| 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 | 50.2 | Low | 55.6 | Low | 241 Ų | 241 | 133.6 Ų | 133.6 | 100% | 1.187 | 79% | 0.79 | S | S | * | * | 0 | 109.7 | 0 | -18.5 | -175.3 | -158.3 | 0 | 0 | 105.6 | |||||
| 2 | T | 57.8 | Low | 55.1 | Low | 143 Ų | 143 | 138.1 Ų | 138.1 | 88% | 0.877 | 80% | 0.797 | S | S | * | * | trans | -97 | 116 | -174 | -78.7 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 3 | T | 61.8 | Low | 55 | Low | 139 Ų | 139 | 138.8 Ų | 138.8 | 85% | 0.853 | 79% | 0.786 | S | S | * | * | trans | -90.7 | 112.1 | 176 | -58.1 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 4 | A | 54.3 | Low | 54.8 | Low | 89 Ų | 89 | 136.9 Ų | 136.9 | 74% | 0.736 | 78% | 0.781 | S | S | * | * | trans | -106.1 | 121.8 | 168.3 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 5 | A | 59.3 | Low | 54.8 | Low | 92 Ų | 92 | 134.4 Ų | 134.4 | 76% | 0.76 | 77% | 0.769 | S | S | * | * | trans | -165 | 113.7 | 152.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 6 | P | 64.9 | Low | 54.8 | Low | 122 Ų | 122 | 133.8 Ų | 133.8 | 79% | 0.792 | 76% | 0.763 | S | S | * | * | trans | -111.2 | 107.3 | 144.3 | 32 | -18.6 | 0 | 0 | 0 | 106.7 | ||||
| 7 | L | 45.7 | Very low | 54.8 | Low | 135 Ų | 135 | 132.2 Ų | 132.2 | 71% | 0.707 | 76% | 0.756 | S | S | * | * | trans | -121.4 | 102.2 | 160.8 | -165.3 | 59.3 | 0 | 0 | 0 | 107.8 | N9 | L7-N9 PolarHBondContact O-N 3.45Å; L7-N9 VanDerWaalsContact O-N 3.17Å; L7-N9 PolarHBondContact O-OD1 3.2Å | ||
| 8 | I | 57 | Low | 54.8 | Low | 136 Ų | 136 | 129.9 Ų | 129.9 | 70% | 0.697 | 75% | 0.745 | S | S | * | * | trans | -71.4 | 97.4 | 168.7 | -65.1 | 164.7 | 0 | 0 | 0 | 105.6 | N10 | I8-N10 HydrophobicContact CG2-CB 3.87Å; I8-N10 PolarHBondContact O-N 2.78Å | ||
| 9 | N | 49.2 | Very low | 54.9 | Low | 115 Ų | 115 | 125.7 Ų | 125.7 | 62% | 0.615 | 73% | 0.728 | S | S | * | * | trans | -91.9 | 57.1 | 168.4 | -51.9 | 76.5 | 0 | 0 | 0 | 109.2 | L7 T11 | L7-N9 PolarHBondContact O-N 3.45Å; L7-N9 VanDerWaalsContact O-N 3.17Å; L7-N9 PolarHBondContact O-OD1 3.2Å; N9-T11 PolarHBondContact O-N 3.24Å | ||
| 10 | N | 57.3 | Low | 54.8 | Low | 150 Ų | 150 | 126.6 Ų | 126.6 | 80% | 0.802 | 72% | 0.722 | S | S | * | * | trans | -79.6 | 57.5 | 169.4 | -85.7 | 4.9 | 0 | 0 | 0 | 111 | I8 | I8-N10 HydrophobicContact CG2-CB 3.87Å; I8-N10 PolarHBondContact O-N 2.78Å | ||
| 11 | T | 53.7 | Low | 54.9 | Low | 108 Ų | 108 | 124 Ų | 124 | 66% | 0.663 | 71% | 0.712 | S | S | * | * | trans | -125.6 | 40.4 | 164.9 | 24.4 | 0 | 0 | 0 | 0 | 110.3 | N9 F13 | N9-T11 PolarHBondContact O-N 3.24Å; T11-F13 WeakPolarHBondContact O-CD2 3.15Å; T11-F13 PolarHBondContact O-N 3.37Å | ||
| 12 | Q | 50.4 | Low | 55.2 | Low | 187 Ų | 187 | 118.3 Ų | 118.3 | 87% | 0.874 | 68% | 0.683 | S | S | * | * | trans | -70.9 | 83.7 | 155.1 | -169.8 | 166.7 | -18.8 | 0 | 0 | 107.6 | ||||
| 13 | F | 53 | Low | 55.1 | Low | 148 Ų | 148 | 118 Ų | 118 | 65% | 0.649 | 67% | 0.671 | S | S | * | * | trans | -34.9 | 127.7 | 159.9 | -81.7 | -93.5 | 0 | 0 | 0 | 110.1 | T11 V15 | T11-F13 WeakPolarHBondContact O-CD2 3.15Å; T11-F13 PolarHBondContact O-N 3.37Å; F13-V15 HydrophobicContact CB-CB 4.08Å; F13-V15 HydrophobicContact CB-CG2 3.79Å; F13-V15 HydrophobicContact CD1-CG2 3.89Å; F13-V15 HydrophobicContact CG-CG2 4.26Å; F13-V15 PolarHBondContact O-N 3.45Å | ||
