| 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 | 46.3 | Very low | 68.5 | Low | 244 Ų | 244 | 109.9 Ų | 109.9 | 100% | 1.202 | 67% | 0.673 | S | S | * | * | 0 | 93 | 0 | -68.6 | -170.1 | -75.3 | 0 | 0 | 108 | |||||
| 2 | A | 51.3 | Low | 70.5 | Confident | 98 Ų | 98 | 110.4 Ų | 110.4 | 81% | 0.81 | 67% | 0.667 | S | S | * | * | trans | 179.1 | 56.7 | 168.8 | 0 | 0 | 0 | 0 | 0 | 106.6 | G4 | A2-G4 VanDerWaalsContact C-N 3.27Å; A2-G4 PolarHBondContact O-N 3.1Å | ||
| 3 | A | 53.6 | Low | 72 | Confident | 93 Ų | 93 | 112.4 Ų | 112.4 | 77% | 0.769 | 66% | 0.661 | S | S | * | * | trans | -64.9 | 101.7 | 167.4 | 0 | 0 | 0 | 0 | 0 | 105.1 | E5 | A3-E5 PolarHBondContact O-N 3.3Š| ||
| 4 | G | 58.1 | Low | 73.4 | Confident | 71 Ų | 71 | 108.9 Ų | 108.9 | 73% | 0.732 | 65% | 0.646 | S | S | * | * | trans | -67.1 | 72.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | A2 N6 | A2-G4 VanDerWaalsContact C-N 3.27Å; A2-G4 PolarHBondContact O-N 3.1Å; G4-N6 VanDerWaalsContact C-N 3.35Å; G4-N6 WeakPolarHBondContact O-CA 3.47Å; G4-N6 PolarHBondContact O-N 2.8Å | ||
| 5 | E | 62.9 | Low | 74.8 | Confident | 182 Ų | 182 | 107.1 Ų | 107.1 | 85% | 0.85 | 64% | 0.636 | S | S | * | * | trans | -48.2 | 106.5 | 165.5 | -79 | -177.1 | 117.6 | 0 | 0 | 106.4 | A3 P7 | A3-E5 PolarHBondContact O-N 3.3Å; E5-P7 VanDerWaalsContact O-CD 3.26Å; E5-P7 WeakPolarHBondContact O-CD 3.28Å | ||
| 6 | N | 67.1 | Low | 75.9 | Confident | 105 Ų | 105 | 104.9 Ų | 104.9 | 56% | 0.561 | 63% | 0.628 | S | S | * | * | trans | -65.3 | 113.6 | -159.3 | -174.4 | -13.4 | 0 | 0 | 0 | 108.3 | G4 A8 A9 | G4-N6 VanDerWaalsContact C-N 3.35Å; G4-N6 WeakPolarHBondContact O-CA 3.47Å; G4-N6 PolarHBondContact O-N 2.8Å; N6-A8 PolarHBondContact O-N 2.92Å; N6-A8 WeakPolarHBondContact OD1-CB 3.4Å; N6-A8 PolarHBondContact OD1-N 2.82Å; N6-A8 VanDerWaalsContact OD1-N 3.17Å; N6-A9 WeakPolarHBondContact O-CB 3.46Å; N6-A9 PolarHBondContact O-N 3.16Å | ||
| 7 | P | 77 | Confident | 76.8 | Confident | 91 Ų | 91 | 106.4 Ų | 106.4 | 59% | 0.591 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -56.5 | -21.9 | -178 | 22.5 | -33.6 | 0 | 0 | 0 | 112 | E5 A9 E10 M11 | E5-P7 VanDerWaalsContact O-CD 3.26Å; E5-P7 WeakPolarHBondContact O-CD 3.28Å; P7-A9 VanDerWaalsContact C-N 3.3Å; P7-A9 PolarHBondContact O-N 3.2Å; P7-E10 PolarHBondContact O-N 3.07Å; P7-M11 WeakPolarHBondContact O-CG 3.37Å; P7-M11 PolarHBondContact O-N 2.85Å; P7-M11 VanDerWaalsContact O-N 3.07Å |
| 8 | A | 80.6 | Confident | 77.7 | Confident | 33 Ų | 33 | 107.1 Ų | 107.1 | 27% | 0.273 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -57.4 | -38.8 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | N6 M11 I12 | N6-A8 PolarHBondContact O-N 2.92Å; N6-A8 WeakPolarHBondContact OD1-CB 3.4Å; N6-A8 PolarHBondContact OD1-N 2.82Å; N6-A8 VanDerWaalsContact OD1-N 3.17Å; A8-M11 HydrophobicContact CB-CE 4.45Å; A8-M11 PolarHBondContact O-N 3.22Å; A8-I12 WeakPolarHBondContact O-CD1 3.48Å; A8-I12 WeakPolarHBondContact O-CG1 3.24Å; A8-I12 PolarHBondContact O-N 3.14Å |
| 9 | A | 82.2 | Confident | 78.5 | Confident | 63 Ų | 63 | 106.1 Ų | 106.1 | 52% | 0.521 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -65.7 | -43.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | N6 P7 I12 K13 | N6-A9 WeakPolarHBondContact O-CB 3.46Å; N6-A9 PolarHBondContact O-N 3.16Å; P7-A9 VanDerWaalsContact C-N 3.3Å; P7-A9 PolarHBondContact O-N 3.2Å; A9-I12 PolarHBondContact O-N 2.95Å; A9-K13 PolarHBondContact O-N 2.89Å; A9-K13 VanDerWaalsContact O-N 3.11Å |
| 10 | E | 85.4 | Confident | 78.9 | Confident | 112 Ų | 112 | 103.3 Ų | 103.3 | 52% | 0.523 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -69.6 | -36.2 | 178 | -162.7 | 61.2 | -146.7 | 0 | 0 | 111.8 | P7 K13 S14 | P7-E10 PolarHBondContact O-N 3.07Å; E10-K13 PolarHBondContact O-N 3.43Å; E10-K13 IonicContact OE1-NZ 3.8Å; E10-S14 PolarHBondContact O-N 3.37Å; E10-S14 VanDerWaalsContact O-N 3.1Å; E10-S14 PolarHBondContact O-OG 3.17Å |
| 11 | M | 89.4 | Confident | 79.3 | Confident | 117 Ų | 117 | 100.2 Ų | 100.2 | 58% | 0.576 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -63.7 | -44.8 | 173.2 | -72.5 | -169 | -59 | 0 | 0 | 111.9 | P7 A8 K13 S14 V15 | P7-M11 WeakPolarHBondContact O-CG 3.37Å; P7-M11 PolarHBondContact O-N 2.85Å; P7-M11 VanDerWaalsContact O-N 3.07Å; A8-M11 HydrophobicContact CB-CE 4.45Å; A8-M11 PolarHBondContact O-N 3.22Å; M11-K13 VanDerWaalsContact C-N 3.31Å; M11-K13 PolarHBondContact O-N 2.97Å; M11-S14 WeakPolarHBondContact O-CB 3.36Å; M11-S14 PolarHBondContact O-N 3.11Å; M11-V15 WeakPolarHBondContact O-CG2 3.36Å; M11-V15 PolarHBondContact O-N 3.46Å |
