| 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 | 53.9 | Low | 80.3 | Confident | 246 Ų | 246 | 132.9 Ų | 132.9 | 100% | 1.212 | 65% | 0.646 | S | S | * | * | 0 | 108.4 | 0 | -60.8 | 173.1 | -159.8 | 0 | 0 | 107.4 | R3 | M1-R3 PolarHBondContact O-N 2.95Š| |||
| 2 | T | 65.3 | Low | 81 | Confident | 110 Ų | 110 | 130.3 Ų | 130.3 | 68% | 0.675 | 63% | 0.632 | S | S | * | * | trans | -68.8 | 128.1 | -153.8 | 56.2 | 0 | 0 | 0 | 0 | 111.9 | G4 N5 | T2-G4 PolarHBondContact O-N 3.49Å; T2-N5 PolarHBondContact O-N 3.47Å | ||
| 3 | R | 70.8 | Confident | 81.8 | Confident | 226 Ų | 226 | 132.2 Ų | 132.2 | 85% | 0.853 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -50.4 | -22.1 | 175.1 | -114.7 | -179 | -177.8 | 96.5 | -2.5 | 113.4 | M1 R7 | M1-R3 PolarHBondContact O-N 2.95Å; R3-R7 PolarHBondContact O-N 3.44Å |
| 4 | G | 77.5 | Confident | 82.4 | Confident | 49 Ų | 49 | 129.9 Ų | 129.9 | 51% | 0.505 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -61.7 | -37.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | T2 Q6 R7 E8 | T2-G4 PolarHBondContact O-N 3.49Å; G4-Q6 PolarHBondContact O-N 3.26Å; G4-R7 PolarHBondContact O-N 3.39Å; G4-E8 PolarHBondContact O-N 2.91Å |
| 5 | N | 84.3 | Confident | 82.7 | Confident | 101 Ų | 101 | 127.5 Ų | 127.5 | 54% | 0.54 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -65 | -43 | -178.7 | -171.1 | 26.1 | 0 | 0 | 0 | 111.7 | T2 R7 E8 L9 | T2-N5 PolarHBondContact O-N 3.47Å; N5-R7 VanDerWaalsContact C-N 3.3Å; N5-R7 PolarHBondContact O-N 3.06Å; N5-E8 PolarHBondContact O-N 3Å; N5-L9 WeakPolarHBondContact O-CB 3.39Å; N5-L9 PolarHBondContact O-N 3.13Å |
| 6 | Q | 85.9 | Confident | 82.9 | Confident | 148 Ų | 148 | 127.3 Ų | 127.3 | 69% | 0.692 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -63.5 | -36.9 | 177.6 | -71.9 | -176 | -8.5 | 0 | 0 | 112.3 | G4 A10 | G4-Q6 PolarHBondContact O-N 3.26Å; Q6-A10 WeakPolarHBondContact O-CB 3.33Å; Q6-A10 PolarHBondContact O-N 3.38Å |
| 7 | R | 86.7 | Confident | 83.1 | Confident | 196 Ų | 196 | 128.6 Ų | 128.6 | 74% | 0.74 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -67 | -42.8 | 178 | -171.1 | -179 | -76.4 | -174.1 | -4.1 | 111.3 | R3 G4 N5 A10 R11 | R3-R7 PolarHBondContact O-N 3.44Å; G4-R7 PolarHBondContact O-N 3.39Å; N5-R7 VanDerWaalsContact C-N 3.3Å; N5-R7 PolarHBondContact O-N 3.06Å; R7-A10 PolarHBondContact O-N 2.98Å; R7-R11 PolarHBondContact O-N 3.32Å |
| 8 | E | 91.2 | Very high | 82.9 | Confident | 87 Ų | 87 | 129.1 Ų | 129.1 | 41% | 0.407 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -65.3 | -45 | 177.2 | -175.5 | 51.3 | -144.6 | 0 | 0 | 111.4 | G4 N5 A10 R11 Q12 | G4-E8 PolarHBondContact O-N 2.91Å; N5-E8 PolarHBondContact O-N 3Å; E8-A10 VanDerWaalsContact C-N 3.32Å; E8-A10 PolarHBondContact O-N 3.35Å; E8-R11 WeakPolarHBondContact O-CB 3.45Å; E8-R11 PolarHBondContact O-N 3.48Å; E8-R11 VanDerWaalsContact O-N 3.13Å; E8-Q12 WeakPolarHBondContact O-CG 3.43Å; E8-Q12 PolarHBondContact O-N 3.25Å; E8-Q12 WeakPolarHBondContact OE1-CG 3.43Å; E8-Q12 PolarHBondContact OE1-NE2 3.48Å |
| 9 | L | 88.7 | Confident | 82.7 | Confident | 99 Ų | 99 | 125.3 Ų | 125.3 | 52% | 0.518 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -58 | -41.9 | 174.2 | -113.9 | 152.7 | 0 | 0 | 0 | 112.6 | N5 Q12 K13 | N5-L9 WeakPolarHBondContact O-CB 3.39Å; N5-L9 PolarHBondContact O-N 3.13Å; L9-Q12 PolarHBondContact O-N 2.94Å; L9-K13 VanDerWaalsContact O-CB 3.28Å; L9-K13 WeakPolarHBondContact O-CB 3.49Å; L9-K13 PolarHBondContact O-N 3.48Å |
