 31% | 0.306 | 61% | 0.605 | S | S | . | * | P | Polyproline II helix | trans | -51.7 | 143.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | G50 G54 R83 | G50-A52 PolarHBondContact O-N 3.08Å; A52-G54 PolarHBondContact O-N 2.82Å; A52-R83 VanDerWaalsContact CB-CD 3.42Å |
| 53 | P | 73.1 | Confident | 70.5 | Confident | 114 Ų | 114 | 91 Ų | 91 | 74% | 0.74 | 59% | 0.591 | S | S | * | * | P | Polyproline II helix | trans | -60 | 137.3 | -170.3 | 23 | -33.5 | 0 | 0 | 0 | 111.4 | ||
| 54 | G | 76.8 | Confident | 72.2 | Confident | 52 Ų | 52 | 90.9 Ų | 90.9 | 54% | 0.536 | 59% | 0.59 | S | S | . | * | P | Polyproline II helix | trans | -57 | 155.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | A52 L81 | A52-G54 PolarHBondContact O-N 2.82Å; G54-L81 CarbonylContact C-O 3.47Å; G54-L81 VanDerWaalsContact CA-O 3.28Å; G54-L81 WeakPolarHBondContact CA-O 3.39Å |
| 55 | V | 83.4 | Confident | 74 | Confident | 23 Ų | 23 | 88.3 Ų | 88.3 | 14% | 0.139 | 57% | 0.574 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -102.7 | 141.8 | 178.4 | -59.8 | 0 | 0 | 0 | 0 | 109.7 | L81 R86 | V55-L81 HydrophobicContact CG2-CB 3.89Å; V55-L81 PolarHBondContact N-O 3.49Å; V55-L81 WeakPolarHBondContact O-CA 3.28Å; V55-L81 WeakPolarHBondContact O-CB 3.41Å; V55-L81 PolarHBondContact O-N 3.17Å; V55-R86 HydrophobicContact CG1-CG 4.37Å |
| 56 | W | 81.6 | Confident | 75.3 | Confident | 130 Ų | 130 | 82.4 Ų | 82.4 | 49% | 0.492 | 56% | 0.555 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -71.2 | 132.4 | 171 | -68.4 | 105.3 | 0 | 0 | 0 | 110.1 | R78 C80 | W56-R78 HydrophobicContact CD2-CG 4.46Å; W56-R78 VanDerWaalsContact CD2-NE 3.26Å; W56-R78 HydrophobicContact CE3-CG 3.67Å; W56-R78 VanDerWaalsContact CE3-NE 3.27Å; W56-R78 HydrophobicContact CZ3-CG 4.1Å; W56-C80 WeakPolarHBondContact CH2-SG 3.33Å; W56-C80 WeakPolarHBondContact CZ3-SG 3.18Å |
| 57 | G | 82 | Confident | 76.9 | Confident | 7 Ų | 7 | 81.5 Ų | 81.5 | 7% | 0.072 | 54% | 0.541 | C | S | . | . | trans | -75.7 | -177.9 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | P79 L81 | G57-P79 PolarHBondContact N-O 3.4Å; G57-L81 VanDerWaalsContact CA-CD1 3.45Å | ||
| 58 | A | 81 | Confident | 77.9 | Confident | 37 Ų | 37 | 80.2 Ų | 80.2 | 31% | 0.306 | 54% | 0.544 | S | S | . | . | trans | -62.4 | 146.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | P79 P93 | A58-P79 VanDerWaalsContact O-CD 3.32Å; A58-P79 WeakPolarHBondContact O-CD 3.42Å; A58-P93 HydrophobicContact CB-CB 3.74Å; A58-P93 VanDerWaalsContact N-CB 3.31Å | ||