| 12 | I | 92 | Very high | 81.3 | Confident | 116 Ų | 116 | 93.3 Ų | 93.3 | 60% | 0.595 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -60.5 | -43.2 | 178.1 | -71.2 | 162 | 0 | 0 | 0 | 110.7 | A8 A9 S14 V15 S16 | A8-I12 WeakPolarHBondContact O-CD1 3.48Å; A8-I12 WeakPolarHBondContact O-CG1 3.24Å; A8-I12 PolarHBondContact O-N 3.14Å; A9-I12 PolarHBondContact O-N 2.95Å; I12-S14 VanDerWaalsContact C-N 3.32Å; I12-S14 PolarHBondContact O-N 2.96Å; I12-V15 PolarHBondContact O-N 2.99Å; I12-S16 VanDerWaalsContact O-CB 3.3Å; I12-S16 WeakPolarHBondContact O-CB 3.3Å; I12-S16 PolarHBondContact O-N 2.97Å |
| 13 | K | 89.6 | Confident | 83 | Confident | 136 Ų | 136 | 93.8 Ų | 93.8 | 59% | 0.591 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -58.6 | -44.5 | 176.5 | -177 | -177.6 | 173.7 | -167.3 | 0 | 111.7 | A9 E10 M11 S16 L17 | A9-K13 PolarHBondContact O-N 2.89Å; A9-K13 VanDerWaalsContact O-N 3.11Å; E10-K13 PolarHBondContact O-N 3.43Å; E10-K13 IonicContact OE1-NZ 3.8Å; M11-K13 VanDerWaalsContact C-N 3.31Å; M11-K13 PolarHBondContact O-N 2.97Å; K13-S16 PolarHBondContact O-N 3.12Å; K13-L17 PolarHBondContact O-N 3.37Å; K13-L17 VanDerWaalsContact O-N 3.13Å |
| 14 | S | 91.6 | Very high | 84.1 | Confident | 64 Ų | 64 | 94.3 Ų | 94.3 | 45% | 0.448 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.2 | -45 | 177.6 | -58.2 | 0 | 0 | 0 | 0 | 112.2 | E10 M11 I12 L17 I18 | E10-S14 PolarHBondContact O-N 3.37Å; E10-S14 VanDerWaalsContact O-N 3.1Å; E10-S14 PolarHBondContact O-OG 3.17Å; M11-S14 WeakPolarHBondContact O-CB 3.36Å; M11-S14 PolarHBondContact O-N 3.11Å; I12-S14 VanDerWaalsContact C-N 3.32Å; I12-S14 PolarHBondContact O-N 2.96Å; S14-L17 PolarHBondContact O-N 3.49Å; S14-I18 WeakPolarHBondContact O-CG1 3.43Å; S14-I18 PolarHBondContact O-N 3.49Å |
| 15 | V | 94.2 | Very high | 85 | Confident | 81 Ų | 81 | 95.9 Ų | 95.9 | 49% | 0.491 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64.7 | -41.8 | 177.6 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | M11 I12 L17 I18 I19 | M11-V15 WeakPolarHBondContact O-CG2 3.36Å; M11-V15 PolarHBondContact O-N 3.46Å; I12-V15 PolarHBondContact O-N 2.99Å; V15-L17 VanDerWaalsContact C-N 3.32Å; V15-L17 PolarHBondContact O-N 3.28Å; V15-I18 PolarHBondContact O-N 3.33Å; V15-I19 HydrophobicContact CG1-CD1 3.81Å; V15-I19 HydrophobicContact CG1-CG1 4.43Å; V15-I19 WeakPolarHBondContact O-CG1 3.47Å; V15-I19 PolarHBondContact O-N 2.92Å |
| 16 | S | 92.4 | Very high | 85.5 | Confident | 73 Ų | 73 | 92.4 Ų | 92.4 | 51% | 0.51 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.1 | -41.9 | 176.4 | 176.9 | 0 | 0 | 0 | 0 | 112 | I12 K13 I18 I19 A20 | I12-S16 VanDerWaalsContact O-CB 3.3Å; I12-S16 WeakPolarHBondContact O-CB 3.3Å; I12-S16 PolarHBondContact O-N 2.97Å; K13-S16 PolarHBondContact O-N 3.12Å; S16-I18 PolarHBondContact O-N 3.43Å; S16-I19 PolarHBondContact O-N 3.32Å; S16-A20 WeakPolarHBondContact O-CB 3.29Å; S16-A20 PolarHBondContact O-N 3.32Å |
| 17 | L | 92 | Very high | 85.4 | Confident | 129 Ų | 129 | 92 Ų | 92 | 68% | 0.675 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.9 | -40.4 | 177.8 | -166.7 | 152.1 | 0 | 0 | 0 | 112 | K13 S14 V15 A20 G21 | K13-L17 PolarHBondContact O-N 3.37Å; K13-L17 VanDerWaalsContact O-N 3.13Å; S14-L17 PolarHBondContact O-N 3.49Å; V15-L17 VanDerWaalsContact C-N 3.32Å; V15-L17 PolarHBondContact O-N 3.28Å; L17-A20 PolarHBondContact O-N 2.94Å; L17-G21 PolarHBondContact O-N 2.95Å |
| 18 | I | 93.3 | Very high | 85.1 | Confident | 119 Ų | 119 | 89.4 Ų | 89.4 | 61% | 0.61 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.6 | -47.2 | 175.5 | -65.6 | 167.2 | 0 | 0 | 0 | 110.9 | S14 V15 S16 A20 G21 L22 | S14-I18 WeakPolarHBondContact O-CG1 3.43Å; S14-I18 PolarHBondContact O-N 3.49Å; V15-I18 PolarHBondContact O-N 3.33Å; S16-I18 PolarHBondContact O-N 3.43Å; I18-A20 VanDerWaalsContact C-N 3.31Å; I18-A20 PolarHBondContact O-N 3.34Å; I18-G21 PolarHBondContact O-N 3.24Å; I18-L22 PolarHBondContact O-N 2.79Å |
| 19 | I | 92.2 | Very high | 84.7 | Confident | 88 Ų | 88 | 94.6 Ų | 94.6 | 45% | 0.451 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.9 | -42.3 | 178.1 | -66.4 | 168.6 | 0 | 0 | 0 | 110.2 | V15 S16 L22 L23 | V15-I19 HydrophobicContact CG1-CD1 3.81Å; V15-I19 HydrophobicContact CG1-CG1 4.43Å; V15-I19 WeakPolarHBondContact O-CG1 3.47Å; V15-I19 PolarHBondContact O-N 2.92Å; S16-I19 PolarHBondContact O-N 3.32Å; I19-L22 PolarHBondContact O-N 2.98Å; I19-L23 HydrophobicContact CG2-CD1 3.88Å; I19-L23 HydrophobicContact CG2-CG 4.24Å; I19-L23 WeakPolarHBondContact O-CB 3.49Å; I19-L23 VanDerWaalsContact O-CG 3.32Å; I19-L23 WeakPolarHBondContact O-CG 3.3Å; I19-L23 PolarHBondContact O-N 3.39Å |
| 20 | A | 87.4 | Confident | 84.3 | Confident | 50 Ų | 50 | 96.8 Ų | 96.8 | 41% | 0.413 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.9 | -42.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | S16 L17 I18 L22 L23 L24 | S16-A20 WeakPolarHBondContact O-CB 3.29Å; S16-A20 PolarHBondContact O-N 3.32Å; L17-A20 PolarHBondContact O-N 2.94Å; I18-A20 VanDerWaalsContact C-N 3.31Å; I18-A20 PolarHBondContact O-N 3.34Å; A20-L22 PolarHBondContact O-N 2.8Å; A20-L23 CarbonylContact O-C 3.4Å; A20-L23 PolarHBondContact O-N 3.49Å; A20-L24 VanDerWaalsContact O-CB 3.29Å; A20-L24 WeakPolarHBondContact O-CB 3.25Å; A20-L24 PolarHBondContact O-N 2.83Å |