| 10 | A | 88.8 | Confident | 82.4 | Confident | 48 Ų | 48 | 122.6 Ų | 122.6 | 40% | 0.397 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -65.3 | -40.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | Q6 R7 E8 K13 N14 | Q6-A10 WeakPolarHBondContact O-CB 3.33Å; Q6-A10 PolarHBondContact O-N 3.38Å; R7-A10 PolarHBondContact O-N 2.98Å; E8-A10 VanDerWaalsContact C-N 3.32Å; E8-A10 PolarHBondContact O-N 3.35Å; A10-K13 PolarHBondContact O-N 2.87Å; A10-N14 WeakPolarHBondContact O-CB 3.28Å; A10-N14 VanDerWaalsContact O-CG 3.24Å; A10-N14 PolarHBondContact O-N 3.49Å; A10-N14 PolarHBondContact O-ND2 2.95Å |
| 11 | R | 90.7 | Very high | 81.7 | Confident | 152 Ų | 152 | 119.6 Ų | 119.6 | 57% | 0.574 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -62.6 | -48.6 | 173.7 | -77.1 | -168.6 | 70.4 | 88.5 | 0.6 | 111.4 | R7 E8 K13 N14 M15 | R7-R11 PolarHBondContact O-N 3.32Å; E8-R11 WeakPolarHBondContact O-CB 3.45Å; E8-R11 PolarHBondContact O-N 3.48Å; E8-R11 VanDerWaalsContact O-N 3.13Å; R11-K13 VanDerWaalsContact C-N 3.34Å; R11-K13 PolarHBondContact O-N 3.44Å; R11-N14 PolarHBondContact O-N 3Å; R11-M15 HydrophobicContact CB-CE 4.39Å; R11-M15 WeakPolarHBondContact O-CB 3.36Å; R11-M15 WeakPolarHBondContact O-CG 3.24Å; R11-M15 PolarHBondContact O-N 2.68Å |
| 12 | Q | 88.5 | Confident | 82.5 | Confident | 102 Ų | 102 | 113 Ų | 113 | 48% | 0.477 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -60.1 | -43.7 | 177.8 | -71 | -177.5 | 14.6 | 0 | 0 | 111.8 | E8 L9 N14 M15 K16 | E8-Q12 WeakPolarHBondContact O-CG 3.43Å; E8-Q12 PolarHBondContact O-N 3.25Å; E8-Q12 WeakPolarHBondContact OE1-CG 3.43Å; E8-Q12 PolarHBondContact OE1-NE2 3.48Å; L9-Q12 PolarHBondContact O-N 2.94Å; Q12-N14 PolarHBondContact O-N 2.94Å; Q12-M15 HydrophobicContact CG-CE 4.22Å; Q12-M15 PolarHBondContact O-N 2.85Å; Q12-K16 VanDerWaalsContact O-CB 3.26Å; Q12-K16 WeakPolarHBondContact O-CB 3.36Å; Q12-K16 PolarHBondContact O-N 3.3Å |
| 13 | K | 90.9 | Very high | 82.3 | Confident | 154 Ų | 154 | 116 Ų | 116 | 67% | 0.67 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -63.7 | -40.9 | 177 | -171.2 | 174.9 | -178 | 177.8 | 0 | 112.1 | L9 A10 R11 K16 K17 | L9-K13 VanDerWaalsContact O-CB 3.28Å; L9-K13 WeakPolarHBondContact O-CB 3.49Å; L9-K13 PolarHBondContact O-N 3.48Å; A10-K13 PolarHBondContact O-N 2.87Å; R11-K13 VanDerWaalsContact C-N 3.34Å; R11-K13 PolarHBondContact O-N 3.44Å; K13-K16 PolarHBondContact O-N 3.45Å; K13-K17 WeakPolarHBondContact O-CB 3.45Å; K13-K17 PolarHBondContact O-N 2.86Å |
| 14 | N | 90.1 | Very high | 81.8 | Confident | 100 Ų | 100 | 108.6 Ų | 108.6 | 54% | 0.535 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -67.6 | -44.5 | 176.6 | -74.5 | -12.3 | 0 | 0 | 0 | 112 | A10 R11 Q12 K16 K17 Q18 | A10-N14 WeakPolarHBondContact O-CB 3.28Å; A10-N14 VanDerWaalsContact O-CG 3.24Å; A10-N14 PolarHBondContact O-N 3.49Å; A10-N14 PolarHBondContact O-ND2 2.95Å; R11-N14 PolarHBondContact O-N 3Å; Q12-N14 PolarHBondContact O-N 2.94Å; N14-K16 VanDerWaalsContact C-N 3.34Å; N14-K16 PolarHBondContact O-N 2.79Å; N14-K17 PolarHBondContact O-N 3.41Å; N14-Q18 WeakPolarHBondContact O-CG 3.35Å; N14-Q18 PolarHBondContact O-N 2.85Å |
| 15 | M | 87.6 | Confident | 80.9 | Confident | 94 Ų | 94 | 113.9 Ų | 113.9 | 46% | 0.463 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -60 | -44.3 | 174 | -73 | -174.3 | -64.2 | 0 | 0 | 111 | R11 Q12 Q18 S19 | R11-M15 HydrophobicContact CB-CE 4.39Å; R11-M15 WeakPolarHBondContact O-CB 3.36Å; R11-M15 WeakPolarHBondContact O-CG 3.24Å; R11-M15 PolarHBondContact O-N 2.68Å; Q12-M15 HydrophobicContact CG-CE 4.22Å; Q12-M15 PolarHBondContact O-N 2.85Å; M15-Q18 PolarHBondContact O-N 3.36Å; M15-S19 WeakPolarHBondContact O-CB 3.46Å; M15-S19 PolarHBondContact O-N 3.35Å; M15-S19 PolarHBondContact O-OG 2.98Å |
