| 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 | 42.5 | Very low | 62.2 | Low | 234 Ų | 234 | 141.7 Ų | 141.7 | 100% | 1.153 | 76% | 0.762 | S | S | * | * | 0 | 86.9 | 0 | -68.1 | 158 | 80.9 | 0 | 0 | 105.9 | |||||
| 2 | S | 47.8 | Very low | 64.6 | Low | 127 Ų | 127 | 133.4 Ų | 133.4 | 89% | 0.888 | 74% | 0.735 | S | S | * | * | trans | -108.7 | 93.5 | 175.7 | -63 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 3 | S | 53 | Low | 66.7 | Low | 88 Ų | 88 | 129.3 Ų | 129.3 | 62% | 0.615 | 71% | 0.711 | S | S | * | * | trans | -131.7 | 90.9 | -167.1 | -55 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 4 | N | 54.4 | Low | 68.5 | Low | 153 Ų | 153 | 125.7 Ų | 125.7 | 82% | 0.818 | 69% | 0.686 | S | S | * | * | trans | 55.8 | 71.5 | 148.6 | -50.8 | -25.6 | 0 | 0 | 0 | 117.4 | E6 | N4-E6 PolarHBondContact O-N 3.33Š| ||
| 5 | D | 55.6 | Low | 70.2 | Confident | 155 Ų | 155 | 127.3 Ų | 127.3 | 83% | 0.829 | 68% | 0.684 | S | S | * | * | trans | -85.5 | 43.8 | 161.9 | -62.2 | -53.3 | 0 | 0 | 0 | 111.4 | E7 | D5-E7 PolarHBondContact O-N 3.09Å; D5-E7 VanDerWaalsContact O-N 3.17Å | ||
| 6 | E | 55.4 | Low | 71.8 | Confident | 186 Ų | 186 | 127.5 Ų | 127.5 | 87% | 0.869 | 68% | 0.677 | S | S | * | * | trans | -81.6 | 75 | 152.1 | -89.1 | -168.7 | 110.1 | 0 | 0 | 106.1 | N4 Q8 | N4-E6 PolarHBondContact O-N 3.33Å; E6-Q8 VanDerWaalsContact C-N 3.35Å; E6-Q8 PolarHBondContact O-N 3.18Å | ||
| 7 | E | 59.2 | Low | 73.2 | Confident | 164 Ų | 164 | 124.5 Ų | 124.5 | 77% | 0.766 | 66% | 0.66 | S | S | * | * | trans | -56.7 | 100.9 | 171.6 | -168.5 | 162.1 | 130.6 | 0 | 0 | 107.2 | D5 V9 | D5-E7 PolarHBondContact O-N 3.09Å; D5-E7 VanDerWaalsContact O-N 3.17Å; E7-V9 VanDerWaalsContact C-N 3.3Å; E7-V9 PolarHBondContact O-N 2.89Å | ||
| 8 | Q | 64.2 | Low | 74.4 | Confident | 188 Ų | 188 | 123.1 Ų | 123.1 | 88% | 0.879 | 65% | 0.65 | S | S | * | * | trans | -56.8 | 99.4 | 172.2 | -72 | 178.7 | 14.2 | 0 | 0 | 106.9 | E6 D10 | E6-Q8 VanDerWaalsContact C-N 3.35Å; E6-Q8 PolarHBondContact O-N 3.18Å; Q8-D10 PolarHBondContact O-N 3.06Å; Q8-D10 VanDerWaalsContact O-N 3.07Å | ||
| 9 | V | 75.1 | Confident | 75.6 | Confident | 69 Ų | 69 | 119.5 Ų | 119.5 | 42% | 0.418 | 64% | 0.639 | S | S | . | * | trans | -54.2 | 118.6 | 177.7 | 177.6 | 0 | 0 | 0 | 0 | 107.3 | E7 L13 Q14 L17 | E7-V9 VanDerWaalsContact C-N 3.3Å; E7-V9 PolarHBondContact O-N 2.89Å; V9-L13 HydrophobicContact CG1-CB 4.13Å; V9-L13 HydrophobicContact CG1-CD2 4.02Å; V9-L13 HydrophobicContact CG1-CG 4Å; V9-Q14 HydrophobicContact CG1-CB 4.06Å; V9-L17 HydrophobicContact CG1-CD1 4.41Å | ||
| 10 | D | 87.7 | Confident | 76.6 | Confident | 100 Ų | 100 | 116.6 Ų | 116.6 | 54% | 0.535 | 62% | 0.622 | S | S | . | * | trans | -49.2 | 130.1 | 177.8 | 170.4 | 63.1 | 0 | 0 | 0 | 109.5 | Q8 G12 L13 Q14 | Q8-D10 PolarHBondContact O-N 3.06Å; Q8-D10 VanDerWaalsContact O-N 3.07Å; D10-G12 PolarHBondContact O-N 3.07Å; D10-G12 VanDerWaalsContact OD2-CA 3.32Å; D10-G12 WeakPolarHBondContact OD2-CA 3.36Å; D10-G12 PolarHBondContact OD2-N 2.87Å; D10-L13 HydrophobicContact CB-CB 4.09Å; D10-L13 CarbonylContact O-C 3.6Å; D10-L13 WeakPolarHBondContact O-CA 3.48Å; D10-L13 WeakPolarHBondContact O-CB 3.32Å; D10-L13 PolarHBondContact O-N 3.14Å; D10-L13 PolarHBondContact OD2-N 3.49Å; D10-Q14 PolarHBondContact O-N 3.02Å | ||
| 11 | P | 89.2 | Confident | 77.6 | Confident | 95 Ų | 95 | 114.1 Ų | 114.1 | 62% | 0.617 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -55.3 | -26.5 | -178.1 | -28.7 | 35.2 | 0 | 0 | 0 | 114.3 | K15 | P11-K15 WeakPolarHBondContact O-CG 3.49Å; P11-K15 PolarHBondContact O-N 2.9Å |
| 12 | G | 91.1 | Very high | 80.2 | Confident | 42 Ų | 42 | 109.3 Ų | 109.3 | 43% | 0.433 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -70.1 | -45.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | D10 K15 F16 | D10-G12 PolarHBondContact O-N 3.07Å; D10-G12 VanDerWaalsContact OD2-CA 3.32Å; D10-G12 WeakPolarHBondContact OD2-CA 3.36Å; D10-G12 PolarHBondContact OD2-N 2.87Å; G12-K15 PolarHBondContact O-N 3.31Å; G12-F16 PolarHBondContact O-N 2.85Å; G12-F16 VanDerWaalsContact O-N 3.09Å |
| 13 | L | 92.1 | Very high | 82.6 | Confident | 80 Ų | 80 | 111.3 Ų | 111.3 | 42% | 0.419 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -60.1 | -43.6 | 173.2 | -179.2 | 60 | 0 | 0 | 0 | 111.7 | V9 D10 K15 F16 L17 | V9-L13 HydrophobicContact CG1-CB 4.13Å; V9-L13 HydrophobicContact CG1-CD2 4.02Å; V9-L13 HydrophobicContact CG1-CG 4Å; D10-L13 HydrophobicContact CB-CB 4.09Å; D10-L13 CarbonylContact O-C 3.6Å; D10-L13 WeakPolarHBondContact O-CA 3.48Å; D10-L13 WeakPolarHBondContact O-CB 3.32Å; D10-L13 PolarHBondContact O-N 3.14Å; D10-L13 PolarHBondContact OD2-N 3.49Å; L13-K15 PolarHBondContact O-N 3.45Å; L13-F16 HydrophobicContact CD1-CD1 4.46Å; L13-F16 WeakPolarHBondContact O-CB 3.31Å; L13-F16 PolarHBondContact O-N 2.8Å; L13-F16 VanDerWaalsContact O-N 3.15Å; L13-L17 HydrophobicContact CD1-CD1 4.32Å; L13-L17 HydrophobicContact CD1-CG 4.1Å; L13-L17 HydrophobicContact CG-CD1 4.02Å; L13-L17 HydrophobicContact CG-CG 4.26Å; L13-L17 WeakPolarHBondContact O-CB 3.41Å; L13-L17 VanDerWaalsContact O-CG 3.31Å; L13-L17 WeakPolarHBondContact O-CG 3.36Å; L13-L17 PolarHBondContact O-N 3.17Å |
| 14 | Q | 92 | Very high | 84.7 | Confident | 79 Ų | 79 | 112.6 Ų | 112.6 | 37% | 0.369 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -56.3 | -47.9 | 177.8 | -179.7 | 61 | 31.4 | 0 | 0 | 111.7 | V9 D10 F16 L17 E18 | V9-Q14 HydrophobicContact CG1-CB 4.06Å; D10-Q14 PolarHBondContact O-N 3.02Å; Q14-F16 VanDerWaalsContact C-N 3.34Å; Q14-F16 PolarHBondContact O-N 3.39Å; Q14-L17 PolarHBondContact O-N 3.4Å; Q14-E18 PolarHBondContact NE2-OE1 3.06Å; Q14-E18 WeakPolarHBondContact O-CG 3.19Å; Q14-E18 PolarHBondContact O-N 2.95Å |
| 15 | K | 94.3 | Very high | 86.8 | Confident | 149 Ų | 149 | 111.4 Ų | 111.4 | 65% | 0.648 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -63.5 | -39.1 | 177 | -72.8 | 179.3 | -179.7 | 179.7 | 0 | 112.8 | P11 G12 L13 E18 A19 | P11-K15 WeakPolarHBondContact O-CG 3.49Å; P11-K15 PolarHBondContact O-N 2.9Å; G12-K15 PolarHBondContact O-N 3.31Å; L13-K15 PolarHBondContact O-N 3.45Å; K15-E18 PolarHBondContact O-N 2.85Å; K15-A19 PolarHBondContact O-N 3.15Å; K15-A19 VanDerWaalsContact O-N 3.14Å |
