| 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 | 48.6 | Very low | 71.6 | Confident | 248 Ų | 248 | 142.8 Ų | 142.8 | 100% | 1.222 | 73% | 0.726 | S | S | * | * | 0 | 66.9 | 0 | -170.5 | 160.9 | 104.8 | 0 | 0 | 110.1 | |||||
| 2 | Q | 52.7 | Low | 73.6 | Confident | 172 Ų | 172 | 140.3 Ų | 140.3 | 80% | 0.804 | 71% | 0.709 | S | S | * | * | trans | -149.5 | -14.5 | -179.3 | -141 | 165.4 | 16.5 | 0 | 0 | 114 | ||||
| 3 | M | 53.8 | Low | 75.2 | Confident | 180 Ų | 180 | 133.8 Ų | 133.8 | 89% | 0.887 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -81.5 | -19.6 | -175.4 | -56.2 | -147.9 | 91.7 | 0 | 0 | 115.2 | ||
| 4 | A | 56.9 | Low | 76.7 | Confident | 91 Ų | 91 | 131.1 Ų | 131.1 | 75% | 0.752 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -78 | -23.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | N6 | A4-N6 VanDerWaalsContact C-N 3.32Å; A4-N6 PolarHBondContact O-N 3.47Å |
| 5 | M | 57.4 | Low | 78.1 | Confident | 149 Ų | 149 | 128.2 Ų | 128.2 | 73% | 0.734 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -70.7 | -26.4 | -178.4 | -70.5 | -66.3 | -162.2 | 0 | 0 | 112.9 | A9 | M5-A9 PolarHBondContact O-N 3.44Å |
| 6 | N | 72.9 | Confident | 79.3 | Confident | 126 Ų | 126 | 123.4 Ų | 123.4 | 67% | 0.674 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -74.2 | -35 | -174 | -158.8 | 10.4 | 0 | 0 | 0 | 112.8 | A4 R10 | A4-N6 VanDerWaalsContact C-N 3.32Å; A4-N6 PolarHBondContact O-N 3.47Å; N6-R10 WeakPolarHBondContact O-CB 3.38Å; N6-R10 PolarHBondContact O-N 3.19Å |
| 7 | G | 81 | Confident | 80.2 | Confident | 50 Ų | 50 | 122.2 Ų | 122.2 | 52% | 0.515 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -70.3 | -38.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | K11 | G7-K11 PolarHBondContact O-N 3.25Å; G7-K11 VanDerWaalsContact O-N 3.15Å |
| 8 | R | 87.6 | Confident | 81.2 | Confident | 180 Ų | 180 | 117.8 Ų | 117.8 | 68% | 0.679 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -68.5 | -49.6 | 179 | -164.3 | -174.7 | -154.4 | 164.6 | 9.3 | 111.5 | R10 K11 E12 | R8-R10 VanDerWaalsContact C-N 3.3Å; R8-R10 PolarHBondContact O-N 3.48Å; R8-K11 PolarHBondContact O-N 2.75Å; R8-K11 VanDerWaalsContact O-N 3.12Å; R8-E12 WeakPolarHBondContact CG-OE1 3.3Å; R8-E12 IonicContact NE-OE1 3.72Å; R8-E12 WeakPolarHBondContact O-CG 3.3Å; R8-E12 PolarHBondContact O-N 2.84Å |
| 9 | A | 89.8 | Confident | 82.1 | Confident | 50 Ų | 50 | 119.7 Ų | 119.7 | 41% | 0.413 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -58.3 | -41.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | M5 K11 E12 A13 | M5-A9 PolarHBondContact O-N 3.44Å; A9-K11 PolarHBondContact O-N 2.75Å; A9-E12 PolarHBondContact O-N 2.94Å; A9-A13 WeakPolarHBondContact O-CB 3.31Å; A9-A13 PolarHBondContact O-N 3.36Å |
| 10 | R | 93.3 | Very high | 82.8 | Confident | 179 Ų | 179 | 118 Ų | 118 | 68% | 0.675 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -61.7 | -44.5 | 175.2 | -179.2 | 176.9 | 177.9 | -177.9 | -0.1 | 112.3 | N6 R8 E12 A13 I14 | N6-R10 WeakPolarHBondContact O-CB 3.38Å; N6-R10 PolarHBondContact O-N 3.19Å; R8-R10 VanDerWaalsContact C-N 3.3Å; R8-R10 PolarHBondContact O-N 3.48Å; R10-E12 VanDerWaalsContact C-N 3.33Å; R10-A13 PolarHBondContact O-N 3.17Å; R10-I14 HydrophobicContact CG-CD1 3.95Å; R10-I14 VanDerWaalsContact O-CG1 3.28Å; R10-I14 WeakPolarHBondContact O-CG1 3.48Å; R10-I14 PolarHBondContact O-N 3.26Å |
| 11 | K | 93.8 | Very high | 83.5 | Confident | 146 Ų | 146 | 117.5 Ų | 117.5 | 64% | 0.635 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -63 | -42.3 | 178.6 | -173.4 | 178.4 | 179.5 | 179.9 | 0 | 111.1 | G7 R8 A9 I14 Q15 | G7-K11 PolarHBondContact O-N 3.25Å; G7-K11 VanDerWaalsContact O-N 3.15Å; R8-K11 PolarHBondContact O-N 2.75Å; R8-K11 VanDerWaalsContact O-N 3.12Å; A9-K11 PolarHBondContact O-N 2.75Å; K11-I14 PolarHBondContact O-N 3.17Å; K11-Q15 WeakPolarHBondContact O-CB 3.49Å; K11-Q15 VanDerWaalsContact O-CG 3.25Å; K11-Q15 WeakPolarHBondContact O-CG 3.3Å; K11-Q15 PolarHBondContact O-N 2.98Å |
| 12 | E | 95.6 | Very high | 85.8 | Confident | 112 Ų | 112 | 110.8 Ų | 110.8 | 52% | 0.523 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -63 | -44.5 | 177.1 | -72.7 | 167.2 | -173.6 | 0 | 0 | 111.7 | R8 A9 R10 I14 Q15 A16 | R8-E12 WeakPolarHBondContact CG-OE1 3.3Å; R8-E12 IonicContact NE-OE1 3.72Å; R8-E12 WeakPolarHBondContact O-CG 3.3Å; R8-E12 PolarHBondContact O-N 2.84Å; A9-E12 PolarHBondContact O-N 2.94Å; R10-E12 VanDerWaalsContact C-N 3.33Å; E12-I14 PolarHBondContact O-N 3.08Å; E12-Q15 PolarHBondContact O-N 3.23Å; E12-A16 WeakPolarHBondContact O-CB 3.36Å; E12-A16 PolarHBondContact O-N 3.01Å |
| 13 | A | 94.7 | Very high | 87.9 | Confident | 56 Ų | 56 | 107.5 Ų | 107.5 | 46% | 0.463 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -60.6 | -43.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | A9 R10 Q15 A16 T17 | A9-A13 WeakPolarHBondContact O-CB 3.31Å; A9-A13 PolarHBondContact O-N 3.36Å; R10-A13 PolarHBondContact O-N 3.17Å; A13-Q15 PolarHBondContact O-N 3.09Å; A13-A16 PolarHBondContact O-N 3.48Å; A13-T17 PolarHBondContact O-N 2.64Å; A13-T17 PolarHBondContact O-OG1 3.17Å; A13-T17 VanDerWaalsContact O-OG1 3.07Å |