| 16 | K | 85.8 | Confident | 79.7 | Confident | 125 Ų | 125 | 119.4 Ų | 119.4 | 54% | 0.543 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -64.5 | -41.6 | 176.5 | -174.9 | 170.2 | -173.7 | -62.8 | 0 | 112.3 | Q12 K13 N14 Q18 S19 D20 | Q12-K16 VanDerWaalsContact O-CB 3.26Å; Q12-K16 WeakPolarHBondContact O-CB 3.36Å; Q12-K16 PolarHBondContact O-N 3.3Å; K13-K16 PolarHBondContact O-N 3.45Å; N14-K16 VanDerWaalsContact C-N 3.34Å; N14-K16 PolarHBondContact O-N 2.79Å; K16-Q18 VanDerWaalsContact C-N 3.35Å; K16-Q18 PolarHBondContact O-N 3.31Å; K16-S19 WeakPolarHBondContact CA-OG 3.27Å; K16-S19 PolarHBondContact O-N 3.49Å; K16-S19 PolarHBondContact O-OG 2.91Å; K16-D20 WeakPolarHBondContact CG-OD2 3.33Å; K16-D20 IonicContact NZ-OD2 2.74Å; K16-D20 PolarHBondContact NZ-OD2 3.48Å; K16-D20 VanDerWaalsContact O-CB 3.27Å; K16-D20 WeakPolarHBondContact O-CB 3.26Å; K16-D20 PolarHBondContact O-N 2.82Å |
| 17 | K | 85.1 | Confident | 78.5 | Confident | 149 Ų | 149 | 122.7 Ų | 122.7 | 65% | 0.648 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -63.4 | -41.9 | 176.5 | -171.5 | -179.9 | 179.9 | -176.1 | 0 | 111.4 | K13 N14 S21 | K13-K17 WeakPolarHBondContact O-CB 3.45Å; K13-K17 PolarHBondContact O-N 2.86Å; N14-K17 PolarHBondContact O-N 3.41Å; K17-S21 VanDerWaalsContact O-CB 3.24Å; K17-S21 WeakPolarHBondContact O-CB 3.44Å; K17-S21 PolarHBondContact O-N 2.82Å; K17-S21 PolarHBondContact O-OG 3.16Å |
| 18 | Q | 80.5 | Confident | 77.3 | Confident | 138 Ų | 138 | 119.7 Ų | 119.7 | 65% | 0.645 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -64.6 | -45.8 | 174 | -75.2 | 178.7 | -24.7 | 0 | 0 | 111.1 | N14 M15 K16 S21 V22 | N14-Q18 WeakPolarHBondContact O-CG 3.35Å; N14-Q18 PolarHBondContact O-N 2.85Å; M15-Q18 PolarHBondContact O-N 3.36Å; K16-Q18 VanDerWaalsContact C-N 3.35Å; K16-Q18 PolarHBondContact O-N 3.31Å; Q18-S21 PolarHBondContact O-N 3.22Å; Q18-V22 VanDerWaalsContact O-CG2 3.26Å; Q18-V22 WeakPolarHBondContact O-CG2 3.34Å; Q18-V22 PolarHBondContact O-N 3.19Å |
| 19 | S | 79.4 | Confident | 76.4 | Confident | 56 Ų | 56 | 119.3 Ų | 119.3 | 39% | 0.392 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -64.8 | -43.4 | 179.2 | 68.5 | 0 | 0 | 0 | 0 | 112.2 | M15 K16 V22 K23 | M15-S19 WeakPolarHBondContact O-CB 3.46Å; M15-S19 PolarHBondContact O-N 3.35Å; M15-S19 PolarHBondContact O-OG 2.98Å; K16-S19 WeakPolarHBondContact CA-OG 3.27Å; K16-S19 PolarHBondContact O-N 3.49Å; K16-S19 PolarHBondContact O-OG 2.91Å; S19-V22 CarbonylContact O-C 3.48Å; S19-V22 WeakPolarHBondContact O-CB 3.09Å; S19-V22 PolarHBondContact O-N 2.69Å; S19-V22 VanDerWaalsContact O-N 3.16Å; S19-K23 WeakPolarHBondContact O-CA 3.19Å; S19-K23 WeakPolarHBondContact O-CB 3.27Å; S19-K23 PolarHBondContact O-N 2.74Å |
| 20 | D | 75.2 | Confident | 75.7 | Confident | 71 Ų | 71 | 118 Ų | 118 | 38% | 0.38 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -69.6 | -37.3 | -179.9 | -70.5 | -16.1 | 0 | 0 | 0 | 111.4 | K16 V22 K23 | K16-D20 WeakPolarHBondContact CG-OD2 3.33Å; K16-D20 IonicContact NZ-OD2 2.74Å; K16-D20 PolarHBondContact NZ-OD2 3.48Å; K16-D20 VanDerWaalsContact O-CB 3.27Å; K16-D20 WeakPolarHBondContact O-CB 3.26Å; K16-D20 PolarHBondContact O-N 2.82Å; D20-V22 PolarHBondContact O-N 3.46Å; D20-K23 CarbonylContact O-C 3.54Å; D20-K23 PolarHBondContact O-N 3.19Å |
| 21 | S | 69.4 | Low | 75.3 | Confident | 61 Ų | 61 | 118 Ų | 118 | 43% | 0.427 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -62 | -25.6 | 172.7 | -60.6 | 0 | 0 | 0 | 0 | 112.2 | K17 Q18 K25 | K17-S21 VanDerWaalsContact O-CB 3.24Å; K17-S21 WeakPolarHBondContact O-CB 3.44Å; K17-S21 PolarHBondContact O-N 2.82Å; K17-S21 PolarHBondContact O-OG 3.16Å; Q18-S21 PolarHBondContact O-N 3.22Å; S21-K25 WeakPolarHBondContact O-CD 3.48Å; S21-K25 WeakPolarHBondContact O-CE 3.26Å; S21-K25 VanDerWaalsContact O-CG 3.27Å; S21-K25 WeakPolarHBondContact O-CG 3.5Å |