| 16 | F | 94.9 | Very high | 88.7 | Confident | 131 Ų | 131 | 110.3 Ų | 110.3 | 58% | 0.575 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -64.2 | -44.7 | 176.4 | 175.6 | -99.3 | 0 | 0 | 0 | 111.3 | G12 L13 Q14 A19 E20 | G12-F16 PolarHBondContact O-N 2.85Å; G12-F16 VanDerWaalsContact O-N 3.09Å; L13-F16 HydrophobicContact CD1-CD1 4.46Å; L13-F16 WeakPolarHBondContact O-CB 3.31Å; L13-F16 PolarHBondContact O-N 2.8Å; L13-F16 VanDerWaalsContact O-N 3.15Å; Q14-F16 VanDerWaalsContact C-N 3.34Å; Q14-F16 PolarHBondContact O-N 3.39Å; F16-A19 PolarHBondContact O-N 3.41Å; F16-E20 PolarHBondContact O-N 2.98Å |
| 17 | L | 95.7 | Very high | 90.8 | Very high | 76 Ų | 76 | 106 Ų | 106 | 40% | 0.398 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.4 | -44.3 | 176.3 | -70.3 | 174.7 | 0 | 0 | 0 | 111.5 | V9 L13 Q14 A19 E20 V21 | V9-L17 HydrophobicContact CG1-CD1 4.41Å; L13-L17 HydrophobicContact CD1-CD1 4.32Å; L13-L17 HydrophobicContact CD1-CG 4.1Å; L13-L17 HydrophobicContact CG-CD1 4.02Å; L13-L17 HydrophobicContact CG-CG 4.26Å; L13-L17 WeakPolarHBondContact O-CB 3.41Å; L13-L17 VanDerWaalsContact O-CG 3.31Å; L13-L17 WeakPolarHBondContact O-CG 3.36Å; L13-L17 PolarHBondContact O-N 3.17Å; Q14-L17 PolarHBondContact O-N 3.4Å; L17-A19 PolarHBondContact O-N 3.46Å; L17-E20 PolarHBondContact O-N 3.44Å; L17-V21 WeakPolarHBondContact O-CB 3.5Å; L17-V21 WeakPolarHBondContact O-CG2 3.36Å; L17-V21 PolarHBondContact O-N 3.35Å |
| 18 | E | 95.5 | Very high | 92.6 | Very high | 99 Ų | 99 | 101.9 Ų | 101.9 | 46% | 0.463 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -58.2 | -45.9 | 176.7 | -75.2 | 169.4 | -169.3 | 0 | 0 | 112.3 | Q14 K15 V21 Q22 | Q14-E18 PolarHBondContact NE2-OE1 3.06Å; Q14-E18 WeakPolarHBondContact O-CG 3.19Å; Q14-E18 PolarHBondContact O-N 2.95Å; K15-E18 PolarHBondContact O-N 2.85Å; E18-V21 PolarHBondContact O-N 3.02Å; E18-Q22 WeakPolarHBondContact O-CG 3.48Å; E18-Q22 PolarHBondContact O-N 3.27Å |
| 19 | A | 96.1 | Very high | 94.1 | Very high | 55 Ų | 55 | 97.1 Ų | 97.1 | 46% | 0.455 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.5 | -42.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | K15 F16 L17 Q22 R23 | K15-A19 PolarHBondContact O-N 3.15Å; K15-A19 VanDerWaalsContact O-N 3.14Å; F16-A19 PolarHBondContact O-N 3.41Å; L17-A19 PolarHBondContact O-N 3.46Å; A19-Q22 PolarHBondContact O-N 2.83Å; A19-R23 PolarHBondContact O-N 3.29Å |
| 20 | E | 97.2 | Very high | 95.2 | Very high | 61 Ų | 61 | 96 Ų | 96 | 29% | 0.285 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -69.2 | -37.8 | 178.7 | -169 | 57.7 | -148.3 | 0 | 0 | 111.5 | F16 L17 R23 Q24 | F16-E20 PolarHBondContact O-N 2.98Å; L17-E20 PolarHBondContact O-N 3.44Å; E20-R23 PolarHBondContact O-N 2.73Å; E20-R23 IonicContact OE1-NE 3.75Å; E20-R23 PolarHBondContact OE1-NE 3.49Å; E20-R23 IonicContact OE2-NE 2.76Å; E20-Q24 WeakPolarHBondContact O-CB 3.37Å; E20-Q24 WeakPolarHBondContact O-CG 3.34Å; E20-Q24 PolarHBondContact O-N 3.44Å |
| 21 | V | 96.7 | Very high | 95.7 | Very high | 66 Ų | 66 | 95.6 Ų | 95.6 | 40% | 0.4 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.5 | -46.2 | 173.7 | 167.3 | 0 | 0 | 0 | 0 | 110.7 | L17 E18 R23 Q24 Q25 | L17-V21 WeakPolarHBondContact O-CB 3.5Å; L17-V21 WeakPolarHBondContact O-CG2 3.36Å; L17-V21 PolarHBondContact O-N 3.35Å; E18-V21 PolarHBondContact O-N 3.02Å; V21-R23 VanDerWaalsContact C-N 3.32Å; V21-R23 PolarHBondContact O-N 3.07Å; V21-Q24 PolarHBondContact O-N 3.29Å; V21-Q25 HydrophobicContact CG1-CG 4.4Å; V21-Q25 WeakPolarHBondContact O-CB 3.49Å; V21-Q25 VanDerWaalsContact O-CG 3.28Å; V21-Q25 WeakPolarHBondContact O-CG 3.47Å; V21-Q25 PolarHBondContact O-N 3.44Å |
| 22 | Q | 97.1 | Very high | 96.1 | Very high | 133 Ų | 133 | 94 Ų | 94 | 62% | 0.621 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -59.7 | -42.5 | 176.2 | -74.6 | 178.7 | -6.9 | 0 | 0 | 112 | E18 A19 Q25 F26 | E18-Q22 WeakPolarHBondContact O-CG 3.48Å; E18-Q22 PolarHBondContact O-N 3.27Å; A19-Q22 PolarHBondContact O-N 2.83Å; Q22-Q25 PolarHBondContact O-N 3.46Å; Q22-F26 WeakPolarHBondContact O-CB 3.5Å; Q22-F26 PolarHBondContact O-N 3.08Å |
| 23 | R | 97.4 | Very high | 96.4 | Very high | 169 Ų | 169 | 93 Ų | 93 | 64% | 0.638 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -63.9 | -42.5 | 176.9 | -178.8 | -178.3 | 132.1 | 92.6 | 3.2 | 112.1 | A19 E20 V21 F26 Q27 | A19-R23 PolarHBondContact O-N 3.29Å; E20-R23 PolarHBondContact O-N 2.73Å; E20-R23 IonicContact OE1-NE 3.75Å; E20-R23 PolarHBondContact OE1-NE 3.49Å; E20-R23 IonicContact OE2-NE 2.76Å; V21-R23 VanDerWaalsContact C-N 3.32Å; V21-R23 PolarHBondContact O-N 3.07Å; R23-F26 PolarHBondContact O-N 3.03Å; R23-Q27 PolarHBondContact O-N 3.24Å |
| 24 | Q | 98.1 | Very high | 96.7 | Very high | 115 Ų | 115 | 92.6 Ų | 92.6 | 54% | 0.537 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -65.3 | -42.1 | 176.5 | -73.6 | 178.8 | 1.4 | 0 | 0 | 112 | E20 V21 F26 Q27 S28 | E20-Q24 WeakPolarHBondContact O-CB 3.37Å; E20-Q24 WeakPolarHBondContact O-CG 3.34Å; E20-Q24 PolarHBondContact O-N 3.44Å; V21-Q24 PolarHBondContact O-N 3.29Å; Q24-F26 VanDerWaalsContact C-N 3.34Å; Q24-F26 PolarHBondContact O-N 3.46Å; Q24-Q27 PolarHBondContact O-N 3.39Å; Q24-S28 WeakPolarHBondContact O-CB 3.49Å; Q24-S28 PolarHBondContact O-N 2.87Å |
| 25 | Q | 97.1 | Very high | 96.9 | Very high | 127 Ų | 127 | 92.1 Ų | 92.1 | 59% | 0.593 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -60.8 | -44.2 | 174.7 | -73.2 | 174.6 | 0.3 | 0 | 0 | 111.2 | V21 Q22 Q27 S28 L29 | V21-Q25 HydrophobicContact CG1-CG 4.4Å; V21-Q25 WeakPolarHBondContact O-CB 3.49Å; V21-Q25 VanDerWaalsContact O-CG 3.28Å; V21-Q25 WeakPolarHBondContact O-CG 3.47Å; V21-Q25 PolarHBondContact O-N 3.44Å; Q22-Q25 PolarHBondContact O-N 3.46Å; Q25-Q27 PolarHBondContact O-N 3.42Å; Q25-S28 WeakPolarHBondContact O-CB 3.28Å; Q25-S28 PolarHBondContact O-N 3.07Å; Q25-L29 PolarHBondContact O-N 3.41Å |
| 26 | F | 97.1 | Very high | 97.1 | Very high | 132 Ų | 132 | 87.4 Ų | 87.4 | 58% | 0.579 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -60.1 | -46.3 | 174.4 | 176.1 | -99.9 | 0 | 0 | 0 | 111.8 | Q22 R23 Q24 S28 L29 V30 | Q22-F26 WeakPolarHBondContact O-CB 3.5Å; Q22-F26 PolarHBondContact O-N 3.08Å; R23-F26 PolarHBondContact O-N 3.03Å; Q24-F26 VanDerWaalsContact C-N 3.34Å; Q24-F26 PolarHBondContact O-N 3.46Å; F26-S28 VanDerWaalsContact C-N 3.31Å; F26-S28 PolarHBondContact O-N 2.95Å; F26-L29 WeakPolarHBondContact O-CB 3.33Å; F26-L29 PolarHBondContact O-N 3.5Å; F26-V30 HydrophobicContact CD1-CG2 4.16Å; F26-V30 HydrophobicContact CD2-CG2 4.43Å; F26-V30 HydrophobicContact CE1-CG2 3.68Å; F26-V30 HydrophobicContact CE2-CG2 3.98Å; F26-V30 HydrophobicContact CZ-CG2 3.58Å; F26-V30 WeakPolarHBondContact O-CG2 3.37Å; F26-V30 PolarHBondContact O-N 2.76Å |