| 21 | G | 87.1 | Confident | 83.7 | Confident | 40 Ų | 40 | 95.6 Ų | 95.6 | 41% | 0.412 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.4 | -40.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | L17 I18 L24 L25 | L17-G21 PolarHBondContact O-N 2.95Å; I18-G21 PolarHBondContact O-N 3.24Å; G21-L24 PolarHBondContact O-N 3.19Å; G21-L25 WeakPolarHBondContact O-CB 3.45Å; G21-L25 PolarHBondContact O-N 3.25Å |
| 22 | L | 87.8 | Confident | 83.1 | Confident | 99 Ų | 99 | 94.7 Ų | 94.7 | 52% | 0.518 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.8 | -43.4 | 173.9 | -174.7 | 65.2 | 0 | 0 | 0 | 111.3 | I18 I19 A20 L24 L25 L26 | I18-L22 PolarHBondContact O-N 2.79Å; I19-L22 PolarHBondContact O-N 2.98Å; A20-L22 PolarHBondContact O-N 2.8Å; L22-L24 PolarHBondContact O-N 3.39Å; L22-L25 PolarHBondContact O-N 3.4Å; L22-L26 HydrophobicContact CD1-CD1 4.14Å; L22-L26 HydrophobicContact CD1-CG 4.47Å; L22-L26 HydrophobicContact CG-CD1 3.81Å; L22-L26 VanDerWaalsContact O-CB 3.31Å; L22-L26 WeakPolarHBondContact O-CB 3.16Å; L22-L26 WeakPolarHBondContact O-CD1 3.33Å; L22-L26 WeakPolarHBondContact O-CG 3.45Å; L22-L26 PolarHBondContact O-N 2.84Å |
| 23 | L | 86.1 | Confident | 82.7 | Confident | 107 Ų | 107 | 95 Ų | 95 | 56% | 0.56 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -70.6 | -11.7 | 173 | -73.7 | 175.6 | 0 | 0 | 0 | 113.9 | I19 A20 P27 | I19-L23 HydrophobicContact CG2-CD1 3.88Å; I19-L23 HydrophobicContact CG2-CG 4.24Å; I19-L23 WeakPolarHBondContact O-CB 3.49Å; I19-L23 VanDerWaalsContact O-CG 3.32Å; I19-L23 WeakPolarHBondContact O-CG 3.3Å; I19-L23 PolarHBondContact O-N 3.39Å; A20-L23 CarbonylContact O-C 3.4Å; A20-L23 PolarHBondContact O-N 3.49Å; L23-P27 VanDerWaalsContact C-CD 3.48Å; L23-P27 WeakPolarHBondContact O-CD 3.37Å; L23-P27 WeakPolarHBondContact O-CG 3.25Å |
| 24 | L | 77.8 | Confident | 82 | Confident | 105 Ų | 105 | 92.4 Ų | 92.4 | 55% | 0.55 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -93 | -35.7 | 173.7 | -157.6 | 158 | 0 | 0 | 0 | 109.6 | A20 G21 L22 L26 F29 | A20-L24 VanDerWaalsContact O-CB 3.29Å; A20-L24 WeakPolarHBondContact O-CB 3.25Å; A20-L24 PolarHBondContact O-N 2.83Å; G21-L24 PolarHBondContact O-N 3.19Å; L22-L24 PolarHBondContact O-N 3.39Å; L24-L26 VanDerWaalsContact C-N 3.35Å; L24-F29 HydrophobicContact CD2-CB 3.75Å; L24-F29 HydrophobicContact CD2-CG 4.07Å |
| 25 | L | 77.5 | Confident | 81.3 | Confident | 103 Ų | 103 | 91.2 Ų | 91.2 | 54% | 0.539 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.2 | -37.4 | 170.9 | -171.4 | 123.1 | 0 | 0 | 0 | 112.2 | G21 L22 F30 | G21-L25 WeakPolarHBondContact O-CB 3.45Å; G21-L25 PolarHBondContact O-N 3.25Å; L22-L25 PolarHBondContact O-N 3.4Å; L25-F30 WeakPolarHBondContact O-CB 3.45Å |
| 26 | L | 72.2 | Confident | 80.6 | Confident | 110 Ų | 110 | 92 Ų | 92 | 58% | 0.576 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79 | -40 | -171 | -76 | 168.1 | 0 | 0 | 0 | 117 | L22 L24 | L22-L26 HydrophobicContact CD1-CD1 4.14Å; L22-L26 HydrophobicContact CD1-CG 4.47Å; L22-L26 HydrophobicContact CG-CD1 3.81Å; L22-L26 VanDerWaalsContact O-CB 3.31Å; L22-L26 WeakPolarHBondContact O-CB 3.16Å; L22-L26 WeakPolarHBondContact O-CD1 3.33Å; L22-L26 WeakPolarHBondContact O-CG 3.45Å; L22-L26 PolarHBondContact O-N 2.84Å; L24-L26 VanDerWaalsContact C-N 3.35Å |
| 27 | P | 66.5 | Low | 80 | Confident | 97 Ų | 97 | 92.4 Ų | 92.4 | 63% | 0.63 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.8 | -23.7 | -165.2 | 34.2 | -33.5 | 0 | 0 | 0 | 115.8 | L23 | L23-P27 VanDerWaalsContact C-CD 3.48Å; L23-P27 WeakPolarHBondContact O-CD 3.37Å; L23-P27 WeakPolarHBondContact O-CG 3.25Å |
| 28 | G | 71 | Confident | 79 | Confident | 35 Ų | 35 | 90.7 Ų | 90.7 | 36% | 0.361 | 50% | 0.503 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -160.4 | -34.7 | -169.7 | 0 | 0 | 0 | 0 | 0 | 118.6 | T31 D32 | G28-T31 PolarHBondContact O-N 2.92Å; G28-D32 VanDerWaalsContact O-CB 3.25Å; G28-D32 WeakPolarHBondContact O-CB 3.4Å; G28-D32 PolarHBondContact O-N 3.24Å |
| 29 | F | 71.6 | Confident | 78.2 | Confident | 142 Ų | 142 | 90.7 Ų | 90.7 | 62% | 0.623 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -69.2 | -46.8 | -177.6 | 176.8 | -98.4 | 0 | 0 | 0 | 112.4 | L24 T31 D32 F33 | L24-F29 HydrophobicContact CD2-CB 3.75Å; L24-F29 HydrophobicContact CD2-CG 4.07Å; F29-T31 VanDerWaalsContact C-N 3.3Å; F29-T31 PolarHBondContact O-N 3.39Å; F29-D32 PolarHBondContact O-N 2.85Å; F29-F33 WeakPolarHBondContact O-CB 3.48Å; F29-F33 PolarHBondContact O-N 3.02Å |