| 22 | V | 69.2 | Low | 75 | Confident | 108 Ų | 108 | 114.2 Ų | 114.2 | 66% | 0.655 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -91.2 | -34.6 | 174.6 | 175.9 | 0 | 0 | 0 | 0 | 111.3 | Q18 S19 D20 G24 K25 | Q18-V22 VanDerWaalsContact O-CG2 3.26Å; Q18-V22 WeakPolarHBondContact O-CG2 3.34Å; Q18-V22 PolarHBondContact O-N 3.19Å; S19-V22 CarbonylContact O-C 3.48Å; S19-V22 WeakPolarHBondContact O-CB 3.09Å; S19-V22 PolarHBondContact O-N 2.69Å; S19-V22 VanDerWaalsContact O-N 3.16Å; D20-V22 PolarHBondContact O-N 3.46Å; V22-G24 PolarHBondContact O-N 2.85Å; V22-G24 VanDerWaalsContact O-N 3.14Å; V22-K25 VanDerWaalsContact O-O 3.06Å |
| 23 | K | 62.3 | Low | 74.8 | Confident | 173 Ų | 173 | 113.4 Ų | 113.4 | 75% | 0.752 | 60% | 0.595 | S | S | * | * | S | Bend | trans | -88.3 | 80.3 | -174.4 | -167.8 | -178.4 | -175.5 | -178.4 | 0 | 110 | S19 D20 | S19-K23 WeakPolarHBondContact O-CA 3.19Å; S19-K23 WeakPolarHBondContact O-CB 3.27Å; S19-K23 PolarHBondContact O-N 2.74Å; D20-K23 CarbonylContact O-C 3.54Å; D20-K23 PolarHBondContact O-N 3.19Å |
| 24 | G | 60.6 | Low | 74.7 | Confident | 70 Ų | 70 | 109.4 Ų | 109.4 | 72% | 0.722 | 59% | 0.591 | S | S | * | * | S | Bend | trans | 144.8 | -28.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | V22 R26 | V22-G24 PolarHBondContact O-N 2.85Å; V22-G24 VanDerWaalsContact O-N 3.14Å; G24-R26 PolarHBondContact O-N 2.78Å |
| 25 | K | 57.6 | Low | 74.6 | Confident | 160 Ų | 160 | 106 Ų | 106 | 70% | 0.696 | 58% | 0.577 | S | S | * | * | S | Bend | trans | -64.1 | 92.3 | 149.3 | -63.1 | -171 | -169.6 | -165.6 | 0 | 105.3 | S21 V22 R27 | S21-K25 WeakPolarHBondContact O-CD 3.48Å; S21-K25 WeakPolarHBondContact O-CE 3.26Å; S21-K25 VanDerWaalsContact O-CG 3.27Å; S21-K25 WeakPolarHBondContact O-CG 3.5Å; V22-K25 VanDerWaalsContact O-O 3.06Å; K25-R27 PolarHBondContact O-N 3.05Å |
| 26 | R | 58.4 | Low | 74.7 | Confident | 216 Ų | 216 | 106.1 Ų | 106.1 | 82% | 0.815 | 57% | 0.572 | S | S | * | * | trans | -38.7 | 124.3 | 157.2 | -64.1 | -178.8 | -173.4 | 122.4 | 0.2 | 103.9 | G24 D28 | G24-R26 PolarHBondContact O-N 2.78Å; R26-D28 PolarHBondContact O-N 3.14Å | ||
| 27 | R | 62.1 | Low | 74.9 | Confident | 217 Ų | 217 | 108 Ų | 108 | 82% | 0.819 | 58% | 0.58 | S | S | * | * | trans | -40.8 | 115.2 | 173.5 | -74.7 | -169.1 | 177.3 | -170.3 | 0.2 | 104.4 | K25 D29 | K25-R27 PolarHBondContact O-N 3.05Å; R27-D29 WeakPolarHBondContact CB-OD1 3.35Å; R27-D29 PolarHBondContact O-N 3.13Å | ||
| 28 | D | 60.9 | Low | 75.2 | Confident | 133 Ų | 133 | 106.5 Ų | 106.5 | 71% | 0.711 | 58% | 0.576 | S | S | * | * | trans | -70.2 | 94 | -177.7 | -144.1 | -20.9 | 0 | 0 | 0 | 101.2 | R26 G30 R36 | R26-D28 PolarHBondContact O-N 3.14Å; D28-G30 PolarHBondContact O-N 2.72Å; D28-R36 IonicContact OD1-NH2 3.04Å; D28-R36 PolarHBondContact OD1-NH2 2.85Å | ||
| 29 | D | 73.2 | Confident | 75.6 | Confident | 80 Ų | 80 | 104.1 Ų | 104.1 | 43% | 0.428 | 56% | 0.561 | S | S | . | * | trans | -68.4 | 16.8 | -168.5 | -67.9 | -31.7 | 0 | 0 | 0 | 110.6 | R27 L31 R39 | R27-D29 WeakPolarHBondContact CB-OD1 3.35Å; R27-D29 PolarHBondContact O-N 3.13Å; D29-L31 HydrophobicContact CB-CB 4.43Å; D29-L31 HydrophobicContact CB-CG 4.09Å; D29-L31 PolarHBondContact O-N 3.04Å; D29-R39 IonicContact OD2-CZ 3.62Å; D29-R39 IonicContact OD2-NH1 2.7Å; D29-R39 PolarHBondContact OD2-NH1 3.48Å; D29-R39 IonicContact OD2-NH2 3.7Å | ||
| 30 | G | 73.8 | Confident | 76.2 | Confident | 72 Ų | 72 | 106.1 Ų | 106.1 | 74% | 0.742 | 57% | 0.567 | S | S | * | * | S | Bend | trans | 61 | -1.8 | -169.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | D28 S32 | D28-G30 PolarHBondContact O-N 2.72Å; G30-S32 PolarHBondContact O-N 2.89Å |