| 14 | P | 52.8 | Low | 54.8 | Low | 112 Ų | 112 | 117.9 Ų | 117.9 | 73% | 0.727 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | 59.5 | 164.1 | 33.7 | -33.7 | 0 | 0 | 0 | 108.7 | ||
| 15 | V | 55.1 | Low | 54.9 | Low | 99 Ų | 99 | 116.7 Ų | 116.7 | 60% | 0.6 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.9 | -17.3 | 176.9 | 168.5 | 0 | 0 | 0 | 0 | 110.9 | F13 | F13-V15 HydrophobicContact CB-CB 4.08Å; F13-V15 HydrophobicContact CB-CG2 3.79Å; F13-V15 HydrophobicContact CD1-CG2 3.89Å; F13-V15 HydrophobicContact CG-CG2 4.26Å; F13-V15 PolarHBondContact O-N 3.45Å |
| 16 | N | 54 | Low | 55 | Low | 124 Ų | 124 | 116.6 Ų | 116.6 | 66% | 0.663 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.3 | 13.5 | -171.2 | -148.2 | 58.1 | 0 | 0 | 0 | 115.9 | ||
| 17 | V | 54.8 | Low | 54.5 | Low | 108 Ų | 108 | 120.2 Ų | 120.2 | 66% | 0.655 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.5 | -19.8 | 172 | -138.9 | 0 | 0 | 0 | 0 | 112 | ||
| 18 | T | 55.8 | Low | 55.3 | Low | 90 Ų | 90 | 121.8 Ų | 121.8 | 55% | 0.552 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -78.9 | -31.8 | -173.5 | -48.7 | 0 | 0 | 0 | 0 | 113.2 | Q22 | T18-Q22 VanDerWaalsContact O-CB 3.29Å; T18-Q22 WeakPolarHBondContact O-CB 3.29Å; T18-Q22 PolarHBondContact O-N 3.12Å |
| 19 | A | 55.9 | Low | 55.8 | Low | 51 Ų | 51 | 117.4 Ų | 117.4 | 42% | 0.421 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -67.6 | -41.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | S21 Q22 E23 | A19-S21 VanDerWaalsContact C-N 3.35Å; A19-S21 PolarHBondContact O-N 3.41Å; A19-Q22 WeakPolarHBondContact O-CB 3.47Å; A19-Q22 PolarHBondContact O-N 3.44Å; A19-Q22 VanDerWaalsContact O-N 3.16Å; A19-E23 WeakPolarHBondContact O-CG 3.4Å; A19-E23 PolarHBondContact O-N 3.22Å |
| 20 | K | 52.9 | Low | 57 | Low | 142 Ų | 142 | 115 Ų | 115 | 62% | 0.617 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -67.4 | -36.8 | -180 | -46.7 | -167.9 | -172.9 | 178.4 | 0 | 111.9 | Q24 | K20-Q24 PolarHBondContact O-N 3.05Å |
| 21 | S | 57.6 | Low | 58.3 | Low | 73 Ų | 73 | 110.1 Ų | 110.1 | 51% | 0.51 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -71 | -31.7 | 172.6 | -176 | 0 | 0 | 0 | 0 | 112.5 | A19 S25 | A19-S21 VanDerWaalsContact C-N 3.35Å; A19-S21 PolarHBondContact O-N 3.41Å; S21-S25 WeakPolarHBondContact O-CB 3.38Å; S21-S25 PolarHBondContact O-N 3.35Å |
| 22 | Q | 55.7 | Low | 59.8 | Low | 121 Ų | 121 | 107.6 Ų | 107.6 | 57% | 0.565 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -68 | -43.2 | 177.2 | -171.6 | 176.7 | 3 | 0 | 0 | 110.6 | T18 A19 S25 L26 | T18-Q22 VanDerWaalsContact O-CB 3.29Å; T18-Q22 WeakPolarHBondContact O-CB 3.29Å; T18-Q22 PolarHBondContact O-N 3.12Å; A19-Q22 WeakPolarHBondContact O-CB 3.47Å; A19-Q22 PolarHBondContact O-N 3.44Å; A19-Q22 VanDerWaalsContact O-N 3.16Å; Q22-S25 PolarHBondContact O-N 2.7Å; Q22-L26 HydrophobicContact CG-CD1 4.14Å; Q22-L26 WeakPolarHBondContact O-CB 3.05Å; Q22-L26 WeakPolarHBondContact O-CD1 2.92Å; Q22-L26 WeakPolarHBondContact O-CG 3.44Å; Q22-L26 PolarHBondContact O-N 3.44Å |
| 23 | E | 55.3 | Low | 61.6 | Low | 136 Ų | 136 | 103 Ų | 103 | 64% | 0.636 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -68.8 | -38.1 | 178.7 | -49.2 | -131.9 | 125.7 | 0 | 0 | 112.1 | A19 L26 Y27 | A19-E23 WeakPolarHBondContact O-CG 3.4Å; A19-E23 PolarHBondContact O-N 3.22Å; E23-L26 PolarHBondContact O-N 3.48Å; E23-Y27 PolarHBondContact O-N 3.15Å |