| 59 | W | 82.1 | Confident | 79.1 | Confident | 133 Ų | 133 | 80.5 Ų | 80.5 | 50% | 0.504 | 53% | 0.533 | S | S | . | . | trans | -63.7 | 134.8 | 165 | -73 | 116 | 0 | 0 | 0 | 110.5 | Q76 R78 | W59-Q76 VanDerWaalsContact CB-CD 3.42Å; W59-Q76 HydrophobicContact CB-CG 4.04Å; W59-Q76 HydrophobicContact CD2-CG 4.36Å; W59-Q76 HydrophobicContact CE3-CB 4.02Å; W59-Q76 HydrophobicContact CE3-CG 3.84Å; W59-Q76 HydrophobicContact CZ3-CB 4.39Å; W59-Q76 WeakPolarHBondContact CZ3-O 3.21Å; W59-R78 HydrophobicContact CD2-CB 3.95Å; W59-R78 HydrophobicContact CD2-CG 4.12Å; W59-R78 HydrophobicContact CE3-CB 3.59Å; W59-R78 HydrophobicContact CE3-CG 3.72Å; W59-R78 HydrophobicContact CG-CB 4.44Å; W59-R78 HydrophobicContact CH2-CG 3.95Å; W59-R78 HydrophobicContact CZ2-CG 4.33Å; W59-R78 HydrophobicContact CZ3-CB 4.01Å; W59-R78 HydrophobicContact CZ3-CG 3.62Å | ||
| 60 | G | 81.1 | Confident | 80.5 | Confident | 31 Ų | 31 | 81.1 Ų | 81.1 | 32% | 0.32 | 53% | 0.526 | S | S | . | . | trans | -72.6 | -171.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q76 T77 | G60-Q76 VanDerWaalsContact O-CD 3.31Å; G60-Q76 WeakPolarHBondContact O-CG 3.15Å; G60-Q76 PolarHBondContact O-NE2 2.88Å; G60-T77 PolarHBondContact N-O 2.73Å | ||
| 61 | P | 83.1 | Confident | 81.5 | Confident | 119 Ų | 119 | 79.5 Ų | 79.5 | 77% | 0.773 | 51% | 0.509 | S | S | * | . | P | Polyproline II helix | trans | -65.6 | 152.7 | 174.2 | 29.1 | -34.5 | 0 | 0 | 0 | 111.4 | ||
| 62 | W | 83.9 | Confident | 82.6 | Confident | 146 Ų | 146 | 77.5 Ų | 77.5 | 55% | 0.553 | 49% | 0.488 | S | S | * | . | P | Polyproline II helix | trans | -66.5 | 142.6 | 166.4 | -71.8 | 105.6 | 0 | 0 | 0 | 109.8 | M74 E75 Q76 | W62-M74 HydrophobicContact CE3-CB 3.95Å; W62-E75 CarbonylContact C-O 3.55Å; W62-E75 WeakPolarHBondContact CA-O 3.37Å; W62-Q76 HydrophobicContact CD2-CB 4.05Å; W62-Q76 HydrophobicContact CD2-CG 4.34Å; W62-Q76 HydrophobicContact CE3-CB 3.65Å; W62-Q76 HydrophobicContact CE3-CG 4.42Å; W62-Q76 HydrophobicContact CH2-CB 4.08Å; W62-Q76 HydrophobicContact CZ2-CB 4.47Å; W62-Q76 HydrophobicContact CZ3-CB 3.67Å |
| 63 | S | 84.8 | Confident | 83.6 | Confident | 45 Ų | 45 | 80.4 Ų | 80.4 | 32% | 0.315 | 50% | 0.502 | S | S | . | . | P | Polyproline II helix | trans | -68.7 | 162.9 | 169.5 | 69.9 | 0 | 0 | 0 | 0 | 111 | E75 | S63-E75 PolarHBondContact N-O 2.97Å; S63-E75 PolarHBondContact OG-N 2.8Å; S63-E75 PolarHBondContact OG-O 2.64Å |
| 64 | A | 86.4 | Confident | 84.3 | Confident | 88 Ų | 88 | 79.9 Ų | 79.9 | 73% | 0.727 | 49% | 0.491 | S | S | * | . | P | Polyproline II helix | trans | -59.4 | 148 | 170.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | S66 | A64-S66 PolarHBondContact O-N 2.99Š|