| 31 | L | 79.3 | Confident | 77 | Confident | 47 Ų | 47 | 105.2 Ų | 105.2 | 25% | 0.246 | 57% | 0.566 | C | S | . | * | trans | -78 | 127.9 | -169.3 | -73.1 | -154.3 | 0 | 0 | 0 | 111.2 | D29 A35 R36 | D29-L31 HydrophobicContact CB-CB 4.43Å; D29-L31 HydrophobicContact CB-CG 4.09Å; D29-L31 PolarHBondContact O-N 3.04Å; L31-A35 HydrophobicContact CB-CB 4.01Å; L31-A35 HydrophobicContact CD1-CB 3.8Å; L31-A35 HydrophobicContact CD2-CB 3.89Å; L31-A35 HydrophobicContact CG-CB 4.13Å; L31-R36 HydrophobicContact CB-CG 3.81Å; L31-R36 HydrophobicContact CD1-CG 4.4Å; L31-R36 PolarHBondContact O-NE 2.7Å; L31-R36 VanDerWaalsContact O-NE 3.13Å; L31-R36 PolarHBondContact O-NH2 2.7Å | ||
| 32 | S | 83.9 | Confident | 78.1 | Confident | 72 Ų | 72 | 106.5 Ų | 106.5 | 50% | 0.503 | 57% | 0.565 | S | S | . | * | trans | -56 | 158 | 163.9 | 73.8 | 0 | 0 | 0 | 0 | 110.7 | G30 A34 A35 R36 | G30-S32 PolarHBondContact O-N 2.89Å; S32-A34 PolarHBondContact O-N 3.31Å; S32-A35 PolarHBondContact O-N 3.09Å; S32-A35 VanDerWaalsContact O-N 3.09Å; S32-A35 PolarHBondContact OG-N 3.04Å; S32-R36 PolarHBondContact O-N 3.17Å | ||
| 33 | A | 85.7 | Confident | 79.3 | Confident | 85 Ų | 85 | 105.8 Ų | 105.8 | 70% | 0.702 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -55.7 | -34.9 | 178 | 0 | 0 | 0 | 0 | 0 | 112.5 | R36 K37 | A33-R36 PolarHBondContact O-N 2.97Å; A33-K37 PolarHBondContact O-N 3.47Å |
| 34 | A | 88.6 | Confident | 80.8 | Confident | 71 Ų | 71 | 103.1 Ų | 103.1 | 59% | 0.587 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65 | -47 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | S32 R36 K37 Q38 | S32-A34 PolarHBondContact O-N 3.31Å; A34-R36 VanDerWaalsContact C-N 3.29Å; A34-R36 PolarHBondContact O-N 3.17Å; A34-K37 PolarHBondContact O-N 3.39Å; A34-Q38 PolarHBondContact O-N 3.47Å |
| 35 | A | 88.8 | Confident | 82.4 | Confident | 29 Ų | 29 | 104.9 Ų | 104.9 | 24% | 0.24 | 54% | 0.538 | C | S | . | . | H | α-helix | trans | -65 | -34.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | L31 S32 Q38 R39 | L31-A35 HydrophobicContact CB-CB 4.01Å; L31-A35 HydrophobicContact CD1-CB 3.8Å; L31-A35 HydrophobicContact CD2-CB 3.89Å; L31-A35 HydrophobicContact CG-CB 4.13Å; S32-A35 PolarHBondContact O-N 3.09Å; S32-A35 VanDerWaalsContact O-N 3.09Å; S32-A35 PolarHBondContact OG-N 3.04Å; A35-Q38 PolarHBondContact O-N 3.39Å; A35-R39 WeakPolarHBondContact O-CB 3.44Å; A35-R39 PolarHBondContact O-N 2.99Å |
| 36 | R | 87.8 | Confident | 84.1 | Confident | 95 Ų | 95 | 103.5 Ų | 103.5 | 36% | 0.358 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.2 | -46.9 | 171.6 | -65.9 | -179 | -164.7 | 176.9 | -2.6 | 111.6 | D28 L31 S32 A33 A34 Q38 R39 D40 | D28-R36 IonicContact OD1-NH2 3.04Å; D28-R36 PolarHBondContact OD1-NH2 2.85Å; L31-R36 HydrophobicContact CB-CG 3.81Å; L31-R36 HydrophobicContact CD1-CG 4.4Å; L31-R36 PolarHBondContact O-NE 2.7Å; L31-R36 VanDerWaalsContact O-NE 3.13Å; L31-R36 PolarHBondContact O-NH2 2.7Å; S32-R36 PolarHBondContact O-N 3.17Å; A33-R36 PolarHBondContact O-N 2.97Å; A34-R36 VanDerWaalsContact C-N 3.29Å; A34-R36 PolarHBondContact O-N 3.17Å; R36-Q38 VanDerWaalsContact C-N 3.32Å; R36-Q38 PolarHBondContact O-N 3.4Å; R36-R39 PolarHBondContact O-N 3.05Å; R36-D40 WeakPolarHBondContact O-CB 3.41Å; R36-D40 VanDerWaalsContact O-CG 3.27Å; R36-D40 PolarHBondContact O-N 3.44Å |
| 37 | K | 91.9 | Very high | 85.9 | Confident | 165 Ų | 165 | 101 Ų | 101 | 72% | 0.717 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -59.4 | -42.6 | 177.8 | -174.3 | 177.9 | 179.8 | -178.1 | 0 | 111.8 | A33 A34 S41 | A33-K37 PolarHBondContact O-N 3.47Å; A34-K37 PolarHBondContact O-N 3.39Å; K37-S41 WeakPolarHBondContact O-CB 3.32Å; K37-S41 PolarHBondContact O-N 2.98Å; K37-S41 PolarHBondContact O-OG 2.97Å |