| 30 | F | 73.4 | Confident | 77.7 | Confident | 110 Ų | 110 | 90.5 Ų | 90.5 | 48% | 0.482 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.9 | -38 | 177.5 | -169 | -101.2 | 0 | 0 | 0 | 111.1 | L25 F33 L34 | L25-F30 WeakPolarHBondContact O-CB 3.45Å; F30-F33 PolarHBondContact O-N 3.44Å; F30-L34 HydrophobicContact CD1-CD1 4.26Å; F30-L34 HydrophobicContact CD1-CD2 4.47Å; F30-L34 HydrophobicContact CE1-CD1 3.75Å; F30-L34 HydrophobicContact CE1-CD2 3.96Å; F30-L34 HydrophobicContact CE1-CG 4.49Å; F30-L34 HydrophobicContact CE2-CD1 4.32Å; F30-L34 HydrophobicContact CZ-CD1 3.79Å; F30-L34 WeakPolarHBondContact O-CB 2.94Å; F30-L34 PolarHBondContact O-N 3.49Å |
| 31 | T | 72.8 | Confident | 76.8 | Confident | 87 Ų | 87 | 92.4 Ų | 92.4 | 53% | 0.534 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.8 | -41.3 | 177.1 | -49.3 | 0 | 0 | 0 | 0 | 112.1 | G28 F29 L34 G35 | G28-T31 PolarHBondContact O-N 2.92Å; F29-T31 VanDerWaalsContact C-N 3.3Å; F29-T31 PolarHBondContact O-N 3.39Å; T31-L34 PolarHBondContact O-N 3Å; T31-G35 PolarHBondContact O-N 2.8Å |
| 32 | D | 77.8 | Confident | 75.9 | Confident | 98 Ų | 98 | 94.5 Ų | 94.5 | 52% | 0.524 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.2 | -43.3 | 175.4 | -177 | 50.1 | 0 | 0 | 0 | 111.3 | G28 F29 L34 G35 L36 | G28-D32 VanDerWaalsContact O-CB 3.25Å; G28-D32 WeakPolarHBondContact O-CB 3.4Å; G28-D32 PolarHBondContact O-N 3.24Å; F29-D32 PolarHBondContact O-N 2.85Å; D32-L34 PolarHBondContact O-N 3.11Å; D32-G35 PolarHBondContact O-N 3.41Å; D32-G35 VanDerWaalsContact O-N 3.11Å; D32-L36 WeakPolarHBondContact O-CB 2.71Å; D32-L36 WeakPolarHBondContact O-CG 3.29Å; D32-L36 PolarHBondContact O-N 3.46Å |
| 33 | F | 82 | Confident | 74.9 | Confident | 123 Ų | 123 | 91.9 Ų | 91.9 | 54% | 0.539 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.7 | -44.9 | 174.5 | -172.4 | -98.5 | 0 | 0 | 0 | 112.1 | F29 F30 L37 | F29-F33 WeakPolarHBondContact O-CB 3.48Å; F29-F33 PolarHBondContact O-N 3.02Å; F30-F33 PolarHBondContact O-N 3.44Å; F33-L37 VanDerWaalsContact O-CB 3.25Å; F33-L37 WeakPolarHBondContact O-CB 3.38Å; F33-L37 PolarHBondContact O-N 3.13Å |
| 34 | L | 75.2 | Confident | 74 | Confident | 81 Ų | 81 | 91.1 Ų | 91.1 | 42% | 0.424 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.4 | -39.6 | 173.3 | -108.7 | 63.7 | 0 | 0 | 0 | 111.8 | F30 T31 D32 L37 L38 | F30-L34 HydrophobicContact CD1-CD1 4.26Å; F30-L34 HydrophobicContact CD1-CD2 4.47Å; F30-L34 HydrophobicContact CE1-CD1 3.75Å; F30-L34 HydrophobicContact CE1-CD2 3.96Å; F30-L34 HydrophobicContact CE1-CG 4.49Å; F30-L34 HydrophobicContact CE2-CD1 4.32Å; F30-L34 HydrophobicContact CZ-CD1 3.79Å; F30-L34 WeakPolarHBondContact O-CB 2.94Å; F30-L34 PolarHBondContact O-N 3.49Å; T31-L34 PolarHBondContact O-N 3Å; D32-L34 PolarHBondContact O-N 3.11Å; L34-L37 PolarHBondContact O-N 2.82Å; L34-L38 VanDerWaalsContact O-CB 3.3Å; L34-L38 WeakPolarHBondContact O-CB 3.15Å; L34-L38 PolarHBondContact O-N 3.49Å |
| 35 | G | 77.3 | Confident | 73.3 | Confident | 38 Ų | 38 | 93.8 Ų | 93.8 | 39% | 0.392 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63 | -46.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | T31 D32 L38 L39 | T31-G35 PolarHBondContact O-N 2.8Å; D32-G35 PolarHBondContact O-N 3.41Å; D32-G35 VanDerWaalsContact O-N 3.11Å; G35-L38 PolarHBondContact O-N 2.93Å; G35-L39 PolarHBondContact O-N 3.48Å |
| 36 | L | 79.4 | Confident | 72.6 | Confident | 98 Ų | 98 | 96.2 Ų | 96.2 | 51% | 0.513 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.7 | -39.7 | 173.7 | -68.2 | 176.3 | 0 | 0 | 0 | 111.6 | D32 L38 L39 | D32-L36 WeakPolarHBondContact O-CB 2.71Å; D32-L36 WeakPolarHBondContact O-CG 3.29Å; D32-L36 PolarHBondContact O-N 3.46Å; L36-L38 VanDerWaalsContact C-N 3.32Å; L36-L38 PolarHBondContact O-N 3.38Å; L36-L39 WeakPolarHBondContact O-CB 3.35Å; L36-L39 PolarHBondContact O-N 3.32Å |
| 37 | L | 79.8 | Confident | 72.1 | Confident | 81 Ų | 81 | 94.4 Ų | 94.4 | 42% | 0.424 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.3 | -36 | 174.3 | -165.5 | 74 | 0 | 0 | 0 | 111.5 | F33 L34 L39 L40 V43 | F33-L37 VanDerWaalsContact O-CB 3.25Å; F33-L37 WeakPolarHBondContact O-CB 3.38Å; F33-L37 PolarHBondContact O-N 3.13Å; L34-L37 PolarHBondContact O-N 2.82Å; L37-L39 VanDerWaalsContact C-N 3.33Å; L37-L40 HydrophobicContact CD1-CD1 3.82Å; L37-L40 WeakPolarHBondContact O-CB 3.31Å; L37-L40 PolarHBondContact O-N 3.38Å; L37-V43 VanDerWaalsContact O-CG2 3.24Å; L37-V43 WeakPolarHBondContact O-CG2 3.41Å |
| 38 | L | 71.8 | Confident | 72 | Confident | 93 Ų | 93 | 93.8 Ų | 93.8 | 49% | 0.487 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -73 | -25.5 | 176.4 | -143.2 | 77.4 | 0 | 0 | 0 | 112.6 | L34 G35 L36 L40 V43 Q44 L47 | L34-L38 VanDerWaalsContact O-CB 3.3Å; L34-L38 WeakPolarHBondContact O-CB 3.15Å; L34-L38 PolarHBondContact O-N 3.49Å; G35-L38 PolarHBondContact O-N 2.93Å; L36-L38 VanDerWaalsContact C-N 3.32Å; L36-L38 PolarHBondContact O-N 3.38Å; L38-L40 PolarHBondContact O-N 3.19Å; L38-V43 HydrophobicContact CD1-CG1 3.65Å; L38-V43 HydrophobicContact CG-CG1 4.35Å; L38-Q44 WeakPolarHBondContact O-CG 3.49Å; L38-L47 HydrophobicContact CD1-CD2 4.48Å; L38-L47 HydrophobicContact CD2-CD2 4.43Å |