| 24 | Q | 55.9 | Low | 63.5 | Low | 138 Ų | 138 | 100.1 Ų | 100.1 | 65% | 0.645 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -68.8 | -37.9 | 171.2 | -77.4 | -176.7 | -42.8 | 0 | 0 | 112.5 | K20 L26 Y27 Q28 | K20-Q24 PolarHBondContact O-N 3.05Å; Q24-L26 VanDerWaalsContact C-N 3.28Å; Q24-L26 PolarHBondContact O-N 3.5Å; Q24-Y27 PolarHBondContact O-N 3.16Å; Q24-Q28 WeakPolarHBondContact O-CB 3.24Å; Q24-Q28 PolarHBondContact O-N 3.29Å |
| 25 | S | 57.4 | Low | 65.3 | Low | 64 Ų | 64 | 97.1 Ų | 97.1 | 45% | 0.448 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.6 | -35.2 | 173.2 | -173.5 | 0 | 0 | 0 | 0 | 111.5 | S21 Q22 S29 | S21-S25 WeakPolarHBondContact O-CB 3.38Å; S21-S25 PolarHBondContact O-N 3.35Å; Q22-S25 PolarHBondContact O-N 2.7Å; S25-S29 WeakPolarHBondContact O-CA 3.49Å; S25-S29 WeakPolarHBondContact O-CB 3Å; S25-S29 PolarHBondContact O-N 3.14Å; S25-S29 PolarHBondContact O-OG 3.38Å |
| 26 | L | 59.9 | Low | 67 | Low | 89 Ų | 89 | 95.5 Ų | 95.5 | 47% | 0.466 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -68.3 | -37.2 | 179.3 | -74.6 | 162.3 | 0 | 0 | 0 | 112.5 | Q22 E23 Q24 S30 | Q22-L26 HydrophobicContact CG-CD1 4.14Å; Q22-L26 WeakPolarHBondContact O-CB 3.05Å; Q22-L26 WeakPolarHBondContact O-CD1 2.92Å; Q22-L26 WeakPolarHBondContact O-CG 3.44Å; Q22-L26 PolarHBondContact O-N 3.44Å; E23-L26 PolarHBondContact O-N 3.48Å; Q24-L26 VanDerWaalsContact C-N 3.28Å; Q24-L26 PolarHBondContact O-N 3.5Å; L26-S30 PolarHBondContact O-N 2.85Å |
| 27 | Y | 56.3 | Low | 68.9 | Low | 199 Ų | 199 | 94.7 Ų | 94.7 | 78% | 0.78 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -85.2 | -38.9 | 176.8 | -87.2 | -83.6 | 0 | 0 | 0 | 113.7 | E23 Q24 S29 S30 | E23-Y27 PolarHBondContact O-N 3.15Å; Q24-Y27 PolarHBondContact O-N 3.16Å; Y27-S29 VanDerWaalsContact C-N 3.31Å; Y27-S30 VanDerWaalsContact O-CB 3.23Å; Y27-S30 WeakPolarHBondContact O-CB 3.11Å; Y27-S30 PolarHBondContact O-N 3.19Å; Y27-S30 PolarHBondContact O-OG 2.65Å |
| 28 | Q | 62.1 | Low | 70.9 | Confident | 168 Ų | 168 | 93 Ų | 93 | 79% | 0.785 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -71.4 | -26.9 | 176.8 | -171.9 | 171.9 | -28.3 | 0 | 0 | 112.3 | Q24 | Q24-Q28 WeakPolarHBondContact O-CB 3.24Å; Q24-Q28 PolarHBondContact O-N 3.29Å |
| 29 | S | 67.6 | Low | 72.8 | Confident | 43 Ų | 43 | 92.7 Ų | 92.7 | 30% | 0.301 | 52% | 0.524 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.4 | 18.2 | 171.6 | -44.6 | 0 | 0 | 0 | 0 | 112.5 | S25 Y27 G31 A32 I33 | S25-S29 WeakPolarHBondContact O-CA 3.49Å; S25-S29 WeakPolarHBondContact O-CB 3Å; S25-S29 PolarHBondContact O-N 3.14Å; S25-S29 PolarHBondContact O-OG 3.38Å; Y27-S29 VanDerWaalsContact C-N 3.31Å; S29-G31 PolarHBondContact O-N 2.8Å; S29-A32 CarbonylContact O-C 3.59Å; S29-A32 VanDerWaalsContact O-CA 3.31Å; S29-A32 WeakPolarHBondContact O-CA 2.94Å; S29-A32 VanDerWaalsContact O-CB 3.24Å; S29-A32 WeakPolarHBondContact O-CB 3.42Å; S29-A32 PolarHBondContact O-N 3.38Å; S29-I33 PolarHBondContact O-N 3.5Å |
| 30 | S | 74.5 | Confident | 74.8 | Confident | 65 Ų | 65 | 91.7 Ų | 91.7 | 46% | 0.455 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -52.5 | -40 | 172.6 | 51.5 | 0 | 0 | 0 | 0 | 111.3 | L26 Y27 A32 I33 V34 | L26-S30 PolarHBondContact O-N 2.85Å; Y27-S30 VanDerWaalsContact O-CB 3.23Å; Y27-S30 WeakPolarHBondContact O-CB 3.11Å; Y27-S30 PolarHBondContact O-N 3.19Å; Y27-S30 PolarHBondContact O-OG 2.65Å; S30-A32 VanDerWaalsContact C-N 3.32Å; S30-A32 PolarHBondContact O-N 2.68Å; S30-I33 PolarHBondContact O-N 2.96Å; S30-V34 WeakPolarHBondContact O-CG2 3.04Å; S30-V34 PolarHBondContact O-N 3.46Å; S30-V34 VanDerWaalsContact O-N 3.12Å |