| 27 | Q | 97.9 | Very high | 97.2 | Very high | 95 Ų | 95 | 81.2 Ų | 81.2 | 44% | 0.444 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.9 | -40.3 | 178.1 | -174.4 | 61 | 52.5 | 0 | 0 | 112 | R23 Q24 Q25 V30 N31 | R23-Q27 PolarHBondContact O-N 3.24Å; Q24-Q27 PolarHBondContact O-N 3.39Å; Q25-Q27 PolarHBondContact O-N 3.42Å; Q27-V30 PolarHBondContact O-N 3.03Å; Q27-N31 PolarHBondContact NE2-OD1 3.28Å; Q27-N31 WeakPolarHBondContact O-CB 3.42Å; Q27-N31 PolarHBondContact O-N 3.42Å; Q27-N31 PolarHBondContact O-ND2 2.9Å |
| 28 | S | 97.6 | Very high | 97.2 | Very high | 79 Ų | 79 | 84.2 Ų | 84.2 | 55% | 0.552 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -61.5 | -45.1 | 175.3 | -175.7 | 0 | 0 | 0 | 0 | 111.5 | Q24 Q25 F26 N31 S32 | Q24-S28 WeakPolarHBondContact O-CB 3.49Å; Q24-S28 PolarHBondContact O-N 2.87Å; Q25-S28 WeakPolarHBondContact O-CB 3.28Å; Q25-S28 PolarHBondContact O-N 3.07Å; F26-S28 VanDerWaalsContact C-N 3.31Å; F26-S28 PolarHBondContact O-N 2.95Å; S28-N31 PolarHBondContact O-N 2.94Å; S28-S32 WeakPolarHBondContact O-CB 3.46Å; S28-S32 PolarHBondContact O-N 3.27Å |
| 29 | L | 96.6 | Very high | 97.2 | Very high | 88 Ų | 88 | 84.1 Ų | 84.1 | 46% | 0.461 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -60.2 | -47.4 | 175.7 | 178.4 | 63.7 | 0 | 0 | 0 | 111.4 | Q25 F26 N31 S32 L33 | Q25-L29 PolarHBondContact O-N 3.41Å; F26-L29 WeakPolarHBondContact O-CB 3.33Å; F26-L29 PolarHBondContact O-N 3.5Å; L29-N31 VanDerWaalsContact C-N 3.34Å; L29-N31 PolarHBondContact O-N 3.25Å; L29-S32 PolarHBondContact O-N 3.41Å; L29-L33 HydrophobicContact CD1-CD1 4.11Å; L29-L33 HydrophobicContact CD1-CG 4.18Å; L29-L33 HydrophobicContact CG-CD1 3.92Å; L29-L33 HydrophobicContact CG-CG 4.43Å; L29-L33 WeakPolarHBondContact O-CB 3.42Å; L29-L33 WeakPolarHBondContact O-CG 3.31Å; L29-L33 PolarHBondContact O-N 3.43Å |
| 30 | V | 97.9 | Very high | 97.2 | Very high | 46 Ų | 46 | 87.2 Ų | 87.2 | 28% | 0.279 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -59.5 | -44.5 | 177.5 | 170.2 | 0 | 0 | 0 | 0 | 111.2 | F26 Q27 S34 | F26-V30 HydrophobicContact CD1-CG2 4.16Å; F26-V30 HydrophobicContact CD2-CG2 4.43Å; F26-V30 HydrophobicContact CE1-CG2 3.68Å; F26-V30 HydrophobicContact CE2-CG2 3.98Å; F26-V30 HydrophobicContact CZ-CG2 3.58Å; F26-V30 WeakPolarHBondContact O-CG2 3.37Å; F26-V30 PolarHBondContact O-N 2.76Å; Q27-V30 PolarHBondContact O-N 3.03Å; V30-S34 VanDerWaalsContact O-CB 3.27Å; V30-S34 WeakPolarHBondContact O-CB 3.28Å; V30-S34 PolarHBondContact O-N 3.44Å; V30-S34 PolarHBondContact O-OG 3.49Å |
| 31 | N | 98 | Very high | 97.2 | Very high | 91 Ų | 91 | 84.5 Ų | 84.5 | 49% | 0.487 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -63 | -42.9 | 177.6 | -71.2 | -13.8 | 0 | 0 | 0 | 111.6 | Q27 S28 L29 S34 S35 | Q27-N31 PolarHBondContact NE2-OD1 3.28Å; Q27-N31 WeakPolarHBondContact O-CB 3.42Å; Q27-N31 PolarHBondContact O-N 3.42Å; Q27-N31 PolarHBondContact O-ND2 2.9Å; S28-N31 PolarHBondContact O-N 2.94Å; L29-N31 VanDerWaalsContact C-N 3.34Å; L29-N31 PolarHBondContact O-N 3.25Å; N31-S34 PolarHBondContact O-N 3.03Å; N31-S35 PolarHBondContact O-N 2.93Å |
| 32 | S | 97.5 | Very high | 97.1 | Very high | 62 Ų | 62 | 81.7 Ų | 81.7 | 43% | 0.434 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -63.6 | -50.2 | 177.6 | 176.6 | 0 | 0 | 0 | 0 | 111.8 | S28 L29 S34 S35 T36 | S28-S32 WeakPolarHBondContact O-CB 3.46Å; S28-S32 PolarHBondContact O-N 3.27Å; L29-S32 PolarHBondContact O-N 3.41Å; S32-S34 VanDerWaalsContact C-N 3.28Å; S32-S34 PolarHBondContact O-N 3.46Å; S32-S35 PolarHBondContact O-N 3.27Å; S32-T36 WeakPolarHBondContact O-CB 3.38Å; S32-T36 PolarHBondContact O-N 3.09Å; S32-T36 PolarHBondContact O-OG1 2.96Å |
| 33 | L | 98.1 | Very high | 96.5 | Very high | 21 Ų | 21 | 77.4 Ų | 77.4 | 11% | 0.11 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -56.9 | -44.7 | 175.8 | -71.8 | 169 | 0 | 0 | 0 | 111.2 | L29 C37 V62 M65 | L29-L33 HydrophobicContact CD1-CD1 4.11Å; L29-L33 HydrophobicContact CD1-CG 4.18Å; L29-L33 HydrophobicContact CG-CD1 3.92Å; L29-L33 HydrophobicContact CG-CG 4.43Å; L29-L33 WeakPolarHBondContact O-CB 3.42Å; L29-L33 WeakPolarHBondContact O-CG 3.31Å; L29-L33 PolarHBondContact O-N 3.43Å; L33-C37 WeakPolarHBondContact O-CB 3.38Å; L33-C37 PolarHBondContact O-N 3.21Å; L33-C37 PolarHBondContact O-SG 3.42Å; L33-V62 HydrophobicContact CD1-CG1 4.4Å; L33-M65 HydrophobicContact CD2-CB 3.43Å; L33-M65 VanDerWaalsContact CD2-CB 3.43Å; L33-M65 HydrophobicContact CD2-CE 3.74Å; L33-M65 HydrophobicContact CD2-CG 3.98Å |
| 34 | S | 97.1 | Very high | 95.9 | Very high | 71 Ų | 71 | 77.1 Ų | 77.1 | 50% | 0.497 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -63.1 | -49.2 | -179.1 | -59.9 | 0 | 0 | 0 | 0 | 111.5 | V30 N31 S32 W38 | V30-S34 VanDerWaalsContact O-CB 3.27Å; V30-S34 WeakPolarHBondContact O-CB 3.28Å; V30-S34 PolarHBondContact O-N 3.44Å; V30-S34 PolarHBondContact O-OG 3.49Å; N31-S34 PolarHBondContact O-N 3.03Å; S32-S34 VanDerWaalsContact C-N 3.28Å; S32-S34 PolarHBondContact O-N 3.46Å; S34-W38 WeakPolarHBondContact O-CB 3.41Å; S34-W38 PolarHBondContact O-N 3.27Å |
| 35 | S | 97.1 | Very high | 95.2 | Very high | 69 Ų | 69 | 77.1 Ų | 77.1 | 48% | 0.483 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61.7 | -52.4 | 179.2 | -169.3 | 0 | 0 | 0 | 0 | 111.4 | N31 S32 C37 W38 D39 | N31-S35 PolarHBondContact O-N 2.93Å; S32-S35 PolarHBondContact O-N 3.27Å; S35-C37 PolarHBondContact O-N 3.01Å; S35-W38 WeakPolarHBondContact O-CB 3.36Å; S35-W38 PolarHBondContact O-N 2.73Å; S35-D39 VanDerWaalsContact O-CG 3.31Å; S35-D39 PolarHBondContact O-N 3.33Å |