| 14 | I | 96.1 | Very high | 90 | Very high | 96 Ų | 96 | 101 Ų | 101 | 49% | 0.492 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.5 | -44.4 | 176.4 | -68.3 | 165.2 | 0 | 0 | 0 | 110.7 | R10 K11 E12 A16 T17 A18 | R10-I14 HydrophobicContact CG-CD1 3.95Å; R10-I14 VanDerWaalsContact O-CG1 3.28Å; R10-I14 WeakPolarHBondContact O-CG1 3.48Å; R10-I14 PolarHBondContact O-N 3.26Å; K11-I14 PolarHBondContact O-N 3.17Å; E12-I14 PolarHBondContact O-N 3.08Å; I14-A16 VanDerWaalsContact C-N 3.35Å; I14-A16 PolarHBondContact O-N 2.96Å; I14-T17 PolarHBondContact O-N 2.93Å; I14-A18 WeakPolarHBondContact O-CB 3.46Å; I14-A18 PolarHBondContact O-N 2.99Å |
| 15 | Q | 97.4 | Very high | 91.8 | Very high | 88 Ų | 88 | 100.5 Ų | 100.5 | 41% | 0.411 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.8 | -38.7 | 178.5 | -73.5 | -68.3 | -44.4 | 0 | 0 | 112.1 | K11 E12 A13 A18 R19 | K11-Q15 WeakPolarHBondContact O-CB 3.49Å; K11-Q15 VanDerWaalsContact O-CG 3.25Å; K11-Q15 WeakPolarHBondContact O-CG 3.3Å; K11-Q15 PolarHBondContact O-N 2.98Å; E12-Q15 PolarHBondContact O-N 3.23Å; A13-Q15 PolarHBondContact O-N 3.09Å; Q15-A18 PolarHBondContact O-N 3.46Å; Q15-R19 WeakPolarHBondContact O-CB 3.35Å; Q15-R19 WeakPolarHBondContact O-CG 3.43Å; Q15-R19 PolarHBondContact O-N 3.22Å |
| 16 | A | 96.8 | Very high | 93.7 | Very high | 52 Ų | 52 | 99.7 Ų | 99.7 | 43% | 0.43 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.1 | -49.5 | 175 | 0 | 0 | 0 | 0 | 0 | 111 | E12 A13 I14 A18 R19 E20 | E12-A16 WeakPolarHBondContact O-CB 3.36Å; E12-A16 PolarHBondContact O-N 3.01Å; A13-A16 PolarHBondContact O-N 3.48Å; I14-A16 VanDerWaalsContact C-N 3.35Å; I14-A16 PolarHBondContact O-N 2.96Å; A16-A18 PolarHBondContact O-N 3.22Å; A16-R19 PolarHBondContact O-N 3.4Å; A16-E20 PolarHBondContact O-N 3.24Å |
| 17 | T | 95.6 | Very high | 94.6 | Very high | 103 Ų | 103 | 100.7 Ų | 100.7 | 63% | 0.632 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60.2 | -43.6 | 177.5 | -57.6 | 0 | 0 | 0 | 0 | 112.1 | A13 I14 R19 E20 L21 | A13-T17 PolarHBondContact O-N 2.64Å; A13-T17 PolarHBondContact O-OG1 3.17Å; A13-T17 VanDerWaalsContact O-OG1 3.07Å; I14-T17 PolarHBondContact O-N 2.93Å; T17-R19 PolarHBondContact O-N 2.96Å; T17-E20 PolarHBondContact O-N 2.78Å; T17-L21 PolarHBondContact O-N 3.25Å |
| 18 | A | 97.6 | Very high | 95.2 | Very high | 42 Ų | 42 | 99 Ų | 99 | 35% | 0.347 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | I14 Q15 A16 E20 L21 L22 | I14-A18 WeakPolarHBondContact O-CB 3.46Å; I14-A18 PolarHBondContact O-N 2.99Å; Q15-A18 PolarHBondContact O-N 3.46Å; A16-A18 PolarHBondContact O-N 3.22Å; A18-E20 VanDerWaalsContact C-N 3.34Å; A18-E20 PolarHBondContact O-N 3.22Å; A18-L21 WeakPolarHBondContact O-CB 3.06Å; A18-L21 PolarHBondContact O-N 2.86Å; A18-L22 WeakPolarHBondContact O-CG 3.19Å; A18-L22 PolarHBondContact O-N 3.19Å |
| 19 | R | 97.9 | Very high | 95.5 | Very high | 154 Ų | 154 | 95.5 Ų | 95.5 | 58% | 0.581 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.9 | -39.4 | 176.2 | -72.5 | 169.9 | -168.8 | -87.3 | -1.6 | 112 | Q15 A16 T17 L21 L22 K23 | Q15-R19 WeakPolarHBondContact O-CB 3.35Å; Q15-R19 WeakPolarHBondContact O-CG 3.43Å; Q15-R19 PolarHBondContact O-N 3.22Å; A16-R19 PolarHBondContact O-N 3.4Å; T17-R19 PolarHBondContact O-N 2.96Å; R19-L21 VanDerWaalsContact C-N 3.34Å; R19-L22 PolarHBondContact O-N 2.96Å; R19-K23 WeakPolarHBondContact O-CG 3.49Å; R19-K23 PolarHBondContact O-N 3.48Å |
| 20 | E | 97 | Very high | 95.7 | Very high | 86 Ų | 86 | 94.8 Ų | 94.8 | 40% | 0.402 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66.3 | -35.9 | 175.5 | -73.7 | -52.7 | 128.2 | 0 | 0 | 112.7 | A16 T17 A18 K23 F24 | A16-E20 PolarHBondContact O-N 3.24Å; T17-E20 PolarHBondContact O-N 2.78Å; A18-E20 VanDerWaalsContact C-N 3.34Å; A18-E20 PolarHBondContact O-N 3.22Å; E20-K23 PolarHBondContact O-N 2.92Å; E20-K23 WeakPolarHBondContact OE1-CD 3.32Å; E20-K23 WeakPolarHBondContact OE1-CE 3.45Å; E20-K23 IonicContact OE1-NZ 2.69Å; E20-K23 PolarHBondContact OE1-NZ 3.34Å; E20-F24 PolarHBondContact O-N 3.47Å |
| 21 | L | 96.8 | Very high | 95.6 | Very high | 108 Ų | 108 | 90.7 Ų | 90.7 | 57% | 0.565 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -63.9 | -45.6 | 172 | 177.9 | 62 | 0 | 0 | 0 | 111.4 | T17 A18 R19 K23 F24 V25 | T17-L21 PolarHBondContact O-N 3.25Å; A18-L21 WeakPolarHBondContact O-CB 3.06Å; A18-L21 PolarHBondContact O-N 2.86Å; R19-L21 VanDerWaalsContact C-N 3.34Å; L21-K23 VanDerWaalsContact C-N 3.31Å; L21-K23 PolarHBondContact O-N 3.5Å; L21-F24 WeakPolarHBondContact O-CB 3.46Å; L21-F24 PolarHBondContact O-N 3.45Å; L21-F24 VanDerWaalsContact O-N 3.07Å; L21-V25 HydrophobicContact CD1-CG2 4.19Å; L21-V25 HydrophobicContact CG-CG2 4.46Å; L21-V25 WeakPolarHBondContact O-CG2 3.45Å; L21-V25 PolarHBondContact O-N 3.41Å |
| 22 | L | 97.6 | Very high | 95.5 | Very high | 107 Ų | 107 | 89.8 Ų | 89.8 | 56% | 0.56 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -59.7 | -43.1 | 177 | -69.3 | 174 | 0 | 0 | 0 | 111.5 | A18 R19 F24 V25 N26 | A18-L22 WeakPolarHBondContact O-CG 3.19Å; A18-L22 PolarHBondContact O-N 3.19Å; R19-L22 PolarHBondContact O-N 2.96Å; L22-F24 VanDerWaalsContact C-N 3.29Å; L22-F24 PolarHBondContact O-N 3.35Å; L22-V25 PolarHBondContact O-N 3.03Å; L22-N26 WeakPolarHBondContact O-CB 3.37Å; L22-N26 PolarHBondContact O-N 2.85Å; L22-N26 PolarHBondContact O-ND2 3.31Å |