| 65 | C | 89.5 | Confident | 84.7 | Confident | 61 Ų | 61 | 84.1 Ų | 84.1 | 41% | 0.412 | 50% | 0.497 | S | S | . | . | P | Polyproline II helix | trans | -59.3 | 126.9 | 173.7 | -166.6 | 0 | 0 | 0 | 0 | 109.2 | R67 G72 M74 | C65-R67 PolarHBondContact O-N 2.66Å; C65-R67 PolarHBondContact SG-O 3.47Å; C65-G72 WeakPolarHBondContact SG-CA 3.32Å; C65-M74 HydrophobicContact CB-CG 4.21Å |
| 66 | S | 88.1 | Confident | 85 | Confident | 82 Ų | 82 | 85.2 Ų | 85.2 | 57% | 0.573 | 50% | 0.501 | S | S | * | . | S | Bend | trans | -57.3 | -16.3 | 177.6 | 44.1 | 0 | 0 | 0 | 0 | 114 | A64 V73 | A64-S66 PolarHBondContact O-N 2.99Å; S66-V73 PolarHBondContact N-O 3Å; S66-V73 PolarHBondContact OG-N 2.79Å; S66-V73 PolarHBondContact OG-O 2.82Å |
| 67 | R | 86.8 | Confident | 85.2 | Confident | 134 Ų | 134 | 84.5 Ų | 84.5 | 51% | 0.506 | 51% | 0.511 | S | S | . | . | trans | -140.5 | 142.3 | 178.6 | -58.6 | 176.2 | 70.1 | -160.7 | 0.3 | 110.2 | C65 C69 S70 | C65-R67 PolarHBondContact O-N 2.66Å; C65-R67 PolarHBondContact SG-O 3.47Å; R67-C69 VanDerWaalsContact C-N 3.33Å; R67-S70 VanDerWaalsContact CZ-OG 3.25Å; R67-S70 PolarHBondContact NH1-O 2.77Å; R67-S70 PolarHBondContact NH1-OG 2.88Å; R67-S70 PolarHBondContact NH2-OG 2.81Å | ||
| 68 | S | 87.4 | Confident | 85.4 | Confident | 132 Ų | 132 | 87.8 Ų | 87.8 | 92% | 0.923 | 52% | 0.521 | S | S | * | . | S | Bend | trans | -75.7 | -19 | 176.9 | 52.4 | 0 | 0 | 0 | 0 | 113.8 | ||
| 69 | C | 84.4 | Confident | 85.5 | Confident | 85 Ų | 85 | 89.2 Ų | 89.2 | 57% | 0.574 | 53% | 0.527 | S | S | * | . | S | Bend | trans | -147.8 | 164.6 | 177.2 | 64.9 | 0 | 0 | 0 | 0 | 111.8 | R67 | R67-C69 VanDerWaalsContact C-N 3.33Š|
| 70 | S | 82.9 | Confident | 85.7 | Confident | 84 Ų | 84 | 87.5 Ų | 87.5 | 59% | 0.587 | 54% | 0.535 | S | S | * | . | S | Bend | trans | 63.2 | 40.8 | 173.6 | 65.6 | 0 | 0 | 0 | 0 | 116.3 | R67 | R67-S70 VanDerWaalsContact CZ-OG 3.25Å; R67-S70 PolarHBondContact NH1-O 2.77Å; R67-S70 PolarHBondContact NH1-OG 2.88Å; R67-S70 PolarHBondContact NH2-OG 2.81Å |
| 71 | G | 81.4 | Confident | 85.9 | Confident | 61 Ų | 61 | 87.6 Ų | 87.6 | 63% | 0.629 | 53% | 0.528 | S | S | * | . | trans | 74.4 | 75.6 | 168.6 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 72 | G | 86 | Confident | 85.8 | Confident | 26 Ų | 26 | 85.8 Ų | 85.8 | 27% | 0.268 | 52% | 0.516 | S | S | . | . | trans | -84.8 | 167.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | C65 | C65-G72 WeakPolarHBondContact SG-CA 3.32Š| ||
| 73 | V | 89.1 | Confident | 85.3 | Confident | 99 Ų | 99 | 86.1 Ų | 86.1 | 60% | 0.6 | 52% | 0.517 | S | S | * | . | trans | -95.3 | 140.9 | 175.4 | -177.7 | 0 | 0 | 0 | 0 | 110 | S66 | S66-V73 PolarHBondContact N-O 3Å; S66-V73 PolarHBondContact OG-N 2.79Å; S66-V73 PolarHBondContact OG-O 2.82Å | ||