| 36 | T | 97.4 | Very high | 94.4 | Very high | 49 Ų | 49 | 78.2 Ų | 78.2 | 30% | 0.301 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -63.6 | -45.7 | -177.1 | -58.9 | 0 | 0 | 0 | 0 | 111.9 | S32 W38 D39 L40 M65 | S32-T36 WeakPolarHBondContact O-CB 3.38Å; S32-T36 PolarHBondContact O-N 3.09Å; S32-T36 PolarHBondContact O-OG1 2.96Å; T36-W38 VanDerWaalsContact C-N 3.31Å; T36-W38 PolarHBondContact O-N 3.18Å; T36-D39 PolarHBondContact O-N 3.49Å; T36-L40 HydrophobicContact CG2-CD1 3.88Å; T36-L40 HydrophobicContact CG2-CG 4.46Å; T36-L40 WeakPolarHBondContact O-CB 3.47Å; T36-L40 VanDerWaalsContact O-CG 3.26Å; T36-L40 WeakPolarHBondContact O-CG 3.49Å; T36-L40 PolarHBondContact O-N 2.91Å; T36-M65 HydrophobicContact CG2-CE 3.78Å; T36-M65 HydrophobicContact CG2-SD 4.01Å |
| 37 | C | 97.7 | Very high | 93.8 | Very high | 2 Ų | 2 | 74.2 Ų | 74.2 | 1% | 0.014 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -71.1 | -28.4 | 179.7 | -65.7 | 0 | 0 | 0 | 0 | 112.7 | L33 S35 C41 C61 | L33-C37 WeakPolarHBondContact O-CB 3.38Å; L33-C37 PolarHBondContact O-N 3.21Å; L33-C37 PolarHBondContact O-SG 3.42Å; S35-C37 PolarHBondContact O-N 3.01Å; C37-C41 WeakPolarHBondContact O-CB 3.46Å; C37-C41 PolarHBondContact O-N 2.96Å; C37-C61 WeakPolarHBondContact CA-SG 3.45Å; C37-C61 HydrophobicContact CB-CB 3.75Å; C37-C61 WeakPolarHBondContact CB-SG 3.31Å; C37-C61 VanDerWaalsContact SG-C 3.55Å; C37-C61 WeakPolarHBondContact SG-CB 3.16Å; C37-C61 CovalentContact SG-SG 2.04Å; C37-C61 PolarHBondContact SG-SG 2.88Å |
| 38 | W | 96.4 | Very high | 93.3 | Very high | 138 Ų | 138 | 76.6 Ų | 76.6 | 52% | 0.523 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -64.2 | -49.7 | 172 | -173.4 | -93.5 | 0 | 0 | 0 | 111.4 | S34 S35 T36 L40 C41 V42 A43 | S34-W38 WeakPolarHBondContact O-CB 3.41Å; S34-W38 PolarHBondContact O-N 3.27Å; S35-W38 WeakPolarHBondContact O-CB 3.36Å; S35-W38 PolarHBondContact O-N 2.73Å; T36-W38 VanDerWaalsContact C-N 3.31Å; T36-W38 PolarHBondContact O-N 3.18Å; W38-L40 VanDerWaalsContact C-N 3.33Å; W38-L40 PolarHBondContact O-N 3.49Å; W38-C41 PolarHBondContact O-N 3.34Å; W38-V42 HydrophobicContact CD2-CB 3.9Å; W38-V42 HydrophobicContact CD2-CG1 4.18Å; W38-V42 HydrophobicContact CD2-CG2 4.08Å; W38-V42 HydrophobicContact CE3-CB 4.09Å; W38-V42 HydrophobicContact CE3-CG1 4.25Å; W38-V42 HydrophobicContact CE3-CG2 3.8Å; W38-V42 HydrophobicContact CG-CB 4.37Å; W38-V42 HydrophobicContact CH2-CB 4.43Å; W38-V42 HydrophobicContact CH2-CG1 3.71Å; W38-V42 HydrophobicContact CZ2-CB 4.24Å; W38-V42 HydrophobicContact CZ2-CG1 3.59Å; W38-V42 HydrophobicContact CZ3-CB 4.35Å; W38-V42 HydrophobicContact CZ3-CG1 4.04Å; W38-V42 HydrophobicContact CZ3-CG2 4.07Å; W38-V42 WeakPolarHBondContact O-CA 3.44Å; W38-V42 WeakPolarHBondContact O-CB 3.38Å; W38-V42 PolarHBondContact O-N 3.24Å; W38-A43 PolarHBondContact O-N 3.38Å |
| 39 | D | 95.7 | Very high | 93 | Very high | 98 Ų | 98 | 83.3 Ų | 83.3 | 52% | 0.524 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -61.9 | -41.9 | 179.8 | -64.8 | -25.7 | 0 | 0 | 0 | 111.5 | S35 T36 A43 | S35-D39 VanDerWaalsContact O-CG 3.31Å; S35-D39 PolarHBondContact O-N 3.33Å; T36-D39 PolarHBondContact O-N 3.49Å; D39-A43 WeakPolarHBondContact O-CB 3.33Å |
| 40 | L | 96 | Very high | 92.7 | Very high | 119 Ų | 119 | 82.1 Ų | 82.1 | 62% | 0.623 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -72.1 | -33.1 | -179.6 | -69.6 | 174.9 | 0 | 0 | 0 | 114.1 | T36 W38 | T36-L40 HydrophobicContact CG2-CD1 3.88Å; T36-L40 HydrophobicContact CG2-CG 4.46Å; T36-L40 WeakPolarHBondContact O-CB 3.47Å; T36-L40 VanDerWaalsContact O-CG 3.26Å; T36-L40 WeakPolarHBondContact O-CG 3.49Å; T36-L40 PolarHBondContact O-N 2.91Å; W38-L40 VanDerWaalsContact C-N 3.33Å; W38-L40 PolarHBondContact O-N 3.49Å |
| 41 | C | 96.4 | Very high | 92.4 | Very high | 4 Ų | 4 | 83.3 Ų | 83.3 | 3% | 0.027 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -110.8 | -22.6 | -168.6 | -67.1 | 0 | 0 | 0 | 0 | 114.9 | C37 W38 R45 S54 C57 I58 | C37-C41 WeakPolarHBondContact O-CB 3.46Å; C37-C41 PolarHBondContact O-N 2.96Å; W38-C41 PolarHBondContact O-N 3.34Å; C41-R45 PolarHBondContact O-NH1 3.39Å; C41-S54 PolarHBondContact O-OG 3.4Å; C41-C57 VanDerWaalsContact CA-SG 3.52Å; C41-C57 HydrophobicContact CB-CB 3.62Å; C41-C57 WeakPolarHBondContact CB-SG 3.48Å; C41-C57 WeakPolarHBondContact SG-CB 3.32Å; C41-C57 PolarHBondContact SG-O 3.22Å; C41-C57 VanDerWaalsContact SG-O 3.4Å; C41-C57 CovalentContact SG-SG 2.04Å; C41-C57 PolarHBondContact SG-SG 3.43Å; C41-I58 HydrophobicContact CB-CG1 3.77Å; C41-I58 PolarHBondContact SG-N 2.96Å |
| 42 | V | 94.5 | Very high | 92.2 | Very high | 7 Ų | 7 | 81.1 Ų | 81.1 | 4% | 0.042 | 45% | 0.451 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -123.6 | -28.8 | -166.8 | -169.9 | 0 | 0 | 0 | 0 | 113.7 | W38 D44 R45 L50 I58 | W38-V42 HydrophobicContact CD2-CB 3.9Å; W38-V42 HydrophobicContact CD2-CG1 4.18Å; W38-V42 HydrophobicContact CD2-CG2 4.08Å; W38-V42 HydrophobicContact CE3-CB 4.09Å; W38-V42 HydrophobicContact CE3-CG1 4.25Å; W38-V42 HydrophobicContact CE3-CG2 3.8Å; W38-V42 HydrophobicContact CG-CB 4.37Å; W38-V42 HydrophobicContact CH2-CB 4.43Å; W38-V42 HydrophobicContact CH2-CG1 3.71Å; W38-V42 HydrophobicContact CZ2-CB 4.24Å; W38-V42 HydrophobicContact CZ2-CG1 3.59Å; W38-V42 HydrophobicContact CZ3-CB 4.35Å; W38-V42 HydrophobicContact CZ3-CG1 4.04Å; W38-V42 HydrophobicContact CZ3-CG2 4.07Å; W38-V42 WeakPolarHBondContact O-CA 3.44Å; W38-V42 WeakPolarHBondContact O-CB 3.38Å; W38-V42 PolarHBondContact O-N 3.24Å; V42-D44 PolarHBondContact O-N 2.99Å; V42-R45 PolarHBondContact O-N 3.46Å; V42-L50 HydrophobicContact CG1-CD1 4.21Å; V42-L50 HydrophobicContact CG2-CD1 3.63Å; V42-I58 HydrophobicContact CG2-CD1 3.83Å; V42-I58 HydrophobicContact CG2-CG1 4.4Å |
| 43 | A | 83.9 | Confident | 92.1 | Very high | 44 Ų | 44 | 85.8 Ų | 85.8 | 36% | 0.364 | 46% | 0.464 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -47.1 | -42.2 | -170.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | W38 D39 | W38-A43 PolarHBondContact O-N 3.38Å; D39-A43 WeakPolarHBondContact O-CB 3.33Å |
| 44 | D | 85.1 | Confident | 91.9 | Very high | 163 Ų | 163 | 84.9 Ų | 84.9 | 87% | 0.872 | 46% | 0.459 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.3 | 4.8 | -178.9 | -59 | -43.9 | 0 | 0 | 0 | 114.5 | V42 | V42-D44 PolarHBondContact O-N 2.99Š|
| 45 | R | 83.6 | Confident | 91.9 | Very high | 115 Ų | 115 | 86.8 Ų | 86.8 | 43% | 0.434 | 46% | 0.46 | S | S | . | . | trans | -122.1 | 48.7 | -172.4 | -60 | -179 | -169.9 | 144.9 | 5.6 | 111.5 | C41 V42 G47 S54 | C41-R45 PolarHBondContact O-NH1 3.39Å; V42-R45 PolarHBondContact O-N 3.46Å; R45-G47 PolarHBondContact O-N 3.03Å; R45-S54 WeakPolarHBondContact CD-OG 3.38Å; R45-S54 PolarHBondContact NH1-OG 2.97Å | ||