| 38 | Q | 90.6 | Very high | 87.4 | Confident | 118 Ų | 118 | 96 Ų | 96 | 55% | 0.551 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.6 | -50.1 | 176 | -173.9 | -179.1 | -17.3 | 0 | 0 | 111.2 | A34 A35 R36 D40 S41 E42 | A34-Q38 PolarHBondContact O-N 3.47Å; A35-Q38 PolarHBondContact O-N 3.39Å; R36-Q38 VanDerWaalsContact C-N 3.32Å; R36-Q38 PolarHBondContact O-N 3.4Å; Q38-D40 PolarHBondContact O-N 2.65Å; Q38-S41 PolarHBondContact O-N 3.14Å; Q38-S41 VanDerWaalsContact O-N 3.14Å; Q38-S41 PolarHBondContact O-OG 3.42Å; Q38-E42 WeakPolarHBondContact CG-OE1 3.38Å; Q38-E42 PolarHBondContact NE2-OE1 3.25Å; Q38-E42 WeakPolarHBondContact O-CG 3.33Å; Q38-E42 PolarHBondContact O-N 3.5Å |
| 39 | R | 88.9 | Confident | 88.9 | Confident | 88 Ų | 88 | 96.1 Ų | 96.1 | 33% | 0.332 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -57 | -46.8 | 177.2 | -173 | -164.2 | -71.7 | 165.4 | -16.3 | 112.3 | D29 A35 R36 S41 E42 I43 | D29-R39 IonicContact OD2-CZ 3.62Å; D29-R39 IonicContact OD2-NH1 2.7Å; D29-R39 PolarHBondContact OD2-NH1 3.48Å; D29-R39 IonicContact OD2-NH2 3.7Å; A35-R39 WeakPolarHBondContact O-CB 3.44Å; A35-R39 PolarHBondContact O-N 2.99Å; R36-R39 PolarHBondContact O-N 3.05Å; R39-S41 VanDerWaalsContact C-N 3.28Å; R39-S41 PolarHBondContact O-N 3.4Å; R39-E42 PolarHBondContact O-N 2.98Å; R39-I43 HydrophobicContact CG-CD1 3.97Å; R39-I43 VanDerWaalsContact O-CG1 3.32Å; R39-I43 WeakPolarHBondContact O-CG1 3.44Å; R39-I43 PolarHBondContact O-N 3.26Å |
| 40 | D | 91.3 | Very high | 89.8 | Confident | 98 Ų | 98 | 98.3 Ų | 98.3 | 52% | 0.524 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.4 | -37.2 | 179.4 | -69.6 | -12.3 | 0 | 0 | 0 | 111.2 | R36 Q38 M44 | R36-D40 WeakPolarHBondContact O-CB 3.41Å; R36-D40 VanDerWaalsContact O-CG 3.27Å; R36-D40 PolarHBondContact O-N 3.44Å; Q38-D40 PolarHBondContact O-N 2.65Å; D40-M44 WeakPolarHBondContact O-CB 3.45Å; D40-M44 PolarHBondContact O-N 3.03Å |
| 41 | S | 92.6 | Very high | 90.7 | Very high | 51 Ų | 51 | 97 Ų | 97 | 36% | 0.357 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.9 | -40.9 | 175.4 | 75.8 | 0 | 0 | 0 | 0 | 112.7 | K37 Q38 R39 M44 Q45 | K37-S41 WeakPolarHBondContact O-CB 3.32Å; K37-S41 PolarHBondContact O-N 2.98Å; K37-S41 PolarHBondContact O-OG 2.97Å; Q38-S41 PolarHBondContact O-N 3.14Å; Q38-S41 VanDerWaalsContact O-N 3.14Å; Q38-S41 PolarHBondContact O-OG 3.42Å; R39-S41 VanDerWaalsContact C-N 3.28Å; R39-S41 PolarHBondContact O-N 3.4Å; S41-M44 PolarHBondContact O-N 2.97Å; S41-Q45 WeakPolarHBondContact O-CG 3.38Å; S41-Q45 PolarHBondContact O-N 3.35Å |
| 42 | E | 92.5 | Very high | 91.2 | Very high | 88 Ų | 88 | 98.8 Ų | 98.8 | 41% | 0.411 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.6 | -44.6 | 176.8 | -71.3 | 171.5 | -167.7 | 0 | 0 | 111.2 | Q38 R39 M44 Q45 Q46 | Q38-E42 WeakPolarHBondContact CG-OE1 3.38Å; Q38-E42 PolarHBondContact NE2-OE1 3.25Å; Q38-E42 WeakPolarHBondContact O-CG 3.33Å; Q38-E42 PolarHBondContact O-N 3.5Å; R39-E42 PolarHBondContact O-N 2.98Å; E42-M44 VanDerWaalsContact C-N 3.31Å; E42-M44 PolarHBondContact O-N 2.92Å; E42-Q45 PolarHBondContact O-N 3.31Å; E42-Q46 WeakPolarHBondContact O-CG 3.37Å; E42-Q46 PolarHBondContact O-N 2.96Å |
| 43 | I | 94.2 | Very high | 91.4 | Very high | 93 Ų | 93 | 101 Ų | 101 | 48% | 0.477 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.8 | -41.9 | 175.8 | -68.1 | 169 | 0 | 0 | 0 | 110.6 | R39 Q46 K47 | R39-I43 HydrophobicContact CG-CD1 3.97Å; R39-I43 VanDerWaalsContact O-CG1 3.32Å; R39-I43 WeakPolarHBondContact O-CG1 3.44Å; R39-I43 PolarHBondContact O-N 3.26Å; I43-Q46 PolarHBondContact O-N 3.47Å; I43-K47 WeakPolarHBondContact O-CB 3.39Å; I43-K47 PolarHBondContact O-N 2.95Å |