| 39 | L | 75.5 | Confident | 71.6 | Confident | 119 Ų | 119 | 97.2 Ų | 97.2 | 62% | 0.623 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -70.2 | -19.9 | 174 | -169.4 | 61.8 | 0 | 0 | 0 | 112 | G35 L36 L37 P41 Q44 | G35-L39 PolarHBondContact O-N 3.48Å; L36-L39 WeakPolarHBondContact O-CB 3.35Å; L36-L39 PolarHBondContact O-N 3.32Å; L37-L39 VanDerWaalsContact C-N 3.33Å; L39-P41 WeakPolarHBondContact O-CD 3.3Å; L39-Q44 PolarHBondContact O-NE2 2.91Å; L39-Q44 VanDerWaalsContact O-NE2 3.12Å |
| 40 | L | 81.1 | Confident | 71.1 | Confident | 85 Ų | 85 | 98.3 Ų | 98.3 | 45% | 0.445 | 52% | 0.518 | S | S | . | . | S | Bend | trans | -63.9 | 123.8 | 174.5 | -71.1 | 163 | 0 | 0 | 0 | 110.5 | L37 L38 P42 V43 Q44 | L37-L40 HydrophobicContact CD1-CD1 3.82Å; L37-L40 WeakPolarHBondContact O-CB 3.31Å; L37-L40 PolarHBondContact O-N 3.38Å; L38-L40 PolarHBondContact O-N 3.19Å; L40-P42 VanDerWaalsContact C-N 3.32Å; L40-P42 HydrophobicContact CB-CG 4.1Å; L40-P42 VanDerWaalsContact O-N 3.13Å; L40-V43 HydrophobicContact CB-CG2 4.28Å; L40-V43 WeakPolarHBondContact O-CB 3.32Å; L40-V43 PolarHBondContact O-N 2.94Å; L40-Q44 PolarHBondContact O-N 2.81Å |
| 41 | P | 69 | Low | 70.4 | Confident | 89 Ų | 89 | 96.6 Ų | 96.6 | 58% | 0.578 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -47.1 | -38.2 | 178 | -26.2 | 32.3 | 0 | 0 | 0 | 116.5 | L39 V43 Q44 K45 | L39-P41 WeakPolarHBondContact O-CD 3.3Å; P41-V43 VanDerWaalsContact C-N 3.28Å; P41-V43 PolarHBondContact O-N 3.37Å; P41-Q44 PolarHBondContact O-N 3.28Å; P41-K45 PolarHBondContact O-N 2.79Å; P41-K45 VanDerWaalsContact O-N 3.11Å |
| 42 | P | 68.3 | Low | 69.6 | Low | 84 Ų | 84 | 98 Ų | 98 | 55% | 0.545 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.4 | -33.2 | 176.3 | 22.5 | -35.4 | 0 | 0 | 0 | 113.4 | L40 H46 | L40-P42 VanDerWaalsContact C-N 3.32Å; L40-P42 HydrophobicContact CB-CG 4.1Å; L40-P42 VanDerWaalsContact O-N 3.13Å; P42-H46 PolarHBondContact O-N 3.24Å |
| 43 | V | 66.1 | Low | 68.9 | Low | 45 Ų | 45 | 97.2 Ų | 97.2 | 27% | 0.273 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -75.3 | -38.2 | -179.9 | -175.4 | 0 | 0 | 0 | 0 | 110.5 | L37 L38 L40 P41 K45 H46 L47 | L37-V43 VanDerWaalsContact O-CG2 3.24Å; L37-V43 WeakPolarHBondContact O-CG2 3.41Å; L38-V43 HydrophobicContact CD1-CG1 3.65Å; L38-V43 HydrophobicContact CG-CG1 4.35Å; L40-V43 HydrophobicContact CB-CG2 4.28Å; L40-V43 WeakPolarHBondContact O-CB 3.32Å; L40-V43 PolarHBondContact O-N 2.94Å; P41-V43 VanDerWaalsContact C-N 3.28Å; P41-V43 PolarHBondContact O-N 3.37Å; V43-K45 PolarHBondContact O-N 3.5Å; V43-H46 PolarHBondContact O-N 2.95Å; V43-L47 WeakPolarHBondContact O-CB 3.33Å; V43-L47 PolarHBondContact O-N 3.45Å |
| 44 | Q | 67.5 | Low | 67.7 | Low | 91 Ų | 91 | 98.4 Ų | 98.4 | 43% | 0.425 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.2 | -46.6 | 173 | -61.3 | -178.8 | 10.4 | 0 | 0 | 111.7 | L38 L39 L40 P41 H46 L47 T48 | L38-Q44 WeakPolarHBondContact O-CG 3.49Å; L39-Q44 PolarHBondContact O-NE2 2.91Å; L39-Q44 VanDerWaalsContact O-NE2 3.12Å; L40-Q44 PolarHBondContact O-N 2.81Å; P41-Q44 PolarHBondContact O-N 3.28Å; Q44-H46 PolarHBondContact O-N 3.4Å; Q44-L47 PolarHBondContact O-N 3.45Å; Q44-T48 WeakPolarHBondContact O-CB 3.33Å; Q44-T48 PolarHBondContact O-N 3.01Å; Q44-T48 PolarHBondContact O-OG1 3.5Å |
| 45 | K | 62.7 | Low | 66.9 | Low | 160 Ų | 160 | 100.2 Ų | 100.2 | 70% | 0.696 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.1 | -40.2 | -179.4 | -169.4 | 175.7 | 179.8 | -178.9 | 0 | 112.5 | P41 V43 V49 | P41-K45 PolarHBondContact O-N 2.79Å; P41-K45 VanDerWaalsContact O-N 3.11Å; V43-K45 PolarHBondContact O-N 3.5Å; K45-V49 VanDerWaalsContact O-CG2 3.3Å; K45-V49 WeakPolarHBondContact O-CG2 3.45Å; K45-V49 PolarHBondContact O-N 3.13Å |
| 46 | H | 64 | Low | 65.7 | Low | 154 Ų | 154 | 107.7 Ų | 107.7 | 71% | 0.713 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -68.9 | -38.3 | 175.1 | -89.5 | -38.4 | 0 | 0 | 0 | 112.9 | P42 V43 Q44 K50 | P42-H46 PolarHBondContact O-N 3.24Å; V43-H46 PolarHBondContact O-N 2.95Å; Q44-H46 PolarHBondContact O-N 3.4Å; H46-K50 PolarHBondContact O-N 2.87Å |
| 47 | L | 62.4 | Low | 64.5 | Low | 72 Ų | 72 | 111.6 Ų | 111.6 | 38% | 0.377 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -68.1 | -47.4 | 177.4 | -167.8 | 61.8 | 0 | 0 | 0 | 110.8 | L38 V43 Q44 V49 K50 L51 | L38-L47 HydrophobicContact CD1-CD2 4.48Å; L38-L47 HydrophobicContact CD2-CD2 4.43Å; V43-L47 WeakPolarHBondContact O-CB 3.33Å; V43-L47 PolarHBondContact O-N 3.45Å; Q44-L47 PolarHBondContact O-N 3.45Å; L47-V49 PolarHBondContact O-N 3.24Å; L47-K50 PolarHBondContact O-N 3.24Å; L47-K50 VanDerWaalsContact O-N 3.13Å; L47-L51 HydrophobicContact CD1-CD1 4.19Å; L47-L51 HydrophobicContact CD1-CD2 4.45Å; L47-L51 HydrophobicContact CG-CD2 4.35Å; L47-L51 VanDerWaalsContact O-CB 3.29Å; L47-L51 WeakPolarHBondContact O-CB 3.46Å; L47-L51 PolarHBondContact O-N 3.36Å |