| 46 | L | 81.3 | Confident | 91.9 | Very high | 149 Ų | 149 | 87.5 Ų | 87.5 | 78% | 0.78 | 46% | 0.461 | S | S | * | . | trans | -70.3 | 114.6 | 179.6 | -56.6 | -178.3 | 0 | 0 | 0 | 110.1 | ||||
| 47 | G | 83.7 | Confident | 91.9 | Very high | 49 Ų | 49 | 86.9 Ų | 86.9 | 51% | 0.505 | 46% | 0.459 | S | S | . | . | trans | -145.9 | 172.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | R45 R49 | R45-G47 PolarHBondContact O-N 3.03Å; G47-R49 PolarHBondContact O-N 2.82Å; G47-R49 VanDerWaalsContact O-N 3.09Å | ||
| 48 | P | 88.7 | Confident | 91.9 | Very high | 144 Ų | 144 | 88.9 Ų | 88.9 | 94% | 0.935 | 47% | 0.469 | S | S | * | . | S | Bend | trans | -65.9 | -14.7 | -178.4 | 28 | -35.8 | 0 | 0 | 0 | 113.2 | ||
| 49 | R | 89.8 | Confident | 92 | Very high | 221 Ų | 221 | 84.8 Ų | 84.8 | 83% | 0.834 | 47% | 0.465 | S | S | * | . | S | Bend | trans | -147.2 | 154.1 | 179.5 | -61.6 | -174.8 | 176.7 | -164.2 | -2.4 | 109.2 | G47 D51 | G47-R49 PolarHBondContact O-N 2.82Å; G47-R49 VanDerWaalsContact O-N 3.09Å; R49-D51 PolarHBondContact O-N 3.44Å |
| 50 | L | 90.9 | Very high | 92.1 | Very high | 62 Ų | 62 | 84 Ų | 84 | 33% | 0.325 | 46% | 0.46 | S | S | . | . | trans | -67.5 | 113.2 | 169.6 | -169.4 | 70.5 | 0 | 0 | 0 | 109.2 | V42 Q55 I58 | V42-L50 HydrophobicContact CG1-CD1 4.21Å; V42-L50 HydrophobicContact CG2-CD1 3.63Å; L50-Q55 HydrophobicContact CB-CG 4.32Å; L50-Q55 HydrophobicContact CD2-CB 4.39Å; L50-Q55 HydrophobicContact CD2-CG 3.55Å; L50-Q55 HydrophobicContact CG-CG 3.8Å; L50-Q55 PolarHBondContact O-NE2 3.31Å; L50-I58 HydrophobicContact CD1-CD1 4.1Å; L50-I58 HydrophobicContact CD2-CD1 3.75Å | ||
| 51 | D | 91.7 | Very high | 92.2 | Very high | 72 Ų | 72 | 79.1 Ų | 79.1 | 39% | 0.385 | 44% | 0.436 | S | S | . | . | trans | -68.3 | 162.4 | -179.7 | 75.9 | 1.3 | 0 | 0 | 0 | 112 | R49 K53 S54 Q55 | R49-D51 PolarHBondContact O-N 3.44Å; D51-K53 PolarHBondContact O-N 3.44Å; D51-K53 PolarHBondContact OD1-N 2.96Å; D51-S54 PolarHBondContact O-N 2.91Å; D51-S54 VanDerWaalsContact O-N 3.1Å; D51-S54 WeakPolarHBondContact OD1-CB 3.43Å; D51-S54 PolarHBondContact OD1-N 3.39Å; D51-S54 PolarHBondContact OD1-OG 3.22Å; D51-Q55 WeakPolarHBondContact O-CG 3.45Å; D51-Q55 PolarHBondContact O-N 2.95Å | ||
| 52 | G | 94.5 | Very high | 92.3 | Very high | 45 Ų | 45 | 81 Ų | 81 | 46% | 0.464 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -60.9 | -28.5 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | T56 | G52-T56 WeakPolarHBondContact O-CB 3.43Å; G52-T56 PolarHBondContact O-N 3.5Å; G52-T56 VanDerWaalsContact O-N 3.07Å; G52-T56 PolarHBondContact O-OG1 2.89Å |
| 53 | K | 94.1 | Very high | 92.5 | Very high | 160 Ų | 160 | 85 Ų | 85 | 70% | 0.696 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -68.3 | -43.9 | 175.3 | -70 | -177.7 | 179.1 | 177.3 | 0 | 111.1 | D51 T56 C57 | D51-K53 PolarHBondContact O-N 3.44Å; D51-K53 PolarHBondContact OD1-N 2.96Å; K53-T56 PolarHBondContact O-N 2.94Å; K53-C57 VanDerWaalsContact O-CB 3.29Å; K53-C57 WeakPolarHBondContact O-CB 3.29Å; K53-C57 PolarHBondContact O-N 3.43Å |
| 54 | S | 95 | Very high | 93.2 | Very high | 1 Ų | 1 | 91.2 Ų | 91.2 | 1% | 0.007 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -71 | -38.2 | 179.3 | -53.4 | 0 | 0 | 0 | 0 | 111.2 | C41 R45 D51 C57 I58 | C41-S54 PolarHBondContact O-OG 3.4Å; R45-S54 WeakPolarHBondContact CD-OG 3.38Å; R45-S54 PolarHBondContact NH1-OG 2.97Å; D51-S54 PolarHBondContact O-N 2.91Å; D51-S54 VanDerWaalsContact O-N 3.1Å; D51-S54 WeakPolarHBondContact OD1-CB 3.43Å; D51-S54 PolarHBondContact OD1-N 3.39Å; D51-S54 PolarHBondContact OD1-OG 3.22Å; S54-C57 WeakPolarHBondContact O-CB 3.46Å; S54-C57 PolarHBondContact O-N 2.94Å; S54-I58 WeakPolarHBondContact O-CG1 3.32Å; S54-I58 PolarHBondContact O-N 3.35Å |
| 55 | Q | 95.6 | Very high | 93.8 | Very high | 111 Ų | 111 | 86 Ų | 86 | 52% | 0.519 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -57 | -50.1 | 170.8 | -71 | 176 | -1 | 0 | 0 | 111.9 | L50 D51 C57 I58 A59 | L50-Q55 HydrophobicContact CB-CG 4.32Å; L50-Q55 HydrophobicContact CD2-CB 4.39Å; L50-Q55 HydrophobicContact CD2-CG 3.55Å; L50-Q55 HydrophobicContact CG-CG 3.8Å; L50-Q55 PolarHBondContact O-NE2 3.31Å; D51-Q55 WeakPolarHBondContact O-CG 3.45Å; D51-Q55 PolarHBondContact O-N 2.95Å; Q55-C57 VanDerWaalsContact C-N 3.33Å; Q55-C57 PolarHBondContact O-N 3.27Å; Q55-I58 PolarHBondContact O-N 3.48Å; Q55-A59 PolarHBondContact O-N 3.16Å; Q55-A59 VanDerWaalsContact O-N 3.09Å |
| 56 | T | 97.3 | Very high | 94.4 | Very high | 84 Ų | 84 | 84.2 Ų | 84.2 | 52% | 0.515 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.4 | -40.5 | 177.4 | -55.8 | 0 | 0 | 0 | 0 | 111.5 | G52 K53 A59 N60 | G52-T56 WeakPolarHBondContact O-CB 3.43Å; G52-T56 PolarHBondContact O-N 3.5Å; G52-T56 VanDerWaalsContact O-N 3.07Å; G52-T56 PolarHBondContact O-OG1 2.89Å; K53-T56 PolarHBondContact O-N 2.94Å; T56-A59 PolarHBondContact O-N 2.87Å; T56-N60 WeakPolarHBondContact O-CB 3.48Å; T56-N60 PolarHBondContact O-N 3.41Å; T56-N60 PolarHBondContact O-ND2 3.21Å |
| 57 | C | 97.9 | Very high | 95.2 | Very high | 37 Ų | 37 | 81.4 Ų | 81.4 | 25% | 0.25 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -60.5 | -48 | 176.3 | -176.8 | 0 | 0 | 0 | 0 | 111.6 | C41 K53 S54 Q55 A59 N60 C61 | C41-C57 VanDerWaalsContact CA-SG 3.52Å; C41-C57 HydrophobicContact CB-CB 3.62Å; C41-C57 WeakPolarHBondContact CB-SG 3.48Å; C41-C57 WeakPolarHBondContact SG-CB 3.32Å; C41-C57 PolarHBondContact SG-O 3.22Å; C41-C57 VanDerWaalsContact SG-O 3.4Å; C41-C57 CovalentContact SG-SG 2.04Å; C41-C57 PolarHBondContact SG-SG 3.43Å; K53-C57 VanDerWaalsContact O-CB 3.29Å; K53-C57 WeakPolarHBondContact O-CB 3.29Å; K53-C57 PolarHBondContact O-N 3.43Å; S54-C57 WeakPolarHBondContact O-CB 3.46Å; S54-C57 PolarHBondContact O-N 2.94Å; Q55-C57 VanDerWaalsContact C-N 3.33Å; Q55-C57 PolarHBondContact O-N 3.27Å; C57-A59 PolarHBondContact O-N 3.33Å; C57-N60 PolarHBondContact O-N 2.91Å; C57-C61 VanDerWaalsContact O-CB 3.31Å; C57-C61 WeakPolarHBondContact O-CB 3.27Å; C57-C61 PolarHBondContact O-N 3.01Å |