| 44 | M | 94.5 | Very high | 91.5 | Very high | 118 Ų | 118 | 103.5 Ų | 103.5 | 58% | 0.581 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.7 | -45 | 178.1 | -172.7 | -179.4 | -64 | 0 | 0 | 111.8 | D40 S41 E42 K47 Q48 | D40-M44 WeakPolarHBondContact O-CB 3.45Å; D40-M44 PolarHBondContact O-N 3.03Å; S41-M44 PolarHBondContact O-N 2.97Å; E42-M44 VanDerWaalsContact C-N 3.31Å; E42-M44 PolarHBondContact O-N 2.92Å; M44-K47 PolarHBondContact O-N 3.45Å; M44-Q48 WeakPolarHBondContact O-CG 3.37Å; M44-Q48 PolarHBondContact O-N 2.93Å |
| 45 | Q | 93 | Very high | 91.2 | Very high | 107 Ų | 107 | 108.1 Ų | 108.1 | 50% | 0.5 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62 | -44.1 | 176.5 | -72.8 | 177.9 | 17.5 | 0 | 0 | 111.8 | S41 E42 K47 Q48 K49 | S41-Q45 WeakPolarHBondContact O-CG 3.38Å; S41-Q45 PolarHBondContact O-N 3.35Å; E42-Q45 PolarHBondContact O-N 3.31Å; Q45-K47 VanDerWaalsContact C-N 3.32Å; Q45-K47 PolarHBondContact O-N 3.48Å; Q45-Q48 PolarHBondContact O-N 3.49Å; Q45-K49 WeakPolarHBondContact O-CG 3.26Å; Q45-K49 PolarHBondContact O-N 3.41Å |
| 46 | Q | 93.8 | Very high | 90.5 | Very high | 131 Ų | 131 | 114 Ų | 114 | 61% | 0.612 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.1 | -41.9 | 175.6 | -73.5 | 178.1 | 0.9 | 0 | 0 | 111.8 | E42 I43 Q48 K49 K50 | E42-Q46 WeakPolarHBondContact O-CG 3.37Å; E42-Q46 PolarHBondContact O-N 2.96Å; I43-Q46 PolarHBondContact O-N 3.47Å; Q46-Q48 VanDerWaalsContact C-N 3.34Å; Q46-Q48 PolarHBondContact O-N 3.25Å; Q46-K49 PolarHBondContact O-N 2.88Å; Q46-K50 WeakPolarHBondContact O-CB 3.34Å; Q46-K50 PolarHBondContact O-N 2.92Å |
| 47 | K | 96 | Very high | 89.4 | Confident | 164 Ų | 164 | 116.3 Ų | 116.3 | 71% | 0.713 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -63.8 | -39.7 | 176.5 | -171.7 | 178.3 | 179.8 | -177.7 | 0 | 111.8 | I43 M44 Q45 A51 | I43-K47 WeakPolarHBondContact O-CB 3.39Å; I43-K47 PolarHBondContact O-N 2.95Å; M44-K47 PolarHBondContact O-N 3.45Å; Q45-K47 VanDerWaalsContact C-N 3.32Å; Q45-K47 PolarHBondContact O-N 3.48Å; K47-A51 VanDerWaalsContact O-CB 3.25Å; K47-A51 WeakPolarHBondContact O-CB 3.25Å; K47-A51 PolarHBondContact O-N 3.17Å |
| 48 | Q | 93.6 | Very high | 88.2 | Confident | 112 Ų | 112 | 114.2 Ų | 114.2 | 52% | 0.523 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -66.3 | -46.4 | 175.6 | -73.7 | 176.5 | -2.1 | 0 | 0 | 111.8 | M44 Q45 Q46 K50 A51 N52 | M44-Q48 WeakPolarHBondContact O-CG 3.37Å; M44-Q48 PolarHBondContact O-N 2.93Å; Q45-Q48 PolarHBondContact O-N 3.49Å; Q46-Q48 VanDerWaalsContact C-N 3.34Å; Q46-Q48 PolarHBondContact O-N 3.25Å; Q48-K50 PolarHBondContact O-N 2.94Å; Q48-A51 PolarHBondContact O-N 3.27Å; Q48-N52 PolarHBondContact O-N 3.29Å |
| 49 | K | 92.9 | Very high | 86.8 | Confident | 134 Ų | 134 | 121.9 Ų | 121.9 | 58% | 0.583 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -56.6 | -51.3 | 175 | -72.3 | 179.3 | -179.2 | -174.8 | 0 | 111.4 | Q45 Q46 A51 N52 E53 | Q45-K49 WeakPolarHBondContact O-CG 3.26Å; Q45-K49 PolarHBondContact O-N 3.41Å; Q46-K49 PolarHBondContact O-N 2.88Å; K49-A51 VanDerWaalsContact C-N 3.27Å; K49-A51 PolarHBondContact O-N 3.17Å; K49-N52 PolarHBondContact O-N 3.33Å; K49-E53 WeakPolarHBondContact O-CG 3.36Å; K49-E53 PolarHBondContact O-N 3.33Å |
| 50 | K | 92.6 | Very high | 86.7 | Confident | 127 Ų | 127 | 123.6 Ų | 123.6 | 55% | 0.552 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -61.6 | -34 | 177.4 | -170.3 | 171.2 | -171.4 | 168.3 | 0 | 113.1 | Q46 Q48 K54 | Q46-K50 WeakPolarHBondContact O-CB 3.34Å; Q46-K50 PolarHBondContact O-N 2.92Å; Q48-K50 PolarHBondContact O-N 2.94Å; K50-K54 WeakPolarHBondContact O-CB 3.47Å; K50-K54 VanDerWaalsContact O-CG 3.26Å; K50-K54 WeakPolarHBondContact O-CG 3.33Å; K50-K54 PolarHBondContact O-N 2.92Å |