| 48 | T | 64.3 | Low | 63.1 | Low | 85 Ų | 85 | 112.5 Ų | 112.5 | 52% | 0.521 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -59 | -44.2 | 179.3 | -54.8 | 0 | 0 | 0 | 0 | 112.6 | Q44 K50 L51 M52 | Q44-T48 WeakPolarHBondContact O-CB 3.33Å; Q44-T48 PolarHBondContact O-N 3.01Å; Q44-T48 PolarHBondContact O-OG1 3.5Å; T48-K50 VanDerWaalsContact C-N 3.26Å; T48-K50 PolarHBondContact O-N 3.41Å; T48-L51 PolarHBondContact O-N 3.35Å; T48-M52 WeakPolarHBondContact O-CB 3.36Å; T48-M52 PolarHBondContact O-N 3.29Å |
| 49 | V | 62.7 | Low | 61.9 | Low | 106 Ų | 106 | 119.9 Ų | 119.9 | 64% | 0.642 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -64.1 | -31.5 | 178.8 | 173.5 | 0 | 0 | 0 | 0 | 112.1 | K45 L47 | K45-V49 VanDerWaalsContact O-CG2 3.3Å; K45-V49 WeakPolarHBondContact O-CG2 3.45Å; K45-V49 PolarHBondContact O-N 3.13Å; L47-V49 PolarHBondContact O-N 3.24Å |
| 50 | K | 59.2 | Low | 60.9 | Low | 165 Ų | 165 | 121.7 Ų | 121.7 | 72% | 0.717 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -86.9 | -28.4 | 180 | -162.7 | 173.9 | 175.4 | 178.1 | 0 | 113.4 | H46 L47 T48 P53 | H46-K50 PolarHBondContact O-N 2.87Å; L47-K50 PolarHBondContact O-N 3.24Å; L47-K50 VanDerWaalsContact O-N 3.13Å; T48-K50 VanDerWaalsContact C-N 3.26Å; T48-K50 PolarHBondContact O-N 3.41Å; K50-P53 WeakPolarHBondContact O-CD 3.4Å |
| 51 | L | 59.7 | Low | 59.2 | Low | 74 Ų | 74 | 123.6 Ų | 123.6 | 39% | 0.387 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -92.3 | -23.4 | -177.9 | -123.6 | 66.4 | 0 | 0 | 0 | 113.2 | L47 T48 H54 L55 | L47-L51 HydrophobicContact CD1-CD1 4.19Å; L47-L51 HydrophobicContact CD1-CD2 4.45Å; L47-L51 HydrophobicContact CG-CD2 4.35Å; L47-L51 VanDerWaalsContact O-CB 3.29Å; L47-L51 WeakPolarHBondContact O-CB 3.46Å; L47-L51 PolarHBondContact O-N 3.36Å; T48-L51 PolarHBondContact O-N 3.35Å; L51-H54 PolarHBondContact O-N 2.95Å; L51-L55 HydrophobicContact CB-CD1 3.63Å; L51-L55 HydrophobicContact CB-CG 4.25Å; L51-L55 HydrophobicContact CD2-CD1 3.93Å; L51-L55 HydrophobicContact CD2-CG 4.35Å; L51-L55 HydrophobicContact CG-CD1 3.87Å; L51-L55 HydrophobicContact CG-CG 4.1Å; L51-L55 WeakPolarHBondContact O-CB 3.2Å; L51-L55 WeakPolarHBondContact O-CD1 3.32Å; L51-L55 WeakPolarHBondContact O-CG 3.45Å; L51-L55 PolarHBondContact O-N 3Å |
| 52 | M | 56.9 | Low | 58.3 | Low | 117 Ų | 117 | 122.7 Ų | 122.7 | 58% | 0.576 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58 | -33.1 | 178.6 | -169.9 | 160.1 | 178.6 | 0 | 0 | 115.6 | T48 | T48-M52 WeakPolarHBondContact O-CB 3.36Å; T48-M52 PolarHBondContact O-N 3.29Å |
| 53 | P | 61.1 | Low | 57.4 | Low | 81 Ų | 81 | 122.4 Ų | 122.4 | 53% | 0.526 | 64% | 0.64 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78 | -16.9 | 172.9 | -2.7 | 16.9 | 0 | 0 | 0 | 114.1 | K50 | K50-P53 WeakPolarHBondContact O-CD 3.4Š|
| 54 | H | 58.7 | Low | 56.6 | Low | 148 Ų | 148 | 123.8 Ų | 123.8 | 69% | 0.685 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.8 | -20.4 | -176.1 | -66.2 | 88.6 | 0 | 0 | 0 | 113.4 | L51 R56 | L51-H54 PolarHBondContact O-N 2.95Å; H54-R56 VanDerWaalsContact C-N 3.32Å |
| 55 | L | 56.6 | Low | 55.6 | Low | 119 Ų | 119 | 129.9 Ų | 129.9 | 62% | 0.623 | 69% | 0.689 | S | S | * | * | G | 310 helix | trans | -80 | -7.8 | 175.5 | -76.3 | 161.1 | 0 | 0 | 0 | 113.9 | L51 F57 | L51-L55 HydrophobicContact CB-CD1 3.63Å; L51-L55 HydrophobicContact CB-CG 4.25Å; L51-L55 HydrophobicContact CD2-CD1 3.93Å; L51-L55 HydrophobicContact CD2-CG 4.35Å; L51-L55 HydrophobicContact CG-CD1 3.87Å; L51-L55 HydrophobicContact CG-CG 4.1Å; L51-L55 WeakPolarHBondContact O-CB 3.2Å; L51-L55 WeakPolarHBondContact O-CD1 3.32Å; L51-L55 WeakPolarHBondContact O-CG 3.45Å; L51-L55 PolarHBondContact O-N 3Å; L55-F57 PolarHBondContact O-N 3.11Å |
| 56 | R | 52 | Low | 55.3 | Low | 196 Ų | 196 | 127.5 Ų | 127.5 | 74% | 0.74 | 69% | 0.692 | S | S | * | * | G | 310 helix | trans | -75.2 | 4.7 | 173.1 | -71 | -86.6 | -178.4 | 168.2 | -1.8 | 113.2 | H54 | H54-R56 VanDerWaalsContact C-N 3.32Š|
| 57 | F | 55.5 | Low | 54.5 | Low | 179 Ų | 179 | 125.4 Ų | 125.4 | 79% | 0.785 | 70% | 0.701 | S | S | * | * | G | 310 helix | trans | -115 | 23.5 | -176.1 | -75.7 | -79 | 0 | 0 | 0 | 115.3 | L55 | L55-F57 PolarHBondContact O-N 3.11Š|
| 58 | S | 49.2 | Very low | 54 | Low | 100 Ų | 100 | 125.1 Ų | 125.1 | 70% | 0.699 | 72% | 0.716 | S | S | * | * | trans | -144.2 | 69.9 | 164.7 | -75.3 | 0 | 0 | 0 | 0 | 112.4 | M60 | S58-M60 PolarHBondContact O-N 3.4Å; S58-M60 VanDerWaalsContact O-N 3.17Å | ||
| 59 | R | 48.3 | Very low | 53.3 | Low | 248 Ų | 248 | 128 Ų | 128 | 94% | 0.936 | 73% | 0.734 | S | S | * | * | trans | -71.1 | 85.1 | 137.3 | -74.6 | -175.4 | -165.4 | 136.9 | -0.2 | 106 | P61 | R59-P61 WeakPolarHBondContact O-CD 3.16Š| ||
| 60 | M | 53.9 | Low | 52.6 | Low | 157 Ų | 157 | 126.5 Ų | 126.5 | 77% | 0.773 | 74% | 0.739 | S | S | * | * | trans | -94.2 | 109.4 | 168 | -160.6 | 171 | -164.8 | 0 | 0 | 106.5 | S58 G62 | S58-M60 PolarHBondContact O-N 3.4Å; S58-M60 VanDerWaalsContact O-N 3.17Å; M60-G62 PolarHBondContact O-N 3.43Å | ||