| 58 | I | 97.4 | Very high | 95.8 | Very high | 44 Ų | 44 | 80.4 Ų | 80.4 | 23% | 0.226 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -61.6 | -46.1 | 179.5 | -69.6 | 174.9 | 0 | 0 | 0 | 110.6 | C41 V42 L50 S54 Q55 N60 C61 V62 | C41-I58 HydrophobicContact CB-CG1 3.77Å; C41-I58 PolarHBondContact SG-N 2.96Å; V42-I58 HydrophobicContact CG2-CD1 3.83Å; V42-I58 HydrophobicContact CG2-CG1 4.4Å; L50-I58 HydrophobicContact CD1-CD1 4.1Å; L50-I58 HydrophobicContact CD2-CD1 3.75Å; S54-I58 WeakPolarHBondContact O-CG1 3.32Å; S54-I58 PolarHBondContact O-N 3.35Å; Q55-I58 PolarHBondContact O-N 3.48Å; I58-N60 VanDerWaalsContact C-N 3.31Å; I58-N60 PolarHBondContact O-N 3.35Å; I58-C61 PolarHBondContact O-N 3.39Å; I58-V62 HydrophobicContact CG2-CG2 4.44Å; I58-V62 WeakPolarHBondContact O-CG2 3.02Å; I58-V62 PolarHBondContact O-N 3.07Å |
| 59 | A | 98.1 | Very high | 96.2 | Very high | 52 Ų | 52 | 76.8 Ų | 76.8 | 43% | 0.43 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -57.9 | -44.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q55 T56 C57 N63 | Q55-A59 PolarHBondContact O-N 3.16Å; Q55-A59 VanDerWaalsContact O-N 3.09Å; T56-A59 PolarHBondContact O-N 2.87Å; C57-A59 PolarHBondContact O-N 3.33Å; A59-N63 VanDerWaalsContact O-CG 3.32Å; A59-N63 PolarHBondContact O-N 2.98Å; A59-N63 PolarHBondContact O-ND2 2.89Å; A59-N63 VanDerWaalsContact O-ND2 3.16Å |
| 60 | N | 98.4 | Very high | 96.5 | Very high | 81 Ų | 81 | 69.5 Ų | 69.5 | 43% | 0.433 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -66.3 | -43.4 | 175.3 | -72.2 | -30.9 | 0 | 0 | 0 | 112 | T56 C57 I58 V62 N63 R64 | T56-N60 WeakPolarHBondContact O-CB 3.48Å; T56-N60 PolarHBondContact O-N 3.41Å; T56-N60 PolarHBondContact O-ND2 3.21Å; C57-N60 PolarHBondContact O-N 2.91Å; I58-N60 VanDerWaalsContact C-N 3.31Å; I58-N60 PolarHBondContact O-N 3.35Å; N60-V62 PolarHBondContact O-N 3.34Å; N60-N63 PolarHBondContact O-N 2.86Å; N60-R64 WeakPolarHBondContact O-CB 3.3Å; N60-R64 WeakPolarHBondContact O-CG 3.16Å; N60-R64 PolarHBondContact O-N 2.91Å |
| 61 | C | 98.6 | Very high | 96.8 | Very high | 17 Ų | 17 | 72.4 Ų | 72.4 | 12% | 0.115 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -57.8 | -48.8 | 179.9 | 174.2 | 0 | 0 | 0 | 0 | 111.4 | C37 C57 I58 R64 M65 | C37-C61 WeakPolarHBondContact CA-SG 3.45Å; C37-C61 HydrophobicContact CB-CB 3.75Å; C37-C61 WeakPolarHBondContact CB-SG 3.31Å; C37-C61 VanDerWaalsContact SG-C 3.55Å; C37-C61 WeakPolarHBondContact SG-CB 3.16Å; C37-C61 CovalentContact SG-SG 2.04Å; C37-C61 PolarHBondContact SG-SG 2.88Å; C57-C61 VanDerWaalsContact O-CB 3.31Å; C57-C61 WeakPolarHBondContact O-CB 3.27Å; C57-C61 PolarHBondContact O-N 3.01Å; I58-C61 PolarHBondContact O-N 3.39Å; C61-R64 PolarHBondContact O-N 2.72Å; C61-M65 WeakPolarHBondContact O-CB 3.04Å; C61-M65 WeakPolarHBondContact O-CG 3.39Å; C61-M65 PolarHBondContact O-N 3.25Å |
| 62 | V | 98.5 | Very high | 97.1 | Very high | 43 Ų | 43 | 73.9 Ų | 73.9 | 26% | 0.261 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -61.2 | -48.6 | 178.4 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | L33 I58 N60 R64 M65 I66 | L33-V62 HydrophobicContact CD1-CG1 4.4Å; I58-V62 HydrophobicContact CG2-CG2 4.44Å; I58-V62 WeakPolarHBondContact O-CG2 3.02Å; I58-V62 PolarHBondContact O-N 3.07Å; N60-V62 PolarHBondContact O-N 3.34Å; V62-R64 VanDerWaalsContact C-N 3.34Å; V62-R64 PolarHBondContact O-N 3.44Å; V62-M65 PolarHBondContact O-N 2.92Å; V62-I66 HydrophobicContact CG1-CD1 3.9Å; V62-I66 WeakPolarHBondContact O-CG1 3.17Å; V62-I66 PolarHBondContact O-N 3.45Å; V62-I66 VanDerWaalsContact O-N 3.07Å |
| 63 | N | 98.3 | Very high | 97.2 | Very high | 90 Ų | 90 | 75.3 Ų | 75.3 | 48% | 0.481 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -59.6 | -44 | 178.2 | -71.7 | -26.9 | 0 | 0 | 0 | 111.9 | A59 N60 I66 D67 | A59-N63 VanDerWaalsContact O-CG 3.32Å; A59-N63 PolarHBondContact O-N 2.98Å; A59-N63 PolarHBondContact O-ND2 2.89Å; A59-N63 VanDerWaalsContact O-ND2 3.16Å; N60-N63 PolarHBondContact O-N 2.86Å; N63-I66 PolarHBondContact O-N 2.89Å; N63-D67 WeakPolarHBondContact O-CB 3.08Å; N63-D67 PolarHBondContact O-N 3.33Å |
| 64 | R | 98 | Very high | 97.3 | Very high | 175 Ų | 175 | 72.3 Ų | 72.3 | 66% | 0.66 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -69.7 | -34.1 | -179.7 | -64.5 | -62.6 | 167.8 | -171.3 | -3.4 | 113.2 | N60 C61 V62 G68 | N60-R64 WeakPolarHBondContact O-CB 3.3Å; N60-R64 WeakPolarHBondContact O-CG 3.16Å; N60-R64 PolarHBondContact O-N 2.91Å; C61-R64 PolarHBondContact O-N 2.72Å; V62-R64 VanDerWaalsContact C-N 3.34Å; V62-R64 PolarHBondContact O-N 3.44Å; R64-G68 PolarHBondContact O-N 3.03Å |
| 65 | M | 97.7 | Very high | 97.3 | Very high | 54 Ų | 54 | 77.2 Ų | 77.2 | 27% | 0.266 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -63.4 | -47.2 | 173 | -71.7 | -95.4 | -78.8 | 0 | 0 | 110.1 | L33 T36 C61 V62 G68 S69 | L33-M65 HydrophobicContact CD2-CB 3.43Å; L33-M65 VanDerWaalsContact CD2-CB 3.43Å; L33-M65 HydrophobicContact CD2-CE 3.74Å; L33-M65 HydrophobicContact CD2-CG 3.98Å; T36-M65 HydrophobicContact CG2-CE 3.78Å; T36-M65 HydrophobicContact CG2-SD 4.01Å; C61-M65 WeakPolarHBondContact O-CB 3.04Å; C61-M65 WeakPolarHBondContact O-CG 3.39Å; C61-M65 PolarHBondContact O-N 3.25Å; V62-M65 PolarHBondContact O-N 2.92Å; M65-G68 PolarHBondContact O-N 3.38Å; M65-S69 WeakPolarHBondContact O-CB 3.42Å; M65-S69 PolarHBondContact O-N 3.31Å; M65-S69 PolarHBondContact O-OG 3.23Å |
| 66 | I | 97.4 | Very high | 97.3 | Very high | 78 Ų | 78 | 77.3 Ų | 77.3 | 40% | 0.4 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -64.1 | -48.4 | 178.9 | -65.3 | 167.3 | 0 | 0 | 0 | 111.4 | V62 N63 G68 S69 T70 | V62-I66 HydrophobicContact CG1-CD1 3.9Å; V62-I66 WeakPolarHBondContact O-CG1 3.17Å; V62-I66 PolarHBondContact O-N 3.45Å; V62-I66 VanDerWaalsContact O-N 3.07Å; N63-I66 PolarHBondContact O-N 2.89Å; I66-G68 VanDerWaalsContact C-N 3.32Å; I66-G68 PolarHBondContact O-N 2.84Å; I66-S69 PolarHBondContact O-N 3.45Å; I66-T70 WeakPolarHBondContact O-CB 3.02Å; I66-T70 PolarHBondContact O-N 3.07Å; I66-T70 PolarHBondContact O-OG1 2.87Å |
| 67 | D | 97.6 | Very high | 97.2 | Very high | 90 Ų | 90 | 78.4 Ų | 78.4 | 48% | 0.481 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -58.4 | -45.6 | 176.7 | -70.6 | -18.7 | 0 | 0 | 0 | 111 | N63 T70 Y71 | N63-D67 WeakPolarHBondContact O-CB 3.08Å; N63-D67 PolarHBondContact O-N 3.33Å; D67-T70 PolarHBondContact O-N 3.28Å; D67-Y71 WeakPolarHBondContact O-CB 3.47Å; D67-Y71 PolarHBondContact O-N 3.48Å |