| 74 | M | 87.5 | Confident | 84.8 | Confident | 102 Ų | 102 | 87.2 Ų | 87.2 | 50% | 0.502 | 52% | 0.524 | S | S | . | . | trans | -117.7 | 145.3 | 168.5 | -66.6 | 180 | -69.6 | 0 | 0 | 109.3 | W62 C65 | W62-M74 HydrophobicContact CE3-CB 3.95Å; C65-M74 HydrophobicContact CB-CG 4.21Å | ||
| 75 | E | 87.1 | Confident | 83.9 | Confident | 141 Ų | 141 | 87.5 Ų | 87.5 | 66% | 0.659 | 51% | 0.507 | S | S | * | . | trans | -120.6 | 153.6 | -175.4 | -61.3 | 178.7 | 121.2 | 0 | 0 | 110.5 | W62 S63 | W62-E75 CarbonylContact C-O 3.55Å; W62-E75 WeakPolarHBondContact CA-O 3.37Å; S63-E75 PolarHBondContact N-O 2.97Å; S63-E75 PolarHBondContact OG-N 2.8Å; S63-E75 PolarHBondContact OG-O 2.64Å | ||
| 76 | Q | 88.4 | Confident | 82.6 | Confident | 46 Ų | 46 | 93.9 Ų | 93.9 | 22% | 0.215 | 52% | 0.523 | C | S | . | . | trans | -145.2 | 142.7 | 177.6 | -160.2 | 177.3 | 39.7 | 0 | 0 | 109.2 | W59 G60 W62 | W59-Q76 VanDerWaalsContact CB-CD 3.42Å; W59-Q76 HydrophobicContact CB-CG 4.04Å; W59-Q76 HydrophobicContact CD2-CG 4.36Å; W59-Q76 HydrophobicContact CE3-CB 4.02Å; W59-Q76 HydrophobicContact CE3-CG 3.84Å; W59-Q76 HydrophobicContact CZ3-CB 4.39Å; W59-Q76 WeakPolarHBondContact CZ3-O 3.21Å; G60-Q76 VanDerWaalsContact O-CD 3.31Å; G60-Q76 WeakPolarHBondContact O-CG 3.15Å; G60-Q76 PolarHBondContact O-NE2 2.88Å; W62-Q76 HydrophobicContact CD2-CB 4.05Å; W62-Q76 HydrophobicContact CD2-CG 4.34Å; W62-Q76 HydrophobicContact CE3-CB 3.65Å; W62-Q76 HydrophobicContact CE3-CG 4.42Å; W62-Q76 HydrophobicContact CH2-CB 4.08Å; W62-Q76 HydrophobicContact CZ2-CB 4.47Å; W62-Q76 HydrophobicContact CZ3-CB 3.67Å | ||
| 77 | T | 85.6 | Confident | 81.5 | Confident | 116 Ų | 116 | 96.9 Ų | 96.9 | 71% | 0.712 | 53% | 0.532 | S | S | * | . | trans | -115.8 | 146.2 | 179.1 | -59.6 | 0 | 0 | 0 | 0 | 110.3 | G60 | G60-T77 PolarHBondContact N-O 2.73Š| ||
| 78 | R | 87.6 | Confident | 80.3 | Confident | 76 Ų | 76 | 101.6 Ų | 101.6 | 29% | 0.287 | 55% | 0.549 | S | S | . | . | trans | -132.5 | 140.5 | 170.9 | 61.7 | 179 | -170.2 | -160.6 | 4.2 | 110.3 | W56 W59 | W56-R78 HydrophobicContact CD2-CG 4.46Å; W56-R78 VanDerWaalsContact CD2-NE 3.26Å; W56-R78 HydrophobicContact CE3-CG 3.67Å; W56-R78 VanDerWaalsContact CE3-NE 3.27Å; W56-R78 HydrophobicContact CZ3-CG 4.1Å; W59-R78 HydrophobicContact CD2-CB 3.95Å; W59-R78 HydrophobicContact CD2-CG 4.12Å; W59-R78 HydrophobicContact CE3-CB 3.59Å; W59-R78 HydrophobicContact CE3-CG 3.72Å; W59-R78 HydrophobicContact CG-CB 4.44Å; W59-R78 HydrophobicContact CH2-CG 3.95Å; W59-R78 HydrophobicContact CZ2-CG 4.33Å; W59-R78 HydrophobicContact CZ3-CB 4.01Å; W59-R78 HydrophobicContact CZ3-CG 3.62Å | ||