| 23 | K | 96.9 | Very high | 95.3 | Very high | 102 Ų | 102 | 88.9 Ų | 88.9 | 44% | 0.443 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -59.3 | -40.6 | 173.9 | -71.5 | 174.3 | -172.3 | 172.8 | 0 | 111.9 | R19 E20 L21 R27 | R19-K23 WeakPolarHBondContact O-CG 3.49Å; R19-K23 PolarHBondContact O-N 3.48Å; E20-K23 PolarHBondContact O-N 2.92Å; E20-K23 WeakPolarHBondContact OE1-CD 3.32Å; E20-K23 WeakPolarHBondContact OE1-CE 3.45Å; E20-K23 IonicContact OE1-NZ 2.69Å; E20-K23 PolarHBondContact OE1-NZ 3.34Å; L21-K23 VanDerWaalsContact C-N 3.31Å; L21-K23 PolarHBondContact O-N 3.5Å; K23-R27 VanDerWaalsContact O-CG 3.3Å; K23-R27 WeakPolarHBondContact O-CG 3.42Å; K23-R27 PolarHBondContact O-N 3.18Å |
| 24 | F | 96.5 | Very high | 95.2 | Very high | 43 Ų | 43 | 88.7 Ų | 88.7 | 19% | 0.189 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -64.6 | -48.7 | 177.7 | -178.9 | -98.5 | 0 | 0 | 0 | 112.3 | E20 L21 L22 R27 S28 V34 E37 | E20-F24 PolarHBondContact O-N 3.47Å; L21-F24 WeakPolarHBondContact O-CB 3.46Å; L21-F24 PolarHBondContact O-N 3.45Å; L21-F24 VanDerWaalsContact O-N 3.07Å; L22-F24 VanDerWaalsContact C-N 3.29Å; L22-F24 PolarHBondContact O-N 3.35Å; F24-R27 PolarHBondContact O-N 3.48Å; F24-S28 VanDerWaalsContact O-CB 3.3Å; F24-S28 WeakPolarHBondContact O-CB 3.35Å; F24-S28 PolarHBondContact O-N 2.74Å; F24-S28 PolarHBondContact O-OG 3.39Å; F24-V34 HydrophobicContact CE1-CG1 4.41Å; F24-V34 HydrophobicContact CZ-CG1 3.98Å; F24-E37 HydrophobicContact CD2-CB 4.42Å; F24-E37 HydrophobicContact CD2-CG 3.46Å; F24-E37 VanDerWaalsContact CD2-CG 3.46Å; F24-E37 HydrophobicContact CE2-CB 4.06Å; F24-E37 HydrophobicContact CE2-CG 3.53Å |
| 25 | V | 95.8 | Very high | 95 | Very high | 82 Ų | 82 | 88.2 Ų | 88.2 | 50% | 0.497 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -61.6 | -46.2 | 179.7 | 172.5 | 0 | 0 | 0 | 0 | 110.6 | L21 L22 R27 S28 | L21-V25 HydrophobicContact CD1-CG2 4.19Å; L21-V25 HydrophobicContact CG-CG2 4.46Å; L21-V25 WeakPolarHBondContact O-CG2 3.45Å; L21-V25 PolarHBondContact O-N 3.41Å; L22-V25 PolarHBondContact O-N 3.03Å; V25-R27 PolarHBondContact O-N 3.05Å; V25-S28 CarbonylContact O-C 3.56Å; V25-S28 PolarHBondContact O-N 3.19Å |
| 26 | N | 96 | Very high | 94.7 | Very high | 131 Ų | 131 | 86.7 Ų | 86.7 | 70% | 0.701 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -63.7 | -27.7 | 179.8 | -70.9 | -13.6 | 0 | 0 | 0 | 113.4 | L22 S28 | L22-N26 WeakPolarHBondContact O-CB 3.37Å; L22-N26 PolarHBondContact O-N 2.85Å; L22-N26 PolarHBondContact O-ND2 3.31Å; N26-S28 VanDerWaalsContact C-N 3.34Å |
| 27 | R | 93.6 | Very high | 94.6 | Very high | 147 Ų | 147 | 85.4 Ų | 85.4 | 56% | 0.555 | 45% | 0.453 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.5 | -7.9 | 174.6 | -71.2 | 176.7 | -179.1 | -179.5 | -0.3 | 113.5 | K23 F24 V25 P29 E37 | K23-R27 VanDerWaalsContact O-CG 3.3Å; K23-R27 WeakPolarHBondContact O-CG 3.42Å; K23-R27 PolarHBondContact O-N 3.18Å; F24-R27 PolarHBondContact O-N 3.48Å; V25-R27 PolarHBondContact O-N 3.05Å; R27-P29 VanDerWaalsContact O-CD 3.3Å; R27-P29 WeakPolarHBondContact O-CD 3.44Å; R27-E37 IonicContact NH1-OE1 3.46Å; R27-E37 PolarHBondContact NH1-OE1 3.26Å |
| 28 | S | 93.4 | Very high | 94.4 | Very high | 15 Ų | 15 | 83 Ų | 83 | 11% | 0.105 | 44% | 0.44 | C | S | . | . | trans | -123.9 | 60.2 | -168.9 | -52.7 | 0 | 0 | 0 | 0 | 113.2 | F24 V25 N26 S30 | F24-S28 VanDerWaalsContact O-CB 3.3Å; F24-S28 WeakPolarHBondContact O-CB 3.35Å; F24-S28 PolarHBondContact O-N 2.74Å; F24-S28 PolarHBondContact O-OG 3.39Å; V25-S28 CarbonylContact O-C 3.56Å; V25-S28 PolarHBondContact O-N 3.19Å; N26-S28 VanDerWaalsContact C-N 3.34Å; S28-S30 PolarHBondContact O-N 2.76Å; S28-S30 VanDerWaalsContact O-N 3.17Å | ||
| 29 | P | 93.4 | Very high | 94.2 | Very high | 106 Ų | 106 | 85.9 Ų | 85.9 | 69% | 0.688 | 44% | 0.442 | S | S | * | . | S | Bend | trans | -70.5 | -11 | -175.8 | 30.3 | -37.7 | 0 | 0 | 0 | 113.9 | R27 H33 | R27-P29 VanDerWaalsContact O-CD 3.3Å; R27-P29 WeakPolarHBondContact O-CD 3.44Å; P29-H33 HydrophobicContact CG-CB 4.42Å |
| 30 | S | 94.1 | Very high | 94 | Very high | 35 Ų | 35 | 80.7 Ų | 80.7 | 25% | 0.245 | 43% | 0.429 | C | S | . | . | S | Bend | trans | -143.4 | 161.6 | 174.9 | 82 | 0 | 0 | 0 | 0 | 111.4 | S28 F32 H33 V34 | S28-S30 PolarHBondContact O-N 2.76Å; S28-S30 VanDerWaalsContact O-N 3.17Å; S30-F32 PolarHBondContact O-N 3.04Å; S30-F32 VanDerWaalsContact O-N 3.08Å; S30-H33 PolarHBondContact O-N 3.38Å; S30-H33 PolarHBondContact OG-ND1 3.44Å; S30-V34 PolarHBondContact O-N 2.69Å |
| 31 | P | 90.4 | Very high | 93.8 | Very high | 93 Ų | 93 | 80.6 Ų | 80.6 | 60% | 0.604 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -53.8 | -31.4 | 177.5 | -27.4 | 35.3 | 0 | 0 | 0 | 113.7 | V34 V35 | P31-V34 WeakPolarHBondContact O-CB 3.45Å; P31-V34 PolarHBondContact O-N 3.34Å; P31-V35 WeakPolarHBondContact O-CG2 3.38Å; P31-V35 PolarHBondContact O-N 2.89Å |
| 32 | F | 91.4 | Very high | 93.6 | Very high | 127 Ų | 127 | 78 Ų | 78 | 56% | 0.557 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -69.2 | -39.5 | 176.2 | -57.3 | -72.4 | 0 | 0 | 0 | 112.4 | S30 V35 A36 | S30-F32 PolarHBondContact O-N 3.04Å; S30-F32 VanDerWaalsContact O-N 3.08Å; F32-V35 PolarHBondContact O-N 3.05Å; F32-A36 PolarHBondContact O-N 3.4Å |