| 68 | G | 97 | Very high | 97 | Very high | 28 Ų | 28 | 79.9 Ų | 79.9 | 29% | 0.289 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -64.8 | -46.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | R64 M65 I66 T70 Y71 I72 | R64-G68 PolarHBondContact O-N 3.03Å; M65-G68 PolarHBondContact O-N 3.38Å; I66-G68 VanDerWaalsContact C-N 3.32Å; I66-G68 PolarHBondContact O-N 2.84Å; G68-T70 VanDerWaalsContact C-N 3.34Å; G68-T70 PolarHBondContact O-N 3.48Å; G68-Y71 PolarHBondContact O-N 3.4Å; G68-I72 VanDerWaalsContact O-CG1 3.29Å; G68-I72 WeakPolarHBondContact O-CG1 3.29Å; G68-I72 PolarHBondContact O-N 3.27Å |
| 69 | S | 95.7 | Very high | 96.7 | Very high | 67 Ų | 67 | 82.8 Ų | 82.8 | 47% | 0.469 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -60.4 | -44.6 | 175.6 | -63.6 | 0 | 0 | 0 | 0 | 111.5 | M65 I66 Y71 I72 V73 | M65-S69 WeakPolarHBondContact O-CB 3.42Å; M65-S69 PolarHBondContact O-N 3.31Å; M65-S69 PolarHBondContact O-OG 3.23Å; I66-S69 PolarHBondContact O-N 3.45Å; S69-Y71 PolarHBondContact O-N 2.77Å; S69-I72 PolarHBondContact O-N 2.86Å; S69-V73 WeakPolarHBondContact O-CG2 3.07Å; S69-V73 PolarHBondContact O-N 2.96Å |
| 70 | T | 96.8 | Very high | 96.4 | Very high | 68 Ų | 68 | 83.7 Ų | 83.7 | 42% | 0.417 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -62.7 | -43.8 | 177.9 | -55.2 | 0 | 0 | 0 | 0 | 111.3 | I66 D67 G68 I72 V73 Q74 | I66-T70 WeakPolarHBondContact O-CB 3.02Å; I66-T70 PolarHBondContact O-N 3.07Å; I66-T70 PolarHBondContact O-OG1 2.87Å; D67-T70 PolarHBondContact O-N 3.28Å; G68-T70 VanDerWaalsContact C-N 3.34Å; G68-T70 PolarHBondContact O-N 3.48Å; T70-I72 PolarHBondContact O-N 3.47Å; T70-V73 PolarHBondContact O-N 3.09Å; T70-Q74 VanDerWaalsContact O-CG 3.31Å; T70-Q74 WeakPolarHBondContact O-CG 3.33Å; T70-Q74 PolarHBondContact O-N 3.36Å |
| 71 | Y | 97.9 | Very high | 95.7 | Very high | 124 Ų | 124 | 86.3 Ų | 86.3 | 49% | 0.486 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -60.7 | -44.9 | 176.8 | 177.7 | -103.9 | 0 | 0 | 0 | 112.4 | D67 G68 S69 Q74 R75 | D67-Y71 WeakPolarHBondContact O-CB 3.47Å; D67-Y71 PolarHBondContact O-N 3.48Å; G68-Y71 PolarHBondContact O-N 3.4Å; S69-Y71 PolarHBondContact O-N 2.77Å; Y71-Q74 PolarHBondContact O-N 3.17Å; Y71-R75 HydrophobicContact CD1-CG 4.48Å; Y71-R75 HydrophobicContact CE1-CG 4.05Å; Y71-R75 HydrophobicContact CE2-CG 4.1Å; Y71-R75 WeakPolarHBondContact O-CG 3.17Å; Y71-R75 PolarHBondContact O-N 2.9Å; Y71-R75 PolarHBondContact OH-NE 3.47Å; Y71-R75 PolarHBondContact OH-NH2 3.37Å |
| 72 | I | 96.8 | Very high | 94.9 | Very high | 102 Ų | 102 | 91 Ų | 91 | 52% | 0.523 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -60.7 | -47.3 | 177.4 | -69 | 164.3 | 0 | 0 | 0 | 110.3 | G68 S69 T70 Q74 R75 L76 | G68-I72 VanDerWaalsContact O-CG1 3.29Å; G68-I72 WeakPolarHBondContact O-CG1 3.29Å; G68-I72 PolarHBondContact O-N 3.27Å; S69-I72 PolarHBondContact O-N 2.86Å; T70-I72 PolarHBondContact O-N 3.47Å; I72-Q74 PolarHBondContact O-N 3.31Å; I72-R75 PolarHBondContact O-N 3.48Å; I72-L76 HydrophobicContact CG2-CD1 3.94Å; I72-L76 HydrophobicContact CG2-CG 4.4Å; I72-L76 VanDerWaalsContact O-CG 3.32Å; I72-L76 WeakPolarHBondContact O-CG 3.49Å; I72-L76 PolarHBondContact O-N 3.41Å |
| 73 | V | 96.4 | Very high | 93.9 | Very high | 76 Ų | 76 | 94.2 Ų | 94.2 | 46% | 0.461 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.1 | -45.9 | 179.1 | 170.9 | 0 | 0 | 0 | 0 | 111.2 | S69 T70 R75 L76 Q77 | S69-V73 WeakPolarHBondContact O-CG2 3.07Å; S69-V73 PolarHBondContact O-N 2.96Å; T70-V73 PolarHBondContact O-N 3.09Å; V73-R75 PolarHBondContact O-N 3.16Å; V73-L76 PolarHBondContact O-N 3.36Å; V73-Q77 WeakPolarHBondContact O-CG 3.46Å; V73-Q77 PolarHBondContact O-N 2.04Å |
| 74 | Q | 96.2 | Very high | 92.7 | Very high | 97 Ų | 97 | 93.2 Ų | 93.2 | 45% | 0.453 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -58.8 | -44.7 | 177.1 | -74.2 | 173.1 | -13.9 | 0 | 0 | 112.1 | T70 Y71 I72 L76 Q77 E78 | T70-Q74 VanDerWaalsContact O-CG 3.31Å; T70-Q74 WeakPolarHBondContact O-CG 3.33Å; T70-Q74 PolarHBondContact O-N 3.36Å; Y71-Q74 PolarHBondContact O-N 3.17Å; I72-Q74 PolarHBondContact O-N 3.31Å; Q74-L76 PolarHBondContact O-N 3.18Å; Q74-Q77 PolarHBondContact O-N 2.93Å; Q74-E78 WeakPolarHBondContact O-CG 3.26Å; Q74-E78 PolarHBondContact O-N 2.92Å |
| 75 | R | 95.9 | Very high | 91 | Very high | 103 Ų | 103 | 89 Ų | 89 | 39% | 0.389 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.5 | -38.5 | 177.5 | -69.9 | -57.5 | -168.7 | -167.1 | -1 | 113 | Y71 I72 V73 Q77 E78 H79 | Y71-R75 HydrophobicContact CD1-CG 4.48Å; Y71-R75 HydrophobicContact CE1-CG 4.05Å; Y71-R75 HydrophobicContact CE2-CG 4.1Å; Y71-R75 WeakPolarHBondContact O-CG 3.17Å; Y71-R75 PolarHBondContact O-N 2.9Å; Y71-R75 PolarHBondContact OH-NE 3.47Å; Y71-R75 PolarHBondContact OH-NH2 3.37Å; I72-R75 PolarHBondContact O-N 3.48Å; V73-R75 PolarHBondContact O-N 3.16Å; R75-Q77 VanDerWaalsContact C-N 3.35Å; R75-E78 WeakPolarHBondContact CD-OE2 3.21Å; R75-E78 IonicContact CZ-OE2 3.66Å; R75-E78 IonicContact NH1-OE1 3.41Å; R75-E78 IonicContact NH1-OE2 3.76Å; R75-E78 PolarHBondContact NH1-OE2 2.75Å; R75-H79 WeakPolarHBondContact O-CB 3.12Å; R75-H79 PolarHBondContact O-CD2 2.98Å; R75-H79 PolarHBondContact O-N 3.1Å |
| 76 | L | 96.4 | Very high | 89.2 | Confident | 114 Ų | 114 | 91.2 Ų | 91.2 | 60% | 0.597 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64.9 | -40.7 | 175.6 | -69.4 | 173.1 | 0 | 0 | 0 | 111.4 | I72 V73 Q74 H79 S80 | I72-L76 HydrophobicContact CG2-CD1 3.94Å; I72-L76 HydrophobicContact CG2-CG 4.4Å; I72-L76 VanDerWaalsContact O-CG 3.32Å; I72-L76 WeakPolarHBondContact O-CG 3.49Å; I72-L76 PolarHBondContact O-N 3.41Å; V73-L76 PolarHBondContact O-N 3.36Å; Q74-L76 PolarHBondContact O-N 3.18Å; L76-H79 PolarHBondContact O-N 3.41Å; L76-S80 PolarHBondContact O-N 2.04Å; L76-S80 PolarHBondContact O-OG 3.43Å |
| 77 | Q | 94.8 | Very high | 87.2 | Confident | 106 Ų | 106 | 94.4 Ų | 94.4 | 50% | 0.495 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.7 | -52.4 | 174.2 | -70.8 | 170.3 | -24 | 0 | 0 | 111.2 | V73 Q74 R75 H79 S80 E81 | V73-Q77 WeakPolarHBondContact O-CG 3.46Å; V73-Q77 PolarHBondContact O-N 2.04Å; Q74-Q77 PolarHBondContact O-N 2.93Å; R75-Q77 VanDerWaalsContact C-N 3.35Å; Q77-H79 VanDerWaalsContact C-N 3.26Å; Q77-H79 PolarHBondContact O-N 3.19Å; Q77-S80 PolarHBondContact O-N 2.59Å; Q77-S80 VanDerWaalsContact O-N 3.09Å; Q77-S80 PolarHBondContact O-OG 2.96Å; Q77-E81 PolarHBondContact O-N 3.23Å; Q77-E81 VanDerWaalsContact O-N 3.08Å |