| 31 | G | 84.3 | Confident | 76.9 | Confident | 47 Ų | 47 | 89.2 Ų | 89.2 | 49% | 0.485 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.4 | -30.1 | 170.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | S29 A35 | S29-G31 PolarHBondContact O-N 2.8Å; G31-A35 WeakPolarHBondContact O-CB 3.5Å; G31-A35 PolarHBondContact O-N 3.42Å |
| 32 | A | 84.6 | Confident | 78.8 | Confident | 56 Ų | 56 | 90.1 Ų | 90.1 | 46% | 0.463 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -73.5 | -37.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | S29 S30 V34 A35 A36 | S29-A32 CarbonylContact O-C 3.59Å; S29-A32 VanDerWaalsContact O-CA 3.31Å; S29-A32 WeakPolarHBondContact O-CA 2.94Å; S29-A32 VanDerWaalsContact O-CB 3.24Å; S29-A32 WeakPolarHBondContact O-CB 3.42Å; S29-A32 PolarHBondContact O-N 3.38Å; S30-A32 VanDerWaalsContact C-N 3.32Å; S30-A32 PolarHBondContact O-N 2.68Å; A32-V34 VanDerWaalsContact C-N 3.34Å; A32-A35 PolarHBondContact O-N 3.43Å; A32-A36 VanDerWaalsContact O-CB 3.32Å; A32-A36 WeakPolarHBondContact O-CB 3.13Å; A32-A36 PolarHBondContact O-N 2.76Å |
| 33 | I | 88.7 | Confident | 80.8 | Confident | 89 Ų | 89 | 89 Ų | 89 | 46% | 0.456 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.5 | -46.8 | 173.5 | -63.3 | 165.5 | 0 | 0 | 0 | 109.1 | S29 S30 A36 I37 | S29-I33 PolarHBondContact O-N 3.5Å; S30-I33 PolarHBondContact O-N 2.96Å; I33-A36 PolarHBondContact O-N 3.46Å; I33-I37 HydrophobicContact CG2-CD1 4.2Å; I33-I37 WeakPolarHBondContact O-CG1 3.3Å; I33-I37 PolarHBondContact O-N 2.72Å; I33-I37 VanDerWaalsContact O-N 3.11Å |
| 34 | V | 91.5 | Very high | 82.8 | Confident | 88 Ų | 88 | 87.9 Ų | 87.9 | 53% | 0.533 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.9 | -46.9 | 174.7 | 176 | 0 | 0 | 0 | 0 | 110.9 | S30 A32 A36 I37 V38 | S30-V34 WeakPolarHBondContact O-CG2 3.04Å; S30-V34 PolarHBondContact O-N 3.46Å; S30-V34 VanDerWaalsContact O-N 3.12Å; A32-V34 VanDerWaalsContact C-N 3.34Å; V34-A36 PolarHBondContact O-N 2.75Å; V34-I37 PolarHBondContact O-N 3.46Å; V34-V38 HydrophobicContact CG1-CG2 4.13Å; V34-V38 VanDerWaalsContact O-CG2 3.22Å; V34-V38 WeakPolarHBondContact O-CG2 3.48Å; V34-V38 PolarHBondContact O-N 3.36Å |
| 35 | A | 91.9 | Very high | 84.8 | Confident | 49 Ų | 49 | 87.3 Ų | 87.3 | 41% | 0.405 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.9 | -42.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | G31 A32 I37 V38 V39 | G31-A35 WeakPolarHBondContact O-CB 3.5Å; G31-A35 PolarHBondContact O-N 3.42Å; A32-A35 PolarHBondContact O-N 3.43Å; A35-I37 VanDerWaalsContact C-N 3.34Å; A35-I37 PolarHBondContact O-N 2.8Å; A35-V38 PolarHBondContact O-N 3.36Å; A35-V39 WeakPolarHBondContact O-CB 3.43Å; A35-V39 VanDerWaalsContact O-CG2 3.25Å; A35-V39 WeakPolarHBondContact O-CG2 3.29Å; A35-V39 PolarHBondContact O-N 3.35Å |
| 36 | A | 90.6 | Very high | 86.6 | Confident | 66 Ų | 66 | 87.6 Ų | 87.6 | 55% | 0.545 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.3 | -43.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | A32 I33 V34 G40 | A32-A36 VanDerWaalsContact O-CB 3.32Å; A32-A36 WeakPolarHBondContact O-CB 3.13Å; A32-A36 PolarHBondContact O-N 2.76Å; I33-A36 PolarHBondContact O-N 3.46Å; V34-A36 PolarHBondContact O-N 2.75Å; A36-G40 PolarHBondContact O-N 3.34Å |