| 33 | H | 93.1 | Very high | 93.4 | Very high | 94 Ų | 94 | 76.3 Ų | 76.3 | 44% | 0.435 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -69.3 | -36.1 | 175.3 | -64.7 | 96.6 | 0 | 0 | 0 | 111.7 | P29 S30 V35 A36 E37 | P29-H33 HydrophobicContact CG-CB 4.42Å; S30-H33 PolarHBondContact O-N 3.38Å; S30-H33 PolarHBondContact OG-ND1 3.44Å; H33-V35 VanDerWaalsContact C-N 3.31Å; H33-V35 PolarHBondContact O-N 2.99Å; H33-A36 PolarHBondContact O-N 3.4Å; H33-E37 WeakPolarHBondContact O-CB 3.37Å; H33-E37 PolarHBondContact O-N 2.99Å |
| 34 | V | 91.2 | Very high | 93.2 | Very high | 51 Ų | 51 | 78.6 Ų | 78.6 | 31% | 0.309 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -54.7 | -49.2 | 171.5 | 175.7 | 0 | 0 | 0 | 0 | 110.3 | F24 S30 P31 A36 E37 C38 | F24-V34 HydrophobicContact CE1-CG1 4.41Å; F24-V34 HydrophobicContact CZ-CG1 3.98Å; S30-V34 PolarHBondContact O-N 2.69Å; P31-V34 WeakPolarHBondContact O-CB 3.45Å; P31-V34 PolarHBondContact O-N 3.34Å; V34-A36 PolarHBondContact O-N 3.43Å; V34-E37 PolarHBondContact O-N 3.43Å; V34-C38 WeakPolarHBondContact O-CB 3.22Å; V34-C38 PolarHBondContact O-N 2.99Å; V34-C38 PolarHBondContact O-SG 2.96Å; V34-C38 VanDerWaalsContact O-SG 3.34Å |
| 35 | V | 92.4 | Very high | 93 | Very high | 87 Ų | 87 | 80 Ų | 80 | 53% | 0.527 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -63.8 | -41 | 178.9 | 172.9 | 0 | 0 | 0 | 0 | 111.4 | P31 F32 H33 C38 R39 | P31-V35 WeakPolarHBondContact O-CG2 3.38Å; P31-V35 PolarHBondContact O-N 2.89Å; F32-V35 PolarHBondContact O-N 3.05Å; H33-V35 VanDerWaalsContact C-N 3.31Å; H33-V35 PolarHBondContact O-N 2.99Å; V35-C38 PolarHBondContact O-N 3Å; V35-R39 WeakPolarHBondContact O-CB 3.36Å; V35-R39 PolarHBondContact O-N 3.44Å |
| 36 | A | 91.3 | Very high | 92.8 | Very high | 55 Ų | 55 | 79 Ų | 79 | 46% | 0.455 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | F32 H33 V34 R39 S40 | F32-A36 PolarHBondContact O-N 3.4Å; H33-A36 PolarHBondContact O-N 3.4Å; V34-A36 PolarHBondContact O-N 3.43Å; A36-R39 PolarHBondContact O-N 3.21Å; A36-S40 PolarHBondContact O-N 2.98Å |
| 37 | E | 93.7 | Very high | 92.5 | Very high | 25 Ų | 25 | 75.3 Ų | 75.3 | 12% | 0.117 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -65.6 | -43.9 | 176.7 | 179.7 | 66.3 | -170.5 | 0 | 0 | 110.8 | F24 R27 H33 V34 R39 S40 R41 | F24-E37 HydrophobicContact CD2-CB 4.42Å; F24-E37 HydrophobicContact CD2-CG 3.46Å; F24-E37 VanDerWaalsContact CD2-CG 3.46Å; F24-E37 HydrophobicContact CE2-CB 4.06Å; F24-E37 HydrophobicContact CE2-CG 3.53Å; R27-E37 IonicContact NH1-OE1 3.46Å; R27-E37 PolarHBondContact NH1-OE1 3.26Å; H33-E37 WeakPolarHBondContact O-CB 3.37Å; H33-E37 PolarHBondContact O-N 2.99Å; V34-E37 PolarHBondContact O-N 3.43Å; E37-R39 PolarHBondContact O-N 3.39Å; E37-S40 WeakPolarHBondContact O-CB 3.21Å; E37-S40 PolarHBondContact O-N 2.92Å; E37-R41 WeakPolarHBondContact O-CG 3.44Å; E37-R41 PolarHBondContact O-N 2.95Å; E37-R41 IonicContact OE1-CZ 3.38Å; E37-R41 IonicContact OE1-NE 2.89Å; E37-R41 PolarHBondContact OE1-NE 3.49Å; E37-R41 IonicContact OE1-NH2 2.96Å; E37-R41 PolarHBondContact OE1-NH2 2.98Å |
| 38 | C | 92.9 | Very high | 92.2 | Very high | 53 Ų | 53 | 74.7 Ų | 74.7 | 36% | 0.358 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -57.4 | -46.3 | 172.9 | -78.1 | 0 | 0 | 0 | 0 | 112 | V34 V35 S40 R41 L42 | V34-C38 WeakPolarHBondContact O-CB 3.22Å; V34-C38 PolarHBondContact O-N 2.99Å; V34-C38 PolarHBondContact O-SG 2.96Å; V34-C38 VanDerWaalsContact O-SG 3.34Å; V35-C38 PolarHBondContact O-N 3Å; C38-S40 PolarHBondContact O-N 3.07Å; C38-R41 PolarHBondContact O-N 3.44Å; C38-L42 WeakPolarHBondContact O-CB 3.47Å; C38-L42 WeakPolarHBondContact O-CG 3.46Å; C38-L42 PolarHBondContact O-N 2.97Å |
| 39 | R | 92.3 | Very high | 91.8 | Very high | 103 Ų | 103 | 77.1 Ų | 77.1 | 39% | 0.389 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -58.6 | -47.9 | 175.7 | -177.6 | -143.7 | -178.5 | -158.1 | -2.3 | 110.9 | V35 A36 E37 R41 L42 L43 E49 K67 | V35-R39 WeakPolarHBondContact O-CB 3.36Å; V35-R39 PolarHBondContact O-N 3.44Å; A36-R39 PolarHBondContact O-N 3.21Å; E37-R39 PolarHBondContact O-N 3.39Å; R39-R41 VanDerWaalsContact C-N 3.35Å; R39-R41 PolarHBondContact O-N 3.35Å; R39-L42 PolarHBondContact O-N 3.48Å; R39-L43 HydrophobicContact CG-CD1 4.11Å; R39-L43 HydrophobicContact CG-CG 4.43Å; R39-L43 WeakPolarHBondContact O-CG 3.43Å; R39-L43 PolarHBondContact O-N 3.33Å; R39-E49 IonicContact CZ-OE1 3.57Å; R39-E49 IonicContact CZ-OE2 3.21Å; R39-E49 VanDerWaalsContact NE-CD 3.29Å; R39-E49 IonicContact NE-OE1 2.93Å; R39-E49 PolarHBondContact NE-OE1 2.92Å; R39-E49 IonicContact NE-OE2 2.99Å; R39-E49 PolarHBondContact NE-OE2 3.38Å; R39-E49 IonicContact NH2-OE1 3.54Å; R39-E49 IonicContact NH2-OE2 2.64Å; R39-E49 PolarHBondContact NH2-OE2 3.4Å; R39-K67 VanDerWaalsContact CD-NZ 3.31Å |
| 40 | S | 93.5 | Very high | 91.4 | Very high | 45 Ų | 45 | 72.7 Ų | 72.7 | 32% | 0.315 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -57.1 | -47.4 | 179.6 | -176.4 | 0 | 0 | 0 | 0 | 111.9 | A36 E37 C38 L42 L43 Q44 | A36-S40 PolarHBondContact O-N 2.98Å; E37-S40 WeakPolarHBondContact O-CB 3.21Å; E37-S40 PolarHBondContact O-N 2.92Å; C38-S40 PolarHBondContact O-N 3.07Å; S40-L42 VanDerWaalsContact C-N 3.33Å; S40-L42 PolarHBondContact O-N 3.29Å; S40-L43 PolarHBondContact O-N 3.02Å; S40-Q44 WeakPolarHBondContact O-CG 3.19Å; S40-Q44 PolarHBondContact O-N 3.42Å; S40-Q44 PolarHBondContact OG-NE2 3.35Å |