| 79 | P | 83.1 | Confident | 78.9 | Confident | 67 Ų | 67 | 98.7 Ų | 98.7 | 44% | 0.435 | 54% | 0.54 | S | S | . | . | trans | -78.3 | 148.6 | -179 | 30.4 | -32.1 | 0 | 0 | 0 | 112 | G57 A58 L81 | G57-P79 PolarHBondContact N-O 3.4Å; A58-P79 VanDerWaalsContact O-CD 3.32Å; A58-P79 WeakPolarHBondContact O-CD 3.42Å; P79-L81 HydrophobicContact CB-CD2 4.14Å; P79-L81 HydrophobicContact CG-CD2 4.11Å; P79-L81 HydrophobicContact CG-CG 4.42Å | ||
| 80 | C | 86.3 | Confident | 77.7 | Confident | 97 Ų | 97 | 96.2 Ų | 96.2 | 66% | 0.655 | 53% | 0.53 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -83.2 | 115.4 | 165.5 | -60.8 | 0 | 0 | 0 | 0 | 108.6 | W56 | W56-C80 WeakPolarHBondContact CH2-SG 3.33Å; W56-C80 WeakPolarHBondContact CZ3-SG 3.18Å |
| 81 | L | 84.6 | Confident | 76.3 | Confident | 33 Ų | 33 | 100.5 Ų | 100.5 | 17% | 0.173 | 54% | 0.54 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.1 | 144.6 | -178.3 | -56.9 | 177.4 | 0 | 0 | 0 | 111 | G54 V55 G57 P79 Y85 | G54-L81 CarbonylContact C-O 3.47Å; G54-L81 VanDerWaalsContact CA-O 3.28Å; G54-L81 WeakPolarHBondContact CA-O 3.39Å; V55-L81 HydrophobicContact CG2-CB 3.89Å; V55-L81 PolarHBondContact N-O 3.49Å; V55-L81 WeakPolarHBondContact O-CA 3.28Å; V55-L81 WeakPolarHBondContact O-CB 3.41Å; V55-L81 PolarHBondContact O-N 3.17Å; G57-L81 VanDerWaalsContact CA-CD1 3.45Å; P79-L81 HydrophobicContact CB-CD2 4.14Å; P79-L81 HydrophobicContact CG-CD2 4.11Å; P79-L81 HydrophobicContact CG-CG 4.42Å; L81-Y85 HydrophobicContact CB-CG 4.43Å; L81-Y85 HydrophobicContact CD1-CD1 3.76Å; L81-Y85 HydrophobicContact CD1-CD2 4.02Å; L81-Y85 HydrophobicContact CD1-CE1 3.97Å; L81-Y85 HydrophobicContact CD1-CE2 4.2Å; L81-Y85 HydrophobicContact CD1-CG 3.8Å |
| 82 | P | 81.3 | Confident | 74.9 | Confident | 81 Ų | 81 | 109 Ų | 109 | 53% | 0.526 | 55% | 0.553 | S | S | . | * | trans | -67.2 | 156.2 | 172.6 | 29.3 | -34.7 | 0 | 0 | 0 | 111 | S84 Y85 | P82-S84 PolarHBondContact O-N 3.12Å; P82-Y85 WeakPolarHBondContact O-CB 3.37Å; P82-Y85 PolarHBondContact O-N 3.49Å | ||
| 83 | R | 72.3 | Confident | 73.5 | Confident | 153 Ų | 153 | 110.7 Ų | 110.7 | 58% | 0.577 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.8 | -29.7 | 178.7 | -176.5 | 173.6 | 172.7 | 155.3 | 1.5 | 113.3 | A52 Y85 R86 | A52-R83 VanDerWaalsContact CB-CD 3.42Å; R83-Y85 PolarHBondContact O-N 3.21Å; R83-Y85 VanDerWaalsContact O-N 3.12Å; R83-R86 PolarHBondContact O-N 3.07Å; R83-R86 VanDerWaalsContact O-N 3.17Å |
| 84 | S | 74.7 | Confident | 72 | Confident | 67 Ų | 67 | 108.5 Ų | 108.5 | 47% | 0.469 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -58.9 | -21.9 | 178.5 | 55.7 | 0 | 0 | 0 | 0 | 113.7 | P82 R86 L87 R88 | P82-S84 PolarHBondContact O-N 3.12Å; S84-R86 VanDerWaalsContact C-N 3.31Å; S84-R86 PolarHBondContact O-N 3.43Å; S84-L87 PolarHBondContact O-N 3.05Å; S84-R88 PolarHBondContact O-N 3.21Å |