| 37 | I | 94 | Very high | 88.4 | Confident | 107 Ų | 107 | 86.6 Ų | 86.6 | 55% | 0.549 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.6 | -51.9 | 175.4 | -65.7 | 166.6 | 0 | 0 | 0 | 109.8 | I33 V34 A35 V39 G40 V41 | I33-I37 HydrophobicContact CG2-CD1 4.2Å; I33-I37 WeakPolarHBondContact O-CG1 3.3Å; I33-I37 PolarHBondContact O-N 2.72Å; I33-I37 VanDerWaalsContact O-N 3.11Å; V34-I37 PolarHBondContact O-N 3.46Å; A35-I37 VanDerWaalsContact C-N 3.34Å; A35-I37 PolarHBondContact O-N 2.8Å; I37-V39 VanDerWaalsContact C-N 3.34Å; I37-V39 PolarHBondContact O-N 2.68Å; I37-G40 CarbonylContact O-C 3.59Å; I37-G40 WeakPolarHBondContact O-CA 3.5Å; I37-G40 PolarHBondContact O-N 3.2Å; I37-V41 HydrophobicContact CG2-CG2 4.16Å; I37-V41 WeakPolarHBondContact O-CG2 3.48Å; I37-V41 PolarHBondContact O-N 2.82Å |
| 38 | V | 96.4 | Very high | 90.3 | Very high | 73 Ų | 73 | 81 Ų | 81 | 44% | 0.442 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -55.8 | -47.8 | -179.1 | 172.2 | 0 | 0 | 0 | 0 | 111.2 | V34 A35 G40 V41 I42 | V34-V38 HydrophobicContact CG1-CG2 4.13Å; V34-V38 VanDerWaalsContact O-CG2 3.22Å; V34-V38 WeakPolarHBondContact O-CG2 3.48Å; V34-V38 PolarHBondContact O-N 3.36Å; A35-V38 PolarHBondContact O-N 3.36Å; V38-G40 VanDerWaalsContact C-N 3.33Å; V38-G40 PolarHBondContact O-N 3.48Å; V38-V41 PolarHBondContact O-N 3.22Å; V38-I42 HydrophobicContact CG1-CD1 3.81Å; V38-I42 VanDerWaalsContact O-CG1 3.24Å; V38-I42 WeakPolarHBondContact O-CG1 3.31Å; V38-I42 PolarHBondContact O-N 2.89Å |
| 39 | V | 96.6 | Very high | 91.8 | Very high | 83 Ų | 83 | 76.7 Ų | 76.7 | 50% | 0.503 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -61 | -43.7 | 175.8 | 172.8 | 0 | 0 | 0 | 0 | 110.7 | A35 I37 V41 I42 I43 | A35-V39 WeakPolarHBondContact O-CB 3.43Å; A35-V39 VanDerWaalsContact O-CG2 3.25Å; A35-V39 WeakPolarHBondContact O-CG2 3.29Å; A35-V39 PolarHBondContact O-N 3.35Å; I37-V39 VanDerWaalsContact C-N 3.34Å; I37-V39 PolarHBondContact O-N 2.68Å; V39-V41 PolarHBondContact O-N 2.69Å; V39-I42 PolarHBondContact O-N 2.96Å; V39-I43 HydrophobicContact CG1-CG1 4.25Å; V39-I43 VanDerWaalsContact O-CG1 3.26Å; V39-I43 WeakPolarHBondContact O-CG1 3.2Å; V39-I43 PolarHBondContact O-N 2.81Å |
| 40 | G | 97.2 | Very high | 93.1 | Very high | 30 Ų | 30 | 79.6 Ų | 79.6 | 31% | 0.309 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -56.3 | -48.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A36 I37 V38 I42 I43 I44 | A36-G40 PolarHBondContact O-N 3.34Å; I37-G40 CarbonylContact O-C 3.59Å; I37-G40 WeakPolarHBondContact O-CA 3.5Å; I37-G40 PolarHBondContact O-N 3.2Å; V38-G40 VanDerWaalsContact C-N 3.33Å; V38-G40 PolarHBondContact O-N 3.48Å; G40-I42 PolarHBondContact O-N 3.38Å; G40-I43 PolarHBondContact O-N 3.42Å; G40-I44 VanDerWaalsContact O-CG1 3.31Å; G40-I44 WeakPolarHBondContact O-CG1 3.1Å; G40-I44 PolarHBondContact O-N 3.16Å |
| 41 | V | 97.9 | Very high | 93.9 | Very high | 89 Ų | 89 | 81.8 Ų | 81.8 | 54% | 0.539 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.6 | -39.5 | 178.6 | -159.7 | 0 | 0 | 0 | 0 | 111.2 | I37 V38 V39 I44 F45 | I37-V41 HydrophobicContact CG2-CG2 4.16Å; I37-V41 WeakPolarHBondContact O-CG2 3.48Å; I37-V41 PolarHBondContact O-N 2.82Å; V38-V41 PolarHBondContact O-N 3.22Å; V39-V41 PolarHBondContact O-N 2.69Å; V41-I44 PolarHBondContact O-N 2.89Å; V41-F45 WeakPolarHBondContact O-CB 3.28Å; V41-F45 PolarHBondContact O-N 3.41Å |