| 41 | R | 94.3 | Very high | 90.8 | Very high | 83 Ų | 83 | 77.1 Ų | 77.1 | 31% | 0.313 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -63.5 | -38.4 | 177.8 | -68.8 | 179.4 | -175.3 | -141.8 | -3.2 | 112.7 | E37 C38 R39 Q44 A45 | E37-R41 WeakPolarHBondContact O-CG 3.44Å; E37-R41 PolarHBondContact O-N 2.95Å; E37-R41 IonicContact OE1-CZ 3.38Å; E37-R41 IonicContact OE1-NE 2.89Å; E37-R41 PolarHBondContact OE1-NE 3.49Å; E37-R41 IonicContact OE1-NH2 2.96Å; E37-R41 PolarHBondContact OE1-NH2 2.98Å; C38-R41 PolarHBondContact O-N 3.44Å; R39-R41 VanDerWaalsContact C-N 3.35Å; R39-R41 PolarHBondContact O-N 3.35Å; R41-Q44 PolarHBondContact O-N 3.03Å; R41-A45 WeakPolarHBondContact O-CB 3.35Å; R41-A45 PolarHBondContact O-N 3.27Å |
| 42 | L | 92.9 | Very high | 90.2 | Very high | 53 Ų | 53 | 76.2 Ų | 76.2 | 28% | 0.277 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -67.2 | -44.1 | 177.1 | -70.5 | 169 | 0 | 0 | 0 | 111.6 | C38 R39 S40 Q44 A45 G46 F47 K65 | C38-L42 WeakPolarHBondContact O-CB 3.47Å; C38-L42 WeakPolarHBondContact O-CG 3.46Å; C38-L42 PolarHBondContact O-N 2.97Å; R39-L42 PolarHBondContact O-N 3.48Å; S40-L42 VanDerWaalsContact C-N 3.33Å; S40-L42 PolarHBondContact O-N 3.29Å; L42-Q44 VanDerWaalsContact C-N 3.3Å; L42-Q44 PolarHBondContact O-N 3.11Å; L42-A45 CarbonylContact O-C 3.58Å; L42-A45 PolarHBondContact O-N 2.99Å; L42-A45 VanDerWaalsContact O-N 3.11Å; L42-G46 PolarHBondContact O-N 2.92Å; L42-F47 HydrophobicContact CB-CB 4.15Å; L42-F47 HydrophobicContact CB-CD2 3.83Å; L42-F47 HydrophobicContact CB-CG 4.34Å; L42-F47 HydrophobicContact CD2-CD2 3.41Å; L42-F47 VanDerWaalsContact CD2-CD2 3.41Å; L42-F47 HydrophobicContact CD2-CE2 3.65Å; L42-F47 HydrophobicContact CD2-CG 4.22Å; L42-F47 HydrophobicContact CG-CD2 4.22Å; L42-F47 WeakPolarHBondContact O-CB 3.4Å; L42-F47 WeakPolarHBondContact O-CD2 3.44Å; L42-F47 PolarHBondContact O-N 3.43Å; L42-K65 HydrophobicContact CD1-CB 4.5Å; L42-K65 HydrophobicContact CD1-CD 4.39Å; L42-K65 HydrophobicContact CD1-CG 3.53Å |
| 43 | L | 92.9 | Very high | 89.6 | Confident | 73 Ų | 73 | 76.3 Ų | 76.3 | 38% | 0.382 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -60 | -42 | 175 | -68.6 | 173.9 | 0 | 0 | 0 | 111.5 | R39 S40 A45 G46 F47 E49 | R39-L43 HydrophobicContact CG-CD1 4.11Å; R39-L43 HydrophobicContact CG-CG 4.43Å; R39-L43 WeakPolarHBondContact O-CG 3.43Å; R39-L43 PolarHBondContact O-N 3.33Å; S40-L43 PolarHBondContact O-N 3.02Å; L43-A45 VanDerWaalsContact C-N 3.27Å; L43-A45 PolarHBondContact O-N 3.23Å; L43-G46 PolarHBondContact O-N 3.48Å; L43-F47 WeakPolarHBondContact CD2-O 3.49Å; L43-E49 HydrophobicContact CD2-CB 4.2Å |
| 44 | Q | 92.1 | Very high | 88.9 | Confident | 150 Ų | 150 | 76.6 Ų | 76.6 | 70% | 0.701 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -63.6 | -31.3 | 175.5 | -71.8 | 169.1 | 40.5 | 0 | 0 | 113 | S40 R41 L42 G46 | S40-Q44 WeakPolarHBondContact O-CG 3.19Å; S40-Q44 PolarHBondContact O-N 3.42Å; S40-Q44 PolarHBondContact OG-NE2 3.35Å; R41-Q44 PolarHBondContact O-N 3.03Å; L42-Q44 VanDerWaalsContact C-N 3.3Å; L42-Q44 PolarHBondContact O-N 3.11Å; Q44-G46 PolarHBondContact O-N 3.01Å |
| 45 | A | 93.1 | Very high | 87.8 | Confident | 71 Ų | 71 | 78.1 Ų | 78.1 | 59% | 0.587 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.9 | 5.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | R41 L42 L43 F47 | R41-A45 WeakPolarHBondContact O-CB 3.35Å; R41-A45 PolarHBondContact O-N 3.27Å; L42-A45 CarbonylContact O-C 3.58Å; L42-A45 PolarHBondContact O-N 2.99Å; L42-A45 VanDerWaalsContact O-N 3.11Å; L43-A45 VanDerWaalsContact C-N 3.27Å; L43-A45 PolarHBondContact O-N 3.23Å; A45-F47 HydrophobicContact CB-CD2 3.9Å; A45-F47 HydrophobicContact CB-CE2 3.77Å |
| 46 | G | 91.4 | Very high | 87 | Confident | 63 Ų | 63 | 79.2 Ų | 79.2 | 65% | 0.649 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86.7 | 10.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | L42 L43 Q44 | L42-G46 PolarHBondContact O-N 2.92Å; L43-G46 PolarHBondContact O-N 3.48Å; Q44-G46 PolarHBondContact O-N 3.01Å |
| 47 | F | 89.9 | Confident | 85.8 | Confident | 52 Ų | 52 | 82.9 Ų | 82.9 | 23% | 0.228 | 45% | 0.445 | C | S | . | . | P | Polyproline II helix | trans | -72 | 141.1 | 173.9 | -65.3 | -66.8 | 0 | 0 | 0 | 111.3 | L42 L43 A45 K63 | L42-F47 HydrophobicContact CB-CB 4.15Å; L42-F47 HydrophobicContact CB-CD2 3.83Å; L42-F47 HydrophobicContact CB-CG 4.34Å; L42-F47 HydrophobicContact CD2-CD2 3.41Å; L42-F47 VanDerWaalsContact CD2-CD2 3.41Å; L42-F47 HydrophobicContact CD2-CE2 3.65Å; L42-F47 HydrophobicContact CD2-CG 4.22Å; L42-F47 HydrophobicContact CG-CD2 4.22Å; L42-F47 WeakPolarHBondContact O-CB 3.4Å; L42-F47 WeakPolarHBondContact O-CD2 3.44Å; L42-F47 PolarHBondContact O-N 3.43Å; L43-F47 WeakPolarHBondContact CD2-O 3.49Å; A45-F47 HydrophobicContact CB-CD2 3.9Å; A45-F47 HydrophobicContact CB-CE2 3.77Å; F47-K63 HydrophobicContact CD1-CB 3.55Å; F47-K63 HydrophobicContact CD1-CD 4.44Å; F47-K63 HydrophobicContact CD1-CG 4.13Å; F47-K63 WeakPolarHBondContact CD1-O 3.34Å; F47-K63 HydrophobicContact CE1-CB 3.31Å; F47-K63 HydrophobicContact CE1-CD 3.38Å; F47-K63 HydrophobicContact CE1-CG 3.4Å; F47-K63 VanDerWaalsContact CE1-CG 3.4Å; F47-K63 HydrophobicContact CZ-CB 4.28Å; F47-K63 HydrophobicContact CZ-CD 3.65Å; F47-K63 HydrophobicContact CZ-CG 4.21Å |