| 51 | A | 92.1 | Very high | 86.5 | Confident | 44 Ų | 44 | 124.9 Ų | 124.9 | 36% | 0.364 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -70.8 | -34.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | K47 Q48 K49 K55 | K47-A51 VanDerWaalsContact O-CB 3.25Å; K47-A51 WeakPolarHBondContact O-CB 3.25Å; K47-A51 PolarHBondContact O-N 3.17Å; Q48-A51 PolarHBondContact O-N 3.27Å; K49-A51 VanDerWaalsContact C-N 3.27Å; K49-A51 PolarHBondContact O-N 3.17Å; A51-K55 WeakPolarHBondContact O-CG 3.42Å; A51-K55 PolarHBondContact O-N 3.05Å |
| 52 | N | 90.7 | Very high | 86.2 | Confident | 85 Ų | 85 | 129.1 Ų | 129.1 | 46% | 0.455 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -73.3 | -44 | 175.3 | -69.8 | -6.1 | 0 | 0 | 0 | 111.5 | Q48 K49 K54 K55 E56 | Q48-N52 PolarHBondContact O-N 3.29Å; K49-N52 PolarHBondContact O-N 3.33Å; N52-K54 VanDerWaalsContact C-N 3.29Å; N52-K54 PolarHBondContact O-N 2.87Å; N52-K55 CarbonylContact O-C 3.57Å; N52-K55 WeakPolarHBondContact O-CA 3.44Å; N52-K55 WeakPolarHBondContact O-CB 3.49Å; N52-K55 PolarHBondContact O-N 2.87Å; N52-E56 WeakPolarHBondContact O-CG 3.4Å; N52-E56 PolarHBondContact O-N 2.92Å |
| 53 | E | 88.1 | Confident | 85.8 | Confident | 118 Ų | 118 | 131.5 Ų | 131.5 | 55% | 0.551 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -54.9 | -45.6 | 173.8 | -71.9 | 168.6 | 173.4 | 0 | 0 | 111.3 | K49 K55 E56 E57 | K49-E53 WeakPolarHBondContact O-CG 3.36Å; K49-E53 PolarHBondContact O-N 3.33Å; E53-K55 PolarHBondContact O-N 3.25Å; E53-E56 CarbonylContact O-C 3.57Å; E53-E56 PolarHBondContact O-N 2.85Å; E53-E56 VanDerWaalsContact O-N 3.12Å; E53-E57 PolarHBondContact O-N 3.12Å |
| 54 | K | 86.4 | Confident | 85.3 | Confident | 138 Ų | 138 | 133.9 Ų | 133.9 | 60% | 0.6 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -64.1 | -22.9 | 175.2 | -75.7 | -178.5 | 176 | -158.4 | 0 | 114.8 | K50 N52 | K50-K54 WeakPolarHBondContact O-CB 3.47Å; K50-K54 VanDerWaalsContact O-CG 3.26Å; K50-K54 WeakPolarHBondContact O-CG 3.33Å; K50-K54 PolarHBondContact O-N 2.92Å; N52-K54 VanDerWaalsContact C-N 3.29Å; N52-K54 PolarHBondContact O-N 2.87Å |
| 55 | K | 82.3 | Confident | 84.7 | Confident | 168 Ų | 168 | 134.9 Ų | 134.9 | 73% | 0.73 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -85.5 | -30.6 | 174.5 | -73.9 | 174.6 | 178.8 | -175.5 | 0 | 111.4 | A51 N52 E53 | A51-K55 WeakPolarHBondContact O-CG 3.42Å; A51-K55 PolarHBondContact O-N 3.05Å; N52-K55 CarbonylContact O-C 3.57Å; N52-K55 WeakPolarHBondContact O-CA 3.44Å; N52-K55 WeakPolarHBondContact O-CB 3.49Å; N52-K55 PolarHBondContact O-N 2.87Å; E53-K55 PolarHBondContact O-N 3.25Å |
| 56 | E | 74.3 | Confident | 84.1 | Confident | 153 Ų | 153 | 136.9 Ų | 136.9 | 72% | 0.715 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -83.2 | -20.5 | 178.7 | -72.4 | -178.5 | -177.9 | 0 | 0 | 112.9 | N52 E53 P58 | N52-E56 WeakPolarHBondContact O-CG 3.4Å; N52-E56 PolarHBondContact O-N 2.92Å; E53-E56 CarbonylContact O-C 3.57Å; E53-E56 PolarHBondContact O-N 2.85Å; E53-E56 VanDerWaalsContact O-N 3.12Å; E56-P58 WeakPolarHBondContact O-CD 3.09Å |
| 57 | E | 65.1 | Low | 83.3 | Confident | 143 Ų | 143 | 137.4 Ų | 137.4 | 67% | 0.668 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -58.2 | 108.1 | 166.2 | -82 | -178 | 179.1 | 0 | 0 | 108.8 | E53 K59 | E53-E57 PolarHBondContact O-N 3.12Å; E57-K59 PolarHBondContact O-N 3.38Å |
| 58 | P | 67.7 | Low | 82.3 | Confident | 120 Ų | 120 | 135.2 Ų | 135.2 | 78% | 0.779 | 65% | 0.645 | S | S | * | * | trans | -69.4 | 129.8 | 175.3 | 30.8 | -30 | 0 | 0 | 0 | 107.2 | E56 | E56-P58 WeakPolarHBondContact O-CD 3.09Š| ||
| 59 | K | 61.4 | Low | 81.2 | Confident | 280 Ų | 280 | 137.3 Ų | 137.3 | 100% | 1.217 | 66% | 0.656 | S | S | * | * | trans | -58.7 | 0 | 166 | -81.6 | -177.2 | 174.9 | 175.6 | 0 | 111.3 | E57 | E57-K59 PolarHBondContact O-N 3.38Š|
Retrieved 59 of 59 residues in 248.4 ms
(Link to these results)