| 42 | I | 97.3 | Very high | 94.2 | Very high | 93 Ų | 93 | 84.5 Ų | 84.5 | 48% | 0.477 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.1 | -47.6 | 175.9 | -69.3 | 166.6 | 0 | 0 | 0 | 110.5 | V38 V39 G40 F45 T46 | V38-I42 HydrophobicContact CG1-CD1 3.81Å; V38-I42 VanDerWaalsContact O-CG1 3.24Å; V38-I42 WeakPolarHBondContact O-CG1 3.31Å; V38-I42 PolarHBondContact O-N 2.89Å; V39-I42 PolarHBondContact O-N 2.96Å; G40-I42 PolarHBondContact O-N 3.38Å; I42-F45 PolarHBondContact O-N 2.81Å; I42-T46 HydrophobicContact CG2-CG2 4.19Å; I42-T46 WeakPolarHBondContact O-CG2 3.31Å; I42-T46 PolarHBondContact O-N 3.46Å |
| 43 | I | 97.2 | Very high | 94.4 | Very high | 98 Ų | 98 | 88.9 Ų | 88.9 | 50% | 0.503 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.3 | -49.8 | 178.7 | -66.1 | -73 | 0 | 0 | 0 | 110.1 | V39 G40 F45 T46 V47 | V39-I43 HydrophobicContact CG1-CG1 4.25Å; V39-I43 VanDerWaalsContact O-CG1 3.26Å; V39-I43 WeakPolarHBondContact O-CG1 3.2Å; V39-I43 PolarHBondContact O-N 2.81Å; G40-I43 PolarHBondContact O-N 3.42Å; I43-F45 VanDerWaalsContact C-N 3.31Å; I43-F45 PolarHBondContact O-N 2.85Å; I43-T46 PolarHBondContact O-N 3.35Å; I43-T46 VanDerWaalsContact O-N 3.16Å; I43-T46 PolarHBondContact O-OG1 3.43Å; I43-V47 WeakPolarHBondContact O-CG2 3.24Å; I43-V47 PolarHBondContact O-N 2.96Å |
| 44 | I | 97.2 | Very high | 94.2 | Very high | 111 Ų | 111 | 87.8 Ų | 87.8 | 57% | 0.569 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -58.5 | -46.2 | 177.7 | -66.9 | 167.9 | 0 | 0 | 0 | 110.4 | G40 V41 T46 V47 V48 | G40-I44 VanDerWaalsContact O-CG1 3.31Å; G40-I44 WeakPolarHBondContact O-CG1 3.1Å; G40-I44 PolarHBondContact O-N 3.16Å; V41-I44 PolarHBondContact O-N 2.89Å; I44-T46 VanDerWaalsContact C-N 3.33Å; I44-T46 PolarHBondContact O-N 3.26Å; I44-V47 PolarHBondContact O-N 3.28Å; I44-V48 HydrophobicContact CG2-CG2 4.21Å; I44-V48 WeakPolarHBondContact O-CB 3.25Å; I44-V48 VanDerWaalsContact O-CG2 3.29Å; I44-V48 WeakPolarHBondContact O-CG2 3.43Å; I44-V48 PolarHBondContact O-N 2.87Å |
| 45 | F | 97.6 | Very high | 93.9 | Very high | 127 Ų | 127 | 90.6 Ų | 90.6 | 56% | 0.557 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.9 | -41.8 | 177.9 | -172.4 | -107.8 | 0 | 0 | 0 | 111.7 | V41 I42 I43 V47 V48 L49 | V41-F45 WeakPolarHBondContact O-CB 3.28Å; V41-F45 PolarHBondContact O-N 3.41Å; I42-F45 PolarHBondContact O-N 2.81Å; I43-F45 VanDerWaalsContact C-N 3.31Å; I43-F45 PolarHBondContact O-N 2.85Å; F45-V47 PolarHBondContact O-N 2.82Å; F45-V48 PolarHBondContact O-N 3.49Å; F45-L49 HydrophobicContact CD1-CD1 3.69Å; F45-L49 HydrophobicContact CD1-CG 4.11Å; F45-L49 HydrophobicContact CE1-CD1 3.21Å; F45-L49 HydrophobicContact CE1-CG 3.86Å; F45-L49 HydrophobicContact CE2-CD1 4.45Å; F45-L49 HydrophobicContact CE2-CD2 4.41Å; F45-L49 HydrophobicContact CE2-CG 4.27Å; F45-L49 HydrophobicContact CG-CD1 4.5Å; F45-L49 HydrophobicContact CG-CG 4.45Å; F45-L49 HydrophobicContact CZ-CD1 3.65Å; F45-L49 HydrophobicContact CZ-CD2 4.14Å; F45-L49 HydrophobicContact CZ-CG 3.93Å; F45-L49 VanDerWaalsContact O-CB 3.28Å; F45-L49 WeakPolarHBondContact O-CB 3.19Å; F45-L49 VanDerWaalsContact O-CG 3.31Å; F45-L49 WeakPolarHBondContact O-CG 3.26Å; F45-L49 PolarHBondContact O-N 2.98Å |