| 48 | R | 86.6 | Confident | 84.5 | Confident | 134 Ų | 134 | 86 Ų | 86 | 51% | 0.506 | 46% | 0.462 | S | S | . | . | P | Polyproline II helix | trans | -90 | 129.9 | 173.2 | -173.3 | 171.1 | 68.2 | 120.7 | -6.5 | 110.3 | L50 | R48-L50 HydrophobicContact CG-CD2 4.5Å; R48-L50 VanDerWaalsContact CZ-CD2 3.47Å |
| 49 | E | 85.4 | Confident | 82.9 | Confident | 66 Ų | 66 | 87.4 Ų | 87.4 | 31% | 0.308 | 47% | 0.468 | S | S | . | . | P | Polyproline II helix | trans | -76 | 133.8 | 171.4 | -172.1 | 171 | -153.5 | 0 | 0 | 110 | R39 L43 K67 | R39-E49 IonicContact CZ-OE1 3.57Å; R39-E49 IonicContact CZ-OE2 3.21Å; R39-E49 VanDerWaalsContact NE-CD 3.29Å; R39-E49 IonicContact NE-OE1 2.93Å; R39-E49 PolarHBondContact NE-OE1 2.92Å; R39-E49 IonicContact NE-OE2 2.99Å; R39-E49 PolarHBondContact NE-OE2 3.38Å; R39-E49 IonicContact NH2-OE1 3.54Å; R39-E49 IonicContact NH2-OE2 2.64Å; R39-E49 PolarHBondContact NH2-OE2 3.4Å; L43-E49 HydrophobicContact CD2-CB 4.2Å; E49-K67 VanDerWaalsContact OE1-CD 3.31Å; E49-K67 WeakPolarHBondContact OE1-CD 3.45Å; E49-K67 WeakPolarHBondContact OE1-CE 3.28Å; E49-K67 IonicContact OE1-NZ 2.75Å; E49-K67 PolarHBondContact OE1-NZ 2.95Å |
| 50 | L | 84.6 | Confident | 81.1 | Confident | 14 Ų | 14 | 88.9 Ų | 88.9 | 7% | 0.073 | 49% | 0.491 | C | S | . | . | trans | -111.3 | 143.1 | 173.6 | -64.6 | -170.5 | 0 | 0 | 0 | 110.4 | R48 W56 V64 | R48-L50 HydrophobicContact CG-CD2 4.5Å; R48-L50 VanDerWaalsContact CZ-CD2 3.47Å; L50-W56 HydrophobicContact CD1-CB 4.22Å; L50-W56 HydrophobicContact CD1-CD2 4.07Å; L50-W56 HydrophobicContact CD1-CG 3.84Å; L50-V64 HydrophobicContact CB-CG1 3.82Å; L50-V64 HydrophobicContact CD1-CB 4.27Å; L50-V64 HydrophobicContact CD1-CG1 3.23Å; L50-V64 HydrophobicContact CD1-CG2 4.01Å; L50-V64 HydrophobicContact CG-CG1 3.53Å | ||
| 51 | K | 80.7 | Confident | 79.2 | Confident | 127 Ų | 127 | 95.5 Ų | 95.5 | 55% | 0.552 | 52% | 0.517 | S | S | * | . | trans | -88.5 | 137.3 | 170.5 | -64 | -169.4 | -149.9 | 136.2 | 0 | 109.8 | T53 E54 W56 | K51-T53 PolarHBondContact O-N 3.45Å; K51-E54 HydrophobicContact CB-CB 4.5Å; K51-E54 HydrophobicContact CB-CG 4.15Å; K51-E54 WeakPolarHBondContact CD-OE1 3.25Å; K51-E54 IonicContact NZ-OE1 2.75Å; K51-E54 PolarHBondContact NZ-OE1 3.49Å; K51-E54 PolarHBondContact O-N 3.25Å; K51-W56 PolarHBondContact O-NE1 2.95Å | ||
| 52 | E | 78.1 | Confident | 76.9 | Confident | 75 Ų | 75 | 94.8 Ų | 94.8 | 35% | 0.35 | 52% | 0.52 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.1 | -20.1 | 179.8 | -56.1 | -172.1 | 175.1 | 0 | 0 | 113.5 | R66 K67 | E52-R66 VanDerWaalsContact CD-NH2 3.34Å; E52-R66 HydrophobicContact CG-CB 4.43Å; E52-R66 HydrophobicContact CG-CG 4.03Å; E52-R66 WeakPolarHBondContact OE1-CB 3.43Å; E52-R66 WeakPolarHBondContact OE1-CG 3.43Å; E52-R66 IonicContact OE1-CZ 3.54Å; E52-R66 IonicContact OE1-NE 2.76Å; E52-R66 PolarHBondContact OE1-NE 3.07Å; E52-R66 IonicContact OE1-NH2 3.51Å; E52-R66 IonicContact OE2-CZ 3.48Å; E52-R66 IonicContact OE2-NE 3.39Å; E52-R66 PolarHBondContact OE2-NE 3.16Å; E52-R66 IonicContact OE2-NH2 2.74Å; E52-R66 PolarHBondContact OE2-NH2 2.8Å; E52-K67 PolarHBondContact OE1-N 3.4Å |
| 53 | T | 79.3 | Confident | 74.9 | Confident | 129 Ų | 129 | 99.5 Ų | 99.5 | 79% | 0.791 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.1 | -2.9 | -176.3 | 56.9 | 0 | 0 | 0 | 0 | 113.7 | K51 | K51-T53 PolarHBondContact O-N 3.45Š|
| 54 | E | 77.7 | Confident | 72.8 | Confident | 99 Ų | 99 | 98.2 Ų | 98.2 | 46% | 0.463 | 53% | 0.533 | S | S | . | . | S | Bend | trans | -107.9 | 150.4 | -178.3 | -67.6 | 172.6 | -173.9 | 0 | 0 | 110 | K51 W56 | K51-E54 HydrophobicContact CB-CB 4.5Å; K51-E54 HydrophobicContact CB-CG 4.15Å; K51-E54 WeakPolarHBondContact CD-OE1 3.25Å; K51-E54 IonicContact NZ-OE1 2.75Å; K51-E54 PolarHBondContact NZ-OE1 3.49Å; K51-E54 PolarHBondContact O-N 3.25Å; E54-W56 PolarHBondContact O-N 2.85Å; E54-W56 PolarHBondContact O-NE1 3.01Å |
| 55 | G | 69.1 | Low | 70.5 | Confident | 83 Ų | 83 | 97.9 Ų | 97.9 | 86% | 0.856 | 53% | 0.529 | S | S | * | . | trans | -66 | 130.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 56 | W | 75.6 | Confident | 68.2 | Low | 110 Ų | 110 | 102.6 Ų | 102.6 | 42% | 0.417 | 53% | 0.532 | S | S | . | . | trans | -94.9 | 112.8 | -175.6 | -60.5 | -9.8 | 0 | 0 | 0 | 110.8 | L50 K51 E54 I58 R66 | L50-W56 HydrophobicContact CD1-CB 4.22Å; L50-W56 HydrophobicContact CD1-CD2 4.07Å; L50-W56 HydrophobicContact CD1-CG 3.84Å; K51-W56 PolarHBondContact O-NE1 2.95Å; E54-W56 PolarHBondContact O-N 2.85Å; E54-W56 PolarHBondContact O-NE1 3.01Å; W56-I58 HydrophobicContact CB-CD1 4.08Å; W56-I58 HydrophobicContact CB-CG1 3.83Å; W56-I58 HydrophobicContact CE3-CD1 3.91Å; W56-I58 PolarHBondContact O-N 3.39Å; W56-R66 HydrophobicContact CH2-CG 3.95Å; W56-R66 HydrophobicContact CZ2-CG 4.3Å | ||
| 57 | D | 66 | Low | 66.3 | Low | 133 Ų | 133 | 103.8 Ų | 103.8 | 71% | 0.711 | 52% | 0.519 | S | S | * | . | trans | -90.5 | 91.3 | 165.4 | -167.7 | 12.2 | 0 | 0 | 0 | 108.7 | ||||
| 58 | I | 65.8 | Low | 64 | Low | 91 Ų | 91 | 107 Ų | 107 | 47% | 0.467 | 55% | 0.548 | S | S | . | . | trans | -94.1 | 101.1 | -175.5 | -55.5 | 177.7 | 0 | 0 | 0 | 108.8 | W56 | W56-I58 HydrophobicContact CB-CD1 4.08Å; W56-I58 HydrophobicContact CB-CG1 3.83Å; W56-I58 HydrophobicContact CE3-CD1 3.91Å; W56-I58 PolarHBondContact O-N 3.39Å | ||