| 85 | Y | 68.1 | Low | 70.2 | Confident | 95 Ų | 95 | 108.3 Ų | 108.3 | 37% | 0.373 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63 | -34.7 | 176.8 | -168.1 | -90.5 | 0 | 0 | 0 | 112.7 | L81 P82 R83 L87 P93 | L81-Y85 HydrophobicContact CB-CG 4.43Å; L81-Y85 HydrophobicContact CD1-CD1 3.76Å; L81-Y85 HydrophobicContact CD1-CD2 4.02Å; L81-Y85 HydrophobicContact CD1-CE1 3.97Å; L81-Y85 HydrophobicContact CD1-CE2 4.2Å; L81-Y85 HydrophobicContact CD1-CG 3.8Å; P82-Y85 WeakPolarHBondContact O-CB 3.37Å; P82-Y85 PolarHBondContact O-N 3.49Å; R83-Y85 PolarHBondContact O-N 3.21Å; R83-Y85 VanDerWaalsContact O-N 3.12Å; Y85-L87 VanDerWaalsContact C-N 3.34Å; Y85-L87 PolarHBondContact O-N 3.27Å; Y85-P93 HydrophobicContact CE1-CG 3.91Å |
| 86 | R | 62.8 | Low | 68.4 | Low | 194 Ų | 194 | 106.9 Ų | 106.9 | 73% | 0.732 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -71.2 | -27.1 | 176.3 | -79.5 | -147.2 | -98.8 | -149.4 | -5.8 | 113.5 | V55 R83 S84 | V55-R86 HydrophobicContact CG1-CG 4.37Å; R83-R86 PolarHBondContact O-N 3.07Å; R83-R86 VanDerWaalsContact O-N 3.17Å; S84-R86 VanDerWaalsContact C-N 3.31Å; S84-R86 PolarHBondContact O-N 3.43Å |
| 87 | L | 63.8 | Low | 66.5 | Low | 146 Ų | 146 | 109.2 Ų | 109.2 | 76% | 0.764 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -79.8 | -23.4 | -176 | -64.3 | 173.6 | 0 | 0 | 0 | 112.7 | S84 Y85 G89 | S84-L87 PolarHBondContact O-N 3.05Å; Y85-L87 VanDerWaalsContact C-N 3.34Å; Y85-L87 PolarHBondContact O-N 3.27Å; L87-G89 VanDerWaalsContact C-N 3.27Å; L87-G89 PolarHBondContact O-N 2.73Å |
| 88 | R | 62.4 | Low | 65.1 | Low | 232 Ų | 232 | 115 Ų | 115 | 88% | 0.875 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.9 | 12.4 | 179.8 | -81.3 | -169.3 | -176.3 | -140.9 | 1.7 | 114.9 | S84 G90 | S84-R88 PolarHBondContact O-N 3.21Å; R88-G90 PolarHBondContact O-N 3.26Å |
| 89 | G | 58.5 | Low | 63.2 | Low | 71 Ų | 71 | 115.6 Ų | 115.6 | 73% | 0.732 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 64.7 | 21.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | L87 Q91 | L87-G89 VanDerWaalsContact C-N 3.27Å; L87-G89 PolarHBondContact O-N 2.73Å; G89-Q91 PolarHBondContact O-N 3.33Å |
| 90 | G | 58.3 | Low | 61.6 | Low | 34 Ų | 34 | 122 Ų | 122 | 35% | 0.351 | 65% | 0.653 | S | S | . | * | trans | -68.2 | 117.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | R88 | R88-G90 PolarHBondContact O-N 3.26Š| ||
| 91 | Q | 53.5 | Low | 59.2 | Low | 174 Ų | 174 | 125.9 Ų | 125.9 | 81% | 0.813 | 69% | 0.692 | S | S | * | * | trans | -25.4 | 137.9 | 173.1 | -141.7 | 150.4 | -0.9 | 0 | 0 | 114.5 | G89 P93 | G89-Q91 PolarHBondContact O-N 3.33Å; Q91-P93 WeakPolarHBondContact O-CD 3.12Å | ||