| 46 | T | 96.3 | Very high | 93.4 | Very high | 69 Ų | 69 | 93.3 Ų | 93.3 | 42% | 0.423 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.3 | -40.7 | 175.8 | 68.3 | 0 | 0 | 0 | 0 | 112.1 | I42 I43 I44 L50 | I42-T46 HydrophobicContact CG2-CG2 4.19Å; I42-T46 WeakPolarHBondContact O-CG2 3.31Å; I42-T46 PolarHBondContact O-N 3.46Å; I43-T46 PolarHBondContact O-N 3.35Å; I43-T46 VanDerWaalsContact O-N 3.16Å; I43-T46 PolarHBondContact O-OG1 3.43Å; I44-T46 VanDerWaalsContact C-N 3.33Å; I44-T46 PolarHBondContact O-N 3.26Å; T46-L50 WeakPolarHBondContact O-CA 3.29Å; T46-L50 WeakPolarHBondContact O-CB 3.47Å; T46-L50 PolarHBondContact O-N 3.37Å |
| 47 | V | 96.7 | Very high | 92.5 | Very high | 69 Ų | 69 | 98.8 Ų | 98.8 | 42% | 0.418 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -68 | -45.1 | 177.7 | 173.4 | 0 | 0 | 0 | 0 | 110.5 | I43 I44 F45 L50 I51 | I43-V47 WeakPolarHBondContact O-CG2 3.24Å; I43-V47 PolarHBondContact O-N 2.96Å; I44-V47 PolarHBondContact O-N 3.28Å; F45-V47 PolarHBondContact O-N 2.82Å; V47-L50 PolarHBondContact O-N 3.34Å; V47-I51 HydrophobicContact CG1-CD1 3.8Å; V47-I51 HydrophobicContact CG1-CG1 4.42Å; V47-I51 WeakPolarHBondContact O-CB 3.32Å; V47-I51 VanDerWaalsContact O-CG1 3.29Å; V47-I51 WeakPolarHBondContact O-CG1 3.19Å; V47-I51 PolarHBondContact O-N 2.79Å |
| 48 | V | 96.3 | Very high | 91.3 | Very high | 80 Ų | 80 | 101.2 Ų | 101.2 | 49% | 0.485 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.4 | -47.3 | 176.5 | 171.4 | 0 | 0 | 0 | 0 | 110.6 | I44 F45 L50 I51 L52 | I44-V48 HydrophobicContact CG2-CG2 4.21Å; I44-V48 WeakPolarHBondContact O-CB 3.25Å; I44-V48 VanDerWaalsContact O-CG2 3.29Å; I44-V48 WeakPolarHBondContact O-CG2 3.43Å; I44-V48 PolarHBondContact O-N 2.87Å; F45-V48 PolarHBondContact O-N 3.49Å; V48-L50 VanDerWaalsContact C-N 3.32Å; V48-L50 PolarHBondContact O-N 3.47Å; V48-I51 PolarHBondContact O-N 3.11Å; V48-L52 WeakPolarHBondContact O-CB 3.4Å; V48-L52 PolarHBondContact O-N 3.23Å |
| 49 | L | 94.3 | Very high | 89.5 | Confident | 78 Ų | 78 | 101.9 Ų | 101.9 | 41% | 0.408 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.5 | -38.5 | 174.9 | -75.7 | -171.1 | 0 | 0 | 0 | 111.8 | F45 L52 K53 | F45-L49 HydrophobicContact CD1-CD1 3.69Å; F45-L49 HydrophobicContact CD1-CG 4.11Å; F45-L49 HydrophobicContact CE1-CD1 3.21Å; F45-L49 HydrophobicContact CE1-CG 3.86Å; F45-L49 HydrophobicContact CE2-CD1 4.45Å; F45-L49 HydrophobicContact CE2-CD2 4.41Å; F45-L49 HydrophobicContact CE2-CG 4.27Å; F45-L49 HydrophobicContact CG-CD1 4.5Å; F45-L49 HydrophobicContact CG-CG 4.45Å; F45-L49 HydrophobicContact CZ-CD1 3.65Å; F45-L49 HydrophobicContact CZ-CD2 4.14Å; F45-L49 HydrophobicContact CZ-CG 3.93Å; F45-L49 VanDerWaalsContact O-CB 3.28Å; F45-L49 WeakPolarHBondContact O-CB 3.19Å; F45-L49 VanDerWaalsContact O-CG 3.31Å; F45-L49 WeakPolarHBondContact O-CG 3.26Å; F45-L49 PolarHBondContact O-N 2.98Å; L49-L52 PolarHBondContact O-N 2.95Å; L49-K53 WeakPolarHBondContact O-CA 3.22Å; L49-K53 WeakPolarHBondContact O-CB 2.97Å; L49-K53 PolarHBondContact O-N 3.41Å |