| 59 | V | 58.7 | Low | 62.1 | Low | 81 Ų | 81 | 112.5 Ų | 112.5 | 49% | 0.491 | 57% | 0.568 | S | S | . | * | trans | -81.5 | 144.9 | 168 | -128.8 | 0 | 0 | 0 | 0 | 109.4 | E61 N62 | V59-E61 PolarHBondContact O-N 3.35Å; V59-N62 PolarHBondContact O-N 3.5Å; V59-N62 VanDerWaalsContact O-N 3.16Å | ||
| 60 | P | 54.5 | Low | 60.6 | Low | 135 Ų | 135 | 118.4 Ų | 118.4 | 88% | 0.877 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.7 | -1.4 | -166.8 | -24.9 | 35 | 0 | 0 | 0 | 117.8 | ||
| 61 | E | 55.2 | Low | 59.1 | Low | 183 Ų | 183 | 123.3 Ų | 123.3 | 86% | 0.855 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.8 | -2.8 | -179.9 | -64.6 | -166.1 | 169.8 | 0 | 0 | 114.6 | V59 | V59-E61 PolarHBondContact O-N 3.35Š|
| 62 | N | 44.4 | Very low | 57.5 | Low | 69 Ų | 69 | 126.3 Ų | 126.3 | 37% | 0.369 | 64% | 0.639 | S | S | . | * | trans | -101.2 | 113.1 | -175.6 | -77.6 | -49.4 | 0 | 0 | 0 | 112.5 | V59 V64 | V59-N62 PolarHBondContact O-N 3.5Å; V59-N62 VanDerWaalsContact O-N 3.16Å; N62-V64 WeakPolarHBondContact O-CG2 3.44Å | ||
| 63 | K | 51 | Low | 56.1 | Low | 151 Ų | 151 | 129.9 Ų | 129.9 | 66% | 0.657 | 67% | 0.666 | S | S | * | * | trans | -84.1 | 135.1 | 170.6 | -39.8 | 179.1 | -165.6 | 171.4 | 0 | 110.3 | F47 | F47-K63 HydrophobicContact CD1-CB 3.55Å; F47-K63 HydrophobicContact CD1-CD 4.44Å; F47-K63 HydrophobicContact CD1-CG 4.13Å; F47-K63 WeakPolarHBondContact CD1-O 3.34Å; F47-K63 HydrophobicContact CE1-CB 3.31Å; F47-K63 HydrophobicContact CE1-CD 3.38Å; F47-K63 HydrophobicContact CE1-CG 3.4Å; F47-K63 VanDerWaalsContact CE1-CG 3.4Å; F47-K63 HydrophobicContact CZ-CB 4.28Å; F47-K63 HydrophobicContact CZ-CD 3.65Å; F47-K63 HydrophobicContact CZ-CG 4.21Å | ||
| 64 | V | 49.3 | Very low | 54.6 | Low | 47 Ų | 47 | 127.1 Ų | 127.1 | 29% | 0.285 | 66% | 0.663 | S | S | . | * | trans | -119.6 | 145.3 | -163.6 | -168.8 | 0 | 0 | 0 | 0 | 111.6 | L50 N62 | L50-V64 HydrophobicContact CB-CG1 3.82Å; L50-V64 HydrophobicContact CD1-CB 4.27Å; L50-V64 HydrophobicContact CD1-CG1 3.23Å; L50-V64 HydrophobicContact CD1-CG2 4.01Å; L50-V64 HydrophobicContact CG-CG1 3.53Å; N62-V64 WeakPolarHBondContact O-CG2 3.44Å | ||
| 65 | K | 43.6 | Very low | 53.3 | Low | 143 Ų | 143 | 133.6 Ų | 133.6 | 62% | 0.622 | 69% | 0.685 | S | S | * | * | trans | -133.4 | 144 | 168.6 | -73.6 | -63.2 | -172.1 | 176.9 | 0 | 113 | L42 | L42-K65 HydrophobicContact CD1-CB 4.5Å; L42-K65 HydrophobicContact CD1-CD 4.39Å; L42-K65 HydrophobicContact CD1-CG 3.53Å | ||
| 66 | R | 46.3 | Very low | 52.3 | Low | 169 Ų | 169 | 138.2 Ų | 138.2 | 64% | 0.638 | 68% | 0.684 | S | S | * | * | trans | -90.6 | 161.2 | -178.5 | -89 | -173 | 73.9 | 178 | 9.9 | 113.4 | E52 W56 | E52-R66 VanDerWaalsContact CD-NH2 3.34Å; E52-R66 HydrophobicContact CG-CB 4.43Å; E52-R66 HydrophobicContact CG-CG 4.03Å; E52-R66 WeakPolarHBondContact OE1-CB 3.43Å; E52-R66 WeakPolarHBondContact OE1-CG 3.43Å; E52-R66 IonicContact OE1-CZ 3.54Å; E52-R66 IonicContact OE1-NE 2.76Å; E52-R66 PolarHBondContact OE1-NE 3.07Å; E52-R66 IonicContact OE1-NH2 3.51Å; E52-R66 IonicContact OE2-CZ 3.48Å; E52-R66 IonicContact OE2-NE 3.39Å; E52-R66 PolarHBondContact OE2-NE 3.16Å; E52-R66 IonicContact OE2-NH2 2.74Å; E52-R66 PolarHBondContact OE2-NH2 2.8Å; W56-R66 HydrophobicContact CH2-CG 3.95Å; W56-R66 HydrophobicContact CZ2-CG 4.3Å | ||
| 67 | K | 50 | Low | 50.9 | Low | 89 Ų | 89 | 142.6 Ų | 142.6 | 39% | 0.387 | 71% | 0.709 | S | S | . | * | trans | -153.3 | 143.1 | 178.6 | -107 | -159.3 | -166.2 | 161.2 | 0 | 114.3 | R39 E49 E52 | R39-K67 VanDerWaalsContact CD-NZ 3.31Å; E49-K67 VanDerWaalsContact OE1-CD 3.31Å; E49-K67 WeakPolarHBondContact OE1-CD 3.45Å; E49-K67 WeakPolarHBondContact OE1-CE 3.28Å; E49-K67 IonicContact OE1-NZ 2.75Å; E49-K67 PolarHBondContact OE1-NZ 2.95Å; E52-K67 PolarHBondContact OE1-N 3.4Å | ||
| 68 | S | 42 | Very low | 50.3 | Low | 118 Ų | 118 | 142.2 Ų | 142.2 | 83% | 0.825 | 71% | 0.711 | S | S | * | * | trans | -113.4 | 155.4 | 169.3 | 61.1 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 69 | R | 45.9 | Very low | 49.9 | Very low | 250 Ų | 250 | 141.4 Ų | 141.4 | 94% | 0.943 | 73% | 0.726 | S | S | * | * | trans | -90.6 | 149.2 | -170 | -169.7 | 179.4 | -171.4 | -176.8 | 2.6 | 113.2 | ||||
| 70 | R | 54 | Low | 50.4 | Low | 191 Ų | 191 | 143.7 Ų | 143.7 | 72% | 0.721 | 74% | 0.739 | S | S | * | * | trans | -155.2 | 148.5 | 170.4 | -136.9 | 177 | -173.3 | -164.3 | -0.8 | 115.2 | ||||
| 71 | S | 54.8 | Low | 51.5 | Low | 116 Ų | 116 | 146.2 Ų | 146.2 | 81% | 0.811 | 74% | 0.739 | S | S | * | * | trans | -147.5 | 156 | 172.8 | 56.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 72 | Q | 46.4 | Very low | 52.6 | Low | 190 Ų | 190 | 142.3 Ų | 142.3 | 89% | 0.888 | 73% | 0.728 | S | S | * | * | trans | -168.5 | 155.1 | 158.3 | -138.5 | 173.9 | -2.9 | 0 | 0 | 114.1 | ||||
| 73 | V | 48.3 | Very low | 54.4 | Low | 150 Ų | 150 | 149.6 Ų | 149.6 | 91% | 0.909 | 75% | 0.752 | S | S | * | * | trans | -132.3 | 144.4 | -179 | 176.2 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 74 | G | 48.3 | Very low | 56.1 | Low | 71 Ų | 71 | 145.2 Ų | 145.2 | 73% | 0.732 | 75% | 0.75 | S | S | * | * | trans | 119.9 | 145.2 | 162.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 75 | Y | 49.6 | Very low | 58 | Low | 235 Ų | 235 | 147 Ų | 147 | 92% | 0.922 | 78% | 0.777 | S | S | * | * | trans | -98.1 | 136.3 | 179.7 | -58 | -87.5 | 0 | 0 | 0 | 112.9 | ||||