| 92 | R | 52.4 | Low | 58 | Low | 238 Ų | 238 | 130.5 Ų | 130.5 | 90% | 0.898 | 72% | 0.718 | S | S | * | * | trans | -41.9 | 108.8 | 174.8 | -87.3 | 176.2 | 117.3 | 150.7 | -0.8 | 109.5 | G94 | R92-G94 PolarHBondContact O-N 2.7Š| ||
| 93 | P | 55.8 | Low | 56.8 | Low | 63 Ų | 63 | 133.1 Ų | 133.1 | 41% | 0.409 | 73% | 0.728 | S | S | . | * | S | Bend | trans | -70 | 105.2 | -179.6 | -15.5 | 29.6 | 0 | 0 | 0 | 107.9 | A58 Y85 Q91 | A58-P93 HydrophobicContact CB-CB 3.74Å; A58-P93 VanDerWaalsContact N-CB 3.31Å; Y85-P93 HydrophobicContact CE1-CG 3.91Å; Q91-P93 WeakPolarHBondContact O-CD 3.12Å |
| 94 | G | 58.3 | Low | 55.9 | Low | 52 Ų | 52 | 132 Ų | 132 | 54% | 0.536 | 74% | 0.737 | S | S | . | * | trans | 142.3 | 33.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 117.9 | R92 P96 | R92-G94 PolarHBondContact O-N 2.7Å; G94-P96 WeakPolarHBondContact O-CD 3.42Å | ||
| 95 | A | 50 | Low | 54.8 | Low | 98 Ų | 98 | 135.8 Ų | 135.8 | 81% | 0.81 | 75% | 0.752 | S | S | * | * | trans | -83.9 | 107.9 | 159.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | A97 | A95-A97 PolarHBondContact O-N 3.01Š| ||
| 96 | P | 48.2 | Very low | 54 | Low | 112 Ų | 112 | 138.4 Ų | 138.4 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | trans | -69.1 | 130.8 | 175.6 | 28.2 | -33.1 | 0 | 0 | 0 | 109.5 | G94 R98 | G94-P96 WeakPolarHBondContact O-CD 3.42Å; P96-R98 PolarHBondContact O-N 3.28Å; P96-R98 VanDerWaalsContact O-N 3.08Å | ||
| 97 | A | 50 | Low | 53.4 | Low | 95 Ų | 95 | 134.7 Ų | 134.7 | 79% | 0.785 | 78% | 0.779 | S | S | * | * | trans | -62.9 | 110.2 | 161 | 0 | 0 | 0 | 0 | 0 | 107 | A95 A99 | A95-A97 PolarHBondContact O-N 3.01Å; A97-A99 PolarHBondContact O-N 3.45Å | ||
| 98 | R | 54.6 | Low | 52.6 | Low | 237 Ų | 237 | 133.9 Ų | 133.9 | 89% | 0.894 | 78% | 0.78 | S | S | * | * | trans | -61.3 | 107.1 | 169.7 | -67.8 | 179.5 | 85.1 | -174.1 | 6.3 | 106.9 | P96 | P96-R98 PolarHBondContact O-N 3.28Å; P96-R98 VanDerWaalsContact O-N 3.08Å | ||
| 99 | A | 47.4 | Very low | 51.9 | Low | 89 Ų | 89 | 126.3 Ų | 126.3 | 74% | 0.736 | 77% | 0.773 | S | S | * | * | trans | -130.4 | 82.3 | 166.3 | 0 | 0 | 0 | 0 | 0 | 107.3 | A97 | A97-A99 PolarHBondContact O-N 3.45Š| ||
| 100 | F | 50.4 | Low | 51.3 | Low | 200 Ų | 200 | 130.9 Ų | 130.9 | 88% | 0.877 | 78% | 0.776 | S | S | * | * | trans | -112.4 | 105.3 | 157.5 | -65.3 | -77 | 0 | 0 | 0 | 105.1 | ||||
| 101 | A | 37 | Very low | 50.7 | Low | 179 Ų | 179 | 139.7 Ų | 139.7 | 100% | 1.479 | 82% | 0.815 | S | S | * | * | trans | -110.9 | 0 | 159.2 | 0 | 0 | 0 | 0 | 0 | 106.4 |
Retrieved 101 of 101 residues in 72.7 ms
(Link to these results)