| 78 | E | 93.9 | Very high | 85.2 | Confident | 69 Ų | 69 | 95.8 Ų | 95.8 | 32% | 0.322 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -54.8 | -38.8 | 176.8 | -72.6 | 175.2 | -175.3 | 0 | 0 | 113 | Q74 R75 K82 | Q74-E78 WeakPolarHBondContact O-CG 3.26Å; Q74-E78 PolarHBondContact O-N 2.92Å; R75-E78 WeakPolarHBondContact CD-OE2 3.21Å; R75-E78 IonicContact CZ-OE2 3.66Å; R75-E78 IonicContact NH1-OE1 3.41Å; R75-E78 IonicContact NH1-OE2 3.76Å; R75-E78 PolarHBondContact NH1-OE2 2.75Å; E78-K82 WeakPolarHBondContact O-CD 3.45Å; E78-K82 VanDerWaalsContact O-CG 3.28Å; E78-K82 WeakPolarHBondContact O-CG 3.39Å; E78-K82 PolarHBondContact O-N 3.01Å |
| 79 | H | 91.1 | Very high | 83.1 | Confident | 104 Ų | 104 | 98.1 Ų | 98.1 | 48% | 0.481 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -74.5 | -36.3 | 177.9 | -76.7 | -46.8 | 0 | 0 | 0 | 113 | R75 L76 Q77 K82 N83 | R75-H79 WeakPolarHBondContact O-CB 3.12Å; R75-H79 PolarHBondContact O-CD2 2.98Å; R75-H79 PolarHBondContact O-N 3.1Å; L76-H79 PolarHBondContact O-N 3.41Å; Q77-H79 VanDerWaalsContact C-N 3.26Å; Q77-H79 PolarHBondContact O-N 3.19Å; H79-K82 PolarHBondContact O-N 3.41Å; H79-N83 WeakPolarHBondContact O-CB 3.49Å; H79-N83 PolarHBondContact O-N 3.04Å; H79-N83 PolarHBondContact O-ND2 3.03Å |
| 80 | S | 90.3 | Very high | 81 | Confident | 71 Ų | 71 | 98.7 Ų | 98.7 | 50% | 0.497 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.8 | -40.2 | 175.4 | 68.7 | 0 | 0 | 0 | 0 | 112.4 | L76 Q77 N83 A84 | L76-S80 PolarHBondContact O-N 2.04Å; L76-S80 PolarHBondContact O-OG 3.43Å; Q77-S80 PolarHBondContact O-N 2.59Å; Q77-S80 VanDerWaalsContact O-N 3.09Å; Q77-S80 PolarHBondContact O-OG 2.96Å; S80-N83 PolarHBondContact O-N 3.39Å; S80-A84 PolarHBondContact O-N 3.33Å |
| 81 | E | 84.1 | Confident | 78.6 | Confident | 136 Ų | 136 | 99.3 Ų | 99.3 | 64% | 0.636 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -66 | -44.8 | 176.8 | -68.9 | 173.7 | -177.1 | 0 | 0 | 112.1 | Q77 N83 A84 S85 | Q77-E81 PolarHBondContact O-N 3.23Å; Q77-E81 VanDerWaalsContact O-N 3.08Å; E81-N83 VanDerWaalsContact C-N 3.34Å; E81-N83 PolarHBondContact O-N 2.84Å; E81-A84 PolarHBondContact O-N 3.37Å; E81-S85 PolarHBondContact O-N 3.46Å; E81-S85 PolarHBondContact O-OG 2.95Å |
| 82 | K | 81.8 | Confident | 76.8 | Confident | 115 Ų | 115 | 99.7 Ų | 99.7 | 50% | 0.5 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -61.8 | -41.8 | 176.5 | -72.7 | 171.1 | -174 | 171 | 0 | 111.7 | E78 H79 S85 S86 | E78-K82 WeakPolarHBondContact O-CD 3.45Å; E78-K82 VanDerWaalsContact O-CG 3.28Å; E78-K82 WeakPolarHBondContact O-CG 3.39Å; E78-K82 PolarHBondContact O-N 3.01Å; H79-K82 PolarHBondContact O-N 3.41Å; K82-S85 WeakPolarHBondContact CA-OG 3.4Å; K82-S85 PolarHBondContact O-N 3.28Å; K82-S85 PolarHBondContact O-OG 3.5Å; K82-S86 PolarHBondContact O-N 2.82Å; K82-S86 VanDerWaalsContact O-N 3.07Å |
| 83 | N | 76.8 | Confident | 75.1 | Confident | 111 Ų | 111 | 104.9 Ų | 104.9 | 59% | 0.594 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -67.7 | -36.1 | 178.6 | -69.5 | -11.6 | 0 | 0 | 0 | 112.3 | H79 S80 E81 S85 S86 N87 | H79-N83 WeakPolarHBondContact O-CB 3.49Å; H79-N83 PolarHBondContact O-N 3.04Å; H79-N83 PolarHBondContact O-ND2 3.03Å; S80-N83 PolarHBondContact O-N 3.39Å; E81-N83 VanDerWaalsContact C-N 3.34Å; E81-N83 PolarHBondContact O-N 2.84Å; N83-S85 VanDerWaalsContact C-N 3.32Å; N83-S85 PolarHBondContact O-N 3.09Å; N83-S86 PolarHBondContact O-N 3.02Å; N83-N87 PolarHBondContact O-N 3.21Å |
| 84 | A | 74.8 | Confident | 72.9 | Confident | 69 Ų | 69 | 110.5 Ų | 110.5 | 57% | 0.57 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -63.8 | -37.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112 | S80 E81 | S80-A84 PolarHBondContact O-N 3.33Å; E81-A84 PolarHBondContact O-N 3.37Å |
| 85 | S | 62.2 | Low | 71.8 | Confident | 86 Ų | 86 | 111.2 Ų | 111.2 | 60% | 0.601 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -72.4 | -29.8 | 177.6 | 64.9 | 0 | 0 | 0 | 0 | 114.3 | E81 K82 N83 | E81-S85 PolarHBondContact O-N 3.46Å; E81-S85 PolarHBondContact O-OG 2.95Å; K82-S85 WeakPolarHBondContact CA-OG 3.4Å; K82-S85 PolarHBondContact O-N 3.28Å; K82-S85 PolarHBondContact O-OG 3.5Å; N83-S85 VanDerWaalsContact C-N 3.32Å; N83-S85 PolarHBondContact O-N 3.09Å |
| 86 | S | 59.3 | Low | 70.5 | Confident | 102 Ų | 102 | 111.6 Ų | 111.6 | 71% | 0.713 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -78.3 | -18 | 178.6 | -75.3 | 0 | 0 | 0 | 0 | 114.5 | K82 N83 | K82-S86 PolarHBondContact O-N 2.82Å; K82-S86 VanDerWaalsContact O-N 3.07Å; N83-S86 PolarHBondContact O-N 3.02Å |
| 87 | N | 56.4 | Low | 69.1 | Low | 145 Ų | 145 | 111.5 Ų | 111.5 | 78% | 0.775 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.1 | 6.4 | -177 | -156.9 | 55.2 | 0 | 0 | 0 | 114.9 | N83 | N83-N87 PolarHBondContact O-N 3.21Š|
| 88 | S | 54.4 | Low | 67.5 | Low | 118 Ų | 118 | 111.8 Ų | 111.8 | 83% | 0.825 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | 9.5 | 174.5 | -84 | 0 | 0 | 0 | 0 | 114.5 | ||
| 89 | G | 53.1 | Low | 65.9 | Low | 77 Ų | 77 | 114.5 Ų | 114.5 | 79% | 0.794 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -110.3 | 3.1 | -174.3 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||
| 90 | G | 50.7 | Low | 64.2 | Low | 80 Ų | 80 | 115.2 Ų | 115.2 | 83% | 0.825 | 75% | 0.75 | S | S | * | * | trans | -138.4 | 84 | -170.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 91 | G | 47.3 | Very low | 62.3 | Low | 80 Ų | 80 | 118.4 Ų | 118.4 | 83% | 0.825 | 77% | 0.768 | S | S | * | * | trans | -173.7 | 41 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 92 | V | 60.9 | Low | 60.7 | Low | 133 Ų | 133 | 117 Ų | 117 | 81% | 0.806 | 78% | 0.778 | S | S | * | * | trans | -97.4 | 98.5 | 159.3 | 170.6 | 0 | 0 | 0 | 0 | 106 | ||||
| 93 | F | 60.7 | Low | 58.9 | Low | 211 Ų | 211 | 117.2 Ų | 117.2 | 93% | 0.925 | 80% | 0.801 | S | S | * | * | trans | -154.2 | 127 | 147.4 | -91.5 | -72.5 | 0 | 0 | 0 | 107.2 | ||||
| 94 | S | 50.6 | Low | 57.3 | Low | 194 Ų | 194 | 117.7 Ų | 117.7 | 100% | 1.357 | 82% | 0.82 | S | S | * | * | trans | -52.7 | 0 | -176.7 | -51.3 | 0 | 0 | 0 | 0 | 115.4 |
Retrieved 94 of 94 residues in 65.2 ms
(Link to these results)