| 76 | H | 48.1 | Very low | 60 | Low | 180 Ų | 180 | 141.8 Ų | 141.8 | 83% | 0.833 | 76% | 0.764 | S | S | * | * | trans | -147.7 | 156.5 | 175.6 | -80.9 | -21.3 | 0 | 0 | 0 | 113 | V78 | H76-V78 PolarHBondContact O-N 3.36Š| ||
| 77 | Q | 46.8 | Very low | 62.1 | Low | 203 Ų | 203 | 139.6 Ų | 139.6 | 95% | 0.949 | 76% | 0.764 | S | S | * | * | trans | -52.2 | 134.1 | 166 | -85 | 176.5 | -23.7 | 0 | 0 | 110 | G79 | Q77-G79 PolarHBondContact O-N 2.97Š| ||
| 78 | V | 53.5 | Low | 63.7 | Low | 124 Ų | 124 | 140.4 Ų | 140.4 | 75% | 0.752 | 77% | 0.765 | S | S | * | * | trans | -99.9 | 94.7 | -170.4 | -171 | 0 | 0 | 0 | 0 | 110 | H76 V80 | H76-V78 PolarHBondContact O-N 3.36Å; V78-V80 HydrophobicContact CG1-CG1 3.86Å | ||
| 79 | G | 57.1 | Low | 65.8 | Low | 75 Ų | 75 | 139.1 Ų | 139.1 | 77% | 0.773 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 124.3 | 153.1 | 0 | 0 | 0 | 0 | 0 | 108.2 | Q77 | Q77-G79 PolarHBondContact O-N 2.97Š|
| 80 | V | 69 | Low | 67.9 | Low | 129 Ų | 129 | 132.1 Ų | 132.1 | 78% | 0.782 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -94.2 | 130.1 | 175 | -64.8 | 0 | 0 | 0 | 0 | 109.4 | V78 | V78-V80 HydrophobicContact CG1-CG1 3.86Š|
| 81 | E | 77.3 | Confident | 69.2 | Low | 187 Ų | 187 | 132.6 Ų | 132.6 | 87% | 0.874 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -92.2 | 132.6 | 170.7 | -69.6 | 179.3 | -177.8 | 0 | 0 | 109.4 | Y83 | E81-Y83 PolarHBondContact O-N 3.37Š|
| 82 | T | 79.3 | Confident | 70 | Confident | 101 Ų | 101 | 138.7 Ų | 138.7 | 62% | 0.62 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 118.3 | 173.7 | 51 | 0 | 0 | 0 | 0 | 109.7 | W88 | T82-W88 VanDerWaalsContact CB-CZ2 3.45Å; T82-W88 HydrophobicContact CG2-CD2 3.98Å; T82-W88 HydrophobicContact CG2-CE3 3.91Å; T82-W88 HydrophobicContact CG2-CH2 3.63Å; T82-W88 HydrophobicContact CG2-CZ2 3.67Å; T82-W88 HydrophobicContact CG2-CZ3 3.73Å |
| 83 | Y | 80.9 | Confident | 71.1 | Confident | 222 Ų | 222 | 136.2 Ų | 136.2 | 87% | 0.871 | 75% | 0.749 | S | S | * | * | trans | -105.2 | 120 | 173.2 | -176.2 | -98.5 | 0 | 0 | 0 | 110.4 | E81 | E81-Y83 PolarHBondContact O-N 3.37Š| ||
| 84 | G | 87.1 | Confident | 72.3 | Confident | 60 Ų | 60 | 135.4 Ų | 135.4 | 62% | 0.619 | 74% | 0.74 | S | S | * | * | S | Bend | trans | 79.4 | -164.2 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | W88 | G84-W88 WeakPolarHBondContact O-CZ2 3.49Š|
| 85 | G | 88.8 | Confident | 73.7 | Confident | 83 Ų | 83 | 139 Ų | 139 | 86% | 0.856 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -108.1 | 53.7 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 86 | G | 85.8 | Confident | 75.1 | Confident | 34 Ų | 34 | 133.4 Ų | 133.4 | 35% | 0.351 | 73% | 0.73 | S | S | . | * | trans | -67.8 | 156.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | W88 | G86-W88 PolarHBondContact O-N 3.5Å; G86-W88 VanDerWaalsContact O-N 3.09Å; G86-W88 PolarHBondContact O-NE1 3.15Å | ||
| 87 | I | 90.6 | Very high | 76.8 | Confident | 123 Ų | 123 | 130.4 Ų | 130.4 | 63% | 0.631 | 72% | 0.724 | S | S | * | * | trans | -78.2 | 91.3 | 169.5 | -55.8 | 176.7 | 0 | 0 | 0 | 107.6 | S89 T90 | I87-S89 WeakPolarHBondContact CG2-OG 3.4Å; I87-S89 PolarHBondContact O-N 3.02Å; I87-T90 HydrophobicContact CB-CG2 4.31Å; I87-T90 HydrophobicContact CG2-CG2 3.98Å; I87-T90 PolarHBondContact O-N 3.35Å; I87-T90 PolarHBondContact O-OG1 3.34Å | ||
| 88 | W | 83.7 | Confident | 78.8 | Confident | 106 Ų | 106 | 125.6 Ų | 125.6 | 40% | 0.402 | 71% | 0.709 | S | S | . | * | G | 310 helix | trans | -64 | -23.4 | -170.2 | -51.3 | 112.6 | 0 | 0 | 0 | 114.3 | T82 G84 G86 T90 W91 | T82-W88 VanDerWaalsContact CB-CZ2 3.45Å; T82-W88 HydrophobicContact CG2-CD2 3.98Å; T82-W88 HydrophobicContact CG2-CE3 3.91Å; T82-W88 HydrophobicContact CG2-CH2 3.63Å; T82-W88 HydrophobicContact CG2-CZ2 3.67Å; T82-W88 HydrophobicContact CG2-CZ3 3.73Å; G84-W88 WeakPolarHBondContact O-CZ2 3.49Å; G86-W88 PolarHBondContact O-N 3.5Å; G86-W88 VanDerWaalsContact O-N 3.09Å; G86-W88 PolarHBondContact O-NE1 3.15Å; W88-T90 PolarHBondContact O-N 3.12Å; W88-W91 PolarHBondContact O-N 3.19Å |
| 89 | S | 86.5 | Confident | 80.6 | Confident | 91 Ų | 91 | 125.7 Ų | 125.7 | 64% | 0.636 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -65.9 | -19.3 | 176.8 | 56.6 | 0 | 0 | 0 | 0 | 113.9 | I87 W91 | I87-S89 WeakPolarHBondContact CG2-OG 3.4Å; I87-S89 PolarHBondContact O-N 3.02Å; S89-W91 PolarHBondContact O-N 3.43Å |
| 90 | T | 91.1 | Very high | 82.4 | Confident | 104 Ų | 104 | 129.6 Ų | 129.6 | 64% | 0.638 | 70% | 0.701 | S | S | * | * | G | 310 helix | trans | -81.9 | -2.5 | 176.8 | 68.1 | 0 | 0 | 0 | 0 | 113.5 | I87 W88 | I87-T90 HydrophobicContact CB-CG2 4.31Å; I87-T90 HydrophobicContact CG2-CG2 3.98Å; I87-T90 PolarHBondContact O-N 3.35Å; I87-T90 PolarHBondContact O-OG1 3.34Å; W88-T90 PolarHBondContact O-N 3.12Å |
| 91 | W | 81.3 | Confident | 83.5 | Confident | 201 Ų | 201 | 129.7 Ų | 129.7 | 76% | 0.761 | 69% | 0.694 | S | S | * | * | G | 310 helix | trans | -97.3 | -0.8 | 180 | -70.8 | 73.8 | 0 | 0 | 0 | 113 | W88 S89 | W88-W91 PolarHBondContact O-N 3.19Å; S89-W91 PolarHBondContact O-N 3.43Å |
| 92 | F | 69.9 | Low | 84.1 | Confident | 244 Ų | 244 | 124.5 Ų | 124.5 | 100% | 1.07 | 68% | 0.678 | S | S | * | * | trans | -113.8 | 0 | 175.3 | -67.5 | -80.9 | 0 | 0 | 0 | 111.2 |
Retrieved 92 of 92 residues in 179.7 ms
(Link to these results)