| 61 | P | 46 | Very low | 52.1 | Low | 126 Ų | 126 | 122.7 Ų | 122.7 | 82% | 0.818 | 75% | 0.746 | S | S | * | * | trans | -74 | 121.7 | 165.3 | 30.2 | -27 | 0 | 0 | 0 | 106.7 | R59 | R59-P61 WeakPolarHBondContact O-CD 3.16Š| ||
| 62 | G | 48.3 | Very low | 52 | Low | 69 Ų | 69 | 122.1 Ų | 122.1 | 71% | 0.711 | 76% | 0.759 | S | S | * | * | trans | 112.4 | 123.7 | 169.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | M60 | M60-G62 PolarHBondContact O-N 3.43Š| ||
| 63 | G | 50 | Low | 52.4 | Low | 79 Ų | 79 | 122.8 Ų | 122.8 | 81% | 0.814 | 77% | 0.765 | S | S | * | * | trans | 147.7 | 18.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 64 | G | 50.1 | Low | 52.7 | Low | 73 Ų | 73 | 125.5 Ų | 125.5 | 75% | 0.753 | 78% | 0.78 | S | S | * | * | trans | -95.5 | 123.9 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | S66 | G64-S66 PolarHBondContact O-N 3.2Š| ||
| 65 | F | 46.9 | Very low | 53.4 | Low | 220 Ų | 220 | 126.9 Ų | 126.9 | 97% | 0.965 | 78% | 0.784 | S | S | * | * | trans | -60.8 | 96.8 | 166.9 | -75.3 | -97 | 0 | 0 | 0 | 109.6 | ||||
| 66 | S | 55.1 | Low | 54.3 | Low | 109 Ų | 109 | 128.8 Ų | 128.8 | 76% | 0.762 | 80% | 0.795 | S | S | * | * | trans | -153.6 | 68.4 | 160.3 | -174.2 | 0 | 0 | 0 | 0 | 109.2 | G64 G68 | G64-S66 PolarHBondContact O-N 3.2Å; S66-G68 PolarHBondContact O-N 3.1Å | ||
| 67 | A | 48.2 | Very low | 55.6 | Low | 110 Ų | 110 | 122.7 Ų | 122.7 | 91% | 0.909 | 79% | 0.794 | S | S | * | * | trans | -75.1 | 70.2 | 162.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 68 | G | 52.2 | Low | 56.8 | Low | 66 Ų | 66 | 123.1 Ų | 123.1 | 68% | 0.68 | 80% | 0.798 | S | S | * | * | trans | -103.5 | 91.7 | 166.4 | 0 | 0 | 0 | 0 | 0 | 108.1 | S66 G70 | S66-G68 PolarHBondContact O-N 3.1Å; G68-G70 PolarHBondContact O-N 3.41Å | ||
| 69 | T | 48.3 | Very low | 58.3 | Low | 147 Ų | 147 | 128 Ų | 128 | 90% | 0.902 | 80% | 0.803 | S | S | * | * | trans | -62.2 | 120.1 | 177.2 | -51.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 70 | G | 48.4 | Very low | 59.9 | Low | 73 Ų | 73 | 124.6 Ų | 124.6 | 75% | 0.753 | 80% | 0.797 | S | S | * | * | S | Bend | trans | 123.4 | 95.8 | 152.9 | 0 | 0 | 0 | 0 | 0 | 117.8 | G68 | G68-G70 PolarHBondContact O-N 3.41Š|
| 71 | G | 49 | Very low | 60.9 | Low | 85 Ų | 85 | 127.1 Ų | 127.1 | 88% | 0.876 | 80% | 0.798 | S | S | * | * | 78.4 | 42.5 | 128.1 | 0 | 0 | 0 | 0 | 0 | 120 | |||||
| 72 | G | 58.1 | Low | 62.2 | Low | 63 Ų | 63 | 129.6 Ų | 129.6 | 65% | 0.649 | 80% | 0.796 | S | S | * | * | trans | -112.2 | 114.1 | 167.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | T74 | G72-T74 PolarHBondContact O-N 3.44Š| ||
| 73 | N | 64.1 | Low | 63.5 | Low | 131 Ų | 131 | 132.5 Ų | 132.5 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | trans | -67.8 | 96.1 | 175.2 | -69.8 | 3.7 | 0 | 0 | 0 | 110 | F75 | N73-F75 HydrophobicContact CB-CD2 3.83Å; N73-F75 HydrophobicContact CB-CE2 3.32Å; N73-F75 HydrophobicContact CB-CZ 3.92Å; N73-F75 VanDerWaalsContact O-CD2 3.28Å; N73-F75 WeakPolarHBondContact O-CD2 3.26Å; N73-F75 PolarHBondContact O-N 2.83Å; N73-F75 VanDerWaalsContact O-N 3.14Å | ||
| 74 | T | 68.4 | Low | 64.5 | Low | 138 Ų | 138 | 136 Ų | 136 | 85% | 0.847 | 80% | 0.795 | S | S | * | * | trans | -73.3 | 101.5 | 166.2 | -56.4 | 0 | 0 | 0 | 0 | 108 | G72 | G72-T74 PolarHBondContact O-N 3.44Š| ||
| 75 | F | 72.2 | Confident | 65.2 | Low | 176 Ų | 176 | 141.2 Ų | 141.2 | 77% | 0.772 | 80% | 0.8 | S | S | * | * | trans | -83.5 | 119.4 | 172.3 | -70.6 | -86.9 | 0 | 0 | 0 | 109.2 | N73 | N73-F75 HydrophobicContact CB-CD2 3.83Å; N73-F75 HydrophobicContact CB-CE2 3.32Å; N73-F75 HydrophobicContact CB-CZ 3.92Å; N73-F75 VanDerWaalsContact O-CD2 3.28Å; N73-F75 WeakPolarHBondContact O-CD2 3.26Å; N73-F75 PolarHBondContact O-N 2.83Å; N73-F75 VanDerWaalsContact O-N 3.14Å | ||
| 76 | D | 76.9 | Confident | 65.9 | Low | 159 Ų | 159 | 142 Ų | 142 | 85% | 0.85 | 80% | 0.797 | S | S | * | * | trans | -85 | 120 | 172 | -154.2 | 60.5 | 0 | 0 | 0 | 108.3 | ||||
| 77 | G | 79.7 | Confident | 66.3 | Low | 69 Ų | 69 | 144 Ų | 144 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | trans | -90.6 | 104.7 | -176.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y79 | G77-Y79 PolarHBondContact O-N 3.32Š| ||
| 78 | E | 78.8 | Confident | 66.7 | Low | 188 Ų | 188 | 148.1 Ų | 148.1 | 88% | 0.879 | 79% | 0.791 | S | S | * | * | trans | -70.2 | 123.5 | 167.4 | -168.2 | 100.8 | -145 | 0 | 0 | 108.9 | ||||
| 79 | Y | 81.9 | Confident | 67.2 | Low | 203 Ų | 203 | 152.2 Ų | 152.2 | 80% | 0.796 | 80% | 0.796 | S | S | * | * | trans | -100.7 | 135.6 | 169.8 | 72.9 | -85.8 | 0 | 0 | 0 | 109.3 | G77 | G77-Y79 PolarHBondContact O-N 3.32Š| ||
| 80 | Q | 80.6 | Confident | 67.9 | Low | 176 Ų | 176 | 151.4 Ų | 151.4 | 82% | 0.822 | 79% | 0.786 | S | S | * | * | trans | -121.1 | 126.5 | 171.7 | -145.6 | 175.9 | 35.4 | 0 | 0 | 107.9 | K82 | Q80-K82 PolarHBondContact O-N 2.93Å; Q80-K82 VanDerWaalsContact O-N 3.07Å | ||
| 81 | R | 75.3 | Confident | 68.7 | Low | 210 Ų | 210 | 155.5 Ų | 155.5 | 79% | 0.792 | 79% | 0.785 | S | S | * | * | trans | -69.2 | 103.6 | 167 | -94.5 | -173.7 | 172.7 | -143.5 | 0.3 | 107.5 | D83 | R81-D83 PolarHBondContact O-N 2.93Š| ||
| 82 | K | 74.3 | Confident | 69.2 | Low | 178 Ų | 178 | 160.6 Ų | 160.6 | 77% | 0.774 | 78% | 0.783 | S | S | * | * | trans | -73.1 | 100.1 | 155.8 | -84.2 | -177.8 | 173.4 | -178.6 | 0 | 106.2 | Q80 D84 | Q80-K82 PolarHBondContact O-N 2.93Å; Q80-K82 VanDerWaalsContact O-N 3.07Å; K82-D84 PolarHBondContact O-N 3.41Å | ||
| 83 | D | 75.6 | Confident | 69.6 | Low | 130 Ų | 130 | 163.5 Ų | 163.5 | 70% | 0.695 | 78% | 0.784 | S | S | * | * | trans | -66.1 | 110.6 | 157.9 | -66.5 | -33.4 | 0 | 0 | 0 | 105.2 | R81 E85 | R81-D83 PolarHBondContact O-N 2.93Å; D83-E85 PolarHBondContact O-N 2.87Å | ||
| 84 | D | 69.8 | Low | 69.6 | Low | 151 Ų | 151 | 163.6 Ų | 163.6 | 81% | 0.807 | 79% | 0.785 | S | S | * | * | trans | -52.8 | 110.9 | -179 | -79 | -40.6 | 0 | 0 | 0 | 108.9 | K82 R86 | K82-D84 PolarHBondContact O-N 3.41Å; D84-R86 VanDerWaalsContact C-N 3.35Å; D84-R86 PolarHBondContact O-N 3.39Å | ||
| 85 | E | 65.5 | Low | 69.4 | Low | 184 Ų | 184 | 167.5 Ų | 167.5 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | trans | -60.8 | 102.1 | 172.2 | -163.5 | 175.7 | 139.1 | 0 | 0 | 105.7 | D83 D87 | D83-E85 PolarHBondContact O-N 2.87Å; E85-D87 PolarHBondContact O-N 2.94Å | ||
| 86 | R | 61.6 | Low | 69.1 | Low | 237 Ų | 237 | 166.9 Ų | 166.9 | 89% | 0.894 | 78% | 0.784 | S | S | * | * | trans | -31.4 | 102.5 | -179.2 | -79.9 | 177.2 | -77.3 | -156.1 | -5.5 | 109.8 | D84 R88 | D84-R86 VanDerWaalsContact C-N 3.35Å; D84-R86 PolarHBondContact O-N 3.39Å; R86-R88 PolarHBondContact O-N 2.85Å; R86-R88 VanDerWaalsContact O-N 3.16Å | ||
| 87 | D | 62.6 | Low | 68.5 | Low | 149 Ų | 149 | 170.5 Ų | 170.5 | 80% | 0.797 | 80% | 0.803 | S | S | * | * | trans | -52.3 | 124.7 | -179.5 | -149.3 | -2 | 0 | 0 | 0 | 106.8 | E85 L89 | E85-D87 PolarHBondContact O-N 2.94Å; D87-L89 VanDerWaalsContact C-N 3.33Å; D87-L89 PolarHBondContact O-N 3.17Å | ||
| 88 | R | 57 | Low | 67.9 | Low | 198 Ų | 198 | 175.6 Ų | 175.6 | 75% | 0.747 | 81% | 0.807 | S | S | * | * | trans | -51.9 | 99.6 | 178.1 | -80.9 | 173.9 | 151 | 114 | -6.8 | 107.8 | R86 D90 | R86-R88 PolarHBondContact O-N 2.85Å; R86-R88 VanDerWaalsContact O-N 3.16Å; R88-D90 PolarHBondContact O-N 3.07Å | ||
| 89 | L | 64.3 | Low | 67.3 | Low | 151 Ų | 151 | 174.9 Ų | 174.9 | 79% | 0.791 | 80% | 0.804 | S | S | * | * | trans | -77.6 | 70.7 | 160 | -67 | 173.7 | 0 | 0 | 0 | 106.7 | D87 H91 | D87-L89 VanDerWaalsContact C-N 3.33Å; D87-L89 PolarHBondContact O-N 3.17Å; L89-H91 PolarHBondContact O-N 3.4Å | ||
| 90 | D | 62.6 | Low | 66.5 | Low | 131 Ų | 131 | 173.4 Ų | 173.4 | 70% | 0.701 | 80% | 0.804 | S | S | * | * | trans | -68.2 | 72.2 | 158.9 | -75.7 | -39 | 0 | 0 | 0 | 106.9 | R88 K92 | R88-D90 PolarHBondContact O-N 3.07Å; D90-K92 VanDerWaalsContact C-N 3.27Å; D90-K92 PolarHBondContact O-N 2.9Å; D90-K92 VanDerWaalsContact O-N 3.1Å | ||
| 91 | H | 65 | Low | 65.7 | Low | 158 Ų | 158 | 173.2 Ų | 173.2 | 73% | 0.731 | 80% | 0.803 | S | S | * | * | trans | -78.4 | 88.8 | 164.1 | -105.1 | 55 | 0 | 0 | 0 | 107.6 | L89 D93 | L89-H91 PolarHBondContact O-N 3.4Å; H91-D93 PolarHBondContact O-N 2.77Å | ||
| 92 | K | 59.9 | Low | 65.1 | Low | 192 Ų | 192 | 170.9 Ų | 170.9 | 84% | 0.835 | 80% | 0.804 | S | S | * | * | trans | -51.6 | 111.1 | 150.9 | -160.6 | -177.7 | -165.8 | -178.9 | 0 | 107.3 | D90 | D90-K92 VanDerWaalsContact C-N 3.27Å; D90-K92 PolarHBondContact O-N 2.9Å; D90-K92 VanDerWaalsContact O-N 3.1Å | ||
| 93 | D | 66.4 | Low | 64.5 | Low | 124 Ų | 124 | 170.5 Ų | 170.5 | 66% | 0.663 | 81% | 0.806 | S | S | * | * | trans | -169.2 | 103 | 158.6 | -95.9 | -12 | 0 | 0 | 0 | 110 | H91 | H91-D93 PolarHBondContact O-N 2.77Š| ||
| 94 | D | 64.4 | Low | 63.7 | Low | 134 Ų | 134 | 173.4 Ų | 173.4 | 72% | 0.717 | 81% | 0.814 | S | S | * | * | 59.1 | 128.8 | 126.8 | -54.6 | -15.3 | 0 | 0 | 0 | 121.5 | |||||
| 95 | R | 63.9 | Low | 63.2 | Low | 220 Ų | 220 | 175.1 Ų | 175.1 | 83% | 0.83 | 81% | 0.814 | S | S | * | * | trans | 103.6 | 135.1 | 163.9 | -59.6 | 175.2 | -155.7 | -148.4 | 3.9 | 114.4 | ||||
| 96 | Q | 65.4 | Low | 63 | Low | 163 Ų | 163 | 174.3 Ų | 174.3 | 76% | 0.762 | 81% | 0.81 | S | S | * | * | cis | -163.5 | 151.9 | 6.7 | -122.9 | 162 | 14 | 0 | 0 | 107.9 | ||||
| 97 | D | 63.2 | Low | 63.2 | Low | 235 Ų | 235 | 168.6 Ų | 168.6 | 100% | 1.257 | 80% | 0.803 | S | S | * | * | trans | -55.5 | 0 | 171.6 | -52.1 | -74.1 | 0 | 0 | 0 | 114.8 |
Retrieved 97 of 97 residues in 17 ms
(Link to these results)