| 50 | L | 93.9 | Very high | 87.6 | Confident | 105 Ų | 105 | 107.5 Ų | 107.5 | 55% | 0.55 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.6 | -45.5 | 177.2 | 179.8 | 65.6 | 0 | 0 | 0 | 110.5 | T46 V47 V48 T54 | T46-L50 WeakPolarHBondContact O-CA 3.29Å; T46-L50 WeakPolarHBondContact O-CB 3.47Å; T46-L50 PolarHBondContact O-N 3.37Å; V47-L50 PolarHBondContact O-N 3.34Å; V48-L50 VanDerWaalsContact C-N 3.32Å; V48-L50 PolarHBondContact O-N 3.47Å; L50-T54 WeakPolarHBondContact O-CA 3.24Å; L50-T54 WeakPolarHBondContact O-CB 3.31Å; L50-T54 PolarHBondContact O-N 2.83Å; L50-T54 PolarHBondContact O-OG1 3.31Å |
| 51 | I | 92 | Very high | 85.5 | Confident | 110 Ų | 110 | 109.9 Ų | 109.9 | 56% | 0.564 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65.6 | -44.7 | 176.8 | -66.6 | 167.2 | 0 | 0 | 0 | 109.8 | V47 V48 T54 Y55 | V47-I51 HydrophobicContact CG1-CD1 3.8Å; V47-I51 HydrophobicContact CG1-CG1 4.42Å; V47-I51 WeakPolarHBondContact O-CB 3.32Å; V47-I51 VanDerWaalsContact O-CG1 3.29Å; V47-I51 WeakPolarHBondContact O-CG1 3.19Å; V47-I51 PolarHBondContact O-N 2.79Å; V48-I51 PolarHBondContact O-N 3.11Å; I51-T54 CarbonylContact O-C 3.57Å; I51-T54 PolarHBondContact O-N 3.33Å; I51-Y55 WeakPolarHBondContact O-CA 3.37Å; I51-Y55 WeakPolarHBondContact O-CB 3.33Å; I51-Y55 PolarHBondContact O-N 3.03Å |
| 52 | L | 90.1 | Very high | 83.3 | Confident | 104 Ų | 104 | 111 Ų | 111 | 55% | 0.545 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.6 | -45.6 | 179.4 | -174.6 | 61.1 | 0 | 0 | 0 | 111.7 | V48 L49 T54 Y55 N56 | V48-L52 WeakPolarHBondContact O-CB 3.4Å; V48-L52 PolarHBondContact O-N 3.23Å; L49-L52 PolarHBondContact O-N 2.95Å; L52-T54 VanDerWaalsContact C-N 3.35Å; L52-Y55 PolarHBondContact O-N 3.47Å; L52-N56 VanDerWaalsContact O-CB 3.3Å; L52-N56 WeakPolarHBondContact O-CB 3.18Å; L52-N56 PolarHBondContact O-N 2.76Å |
| 53 | K | 88.4 | Confident | 81.3 | Confident | 148 Ų | 148 | 117 Ų | 117 | 64% | 0.643 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -62.1 | -43.1 | 174 | 179.6 | 178.2 | 175.6 | 175.8 | 0 | 110.7 | L49 R57 | L49-K53 WeakPolarHBondContact O-CA 3.22Å; L49-K53 WeakPolarHBondContact O-CB 2.97Å; L49-K53 PolarHBondContact O-N 3.41Å; K53-R57 WeakPolarHBondContact O-CB 3.44Å; K53-R57 PolarHBondContact O-N 3.42Å |
| 54 | T | 84.6 | Confident | 79.1 | Confident | 67 Ų | 67 | 119.6 Ų | 119.6 | 41% | 0.411 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -71.1 | -36.2 | 178.1 | -60.2 | 0 | 0 | 0 | 0 | 111 | L50 I51 L52 R57 R58 | L50-T54 WeakPolarHBondContact O-CA 3.24Å; L50-T54 WeakPolarHBondContact O-CB 3.31Å; L50-T54 PolarHBondContact O-N 2.83Å; L50-T54 PolarHBondContact O-OG1 3.31Å; I51-T54 CarbonylContact O-C 3.57Å; I51-T54 PolarHBondContact O-N 3.33Å; L52-T54 VanDerWaalsContact C-N 3.35Å; T54-R57 PolarHBondContact O-N 2.89Å; T54-R58 WeakPolarHBondContact O-CA 3.23Å; T54-R58 WeakPolarHBondContact O-CB 3.29Å; T54-R58 PolarHBondContact O-N 3.44Å |
| 55 | Y | 84.8 | Confident | 76.8 | Confident | 147 Ų | 147 | 120.3 Ų | 120.3 | 58% | 0.576 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -65.2 | -48.8 | 176 | -177 | -99.4 | 0 | 0 | 0 | 110.2 | I51 L52 R58 M59 | I51-Y55 WeakPolarHBondContact O-CA 3.37Å; I51-Y55 WeakPolarHBondContact O-CB 3.33Å; I51-Y55 PolarHBondContact O-N 3.03Å; L52-Y55 PolarHBondContact O-N 3.47Å; Y55-R58 PolarHBondContact O-N 2.77Å; Y55-M59 HydrophobicContact CD2-CE 4.41Å; Y55-M59 HydrophobicContact CE1-CE 4.29Å; Y55-M59 HydrophobicContact CE1-CG 4.45Å; Y55-M59 HydrophobicContact CE2-CE 3.61Å; Y55-M59 WeakPolarHBondContact O-CB 3.16Å; Y55-M59 VanDerWaalsContact O-CG 3.24Å; Y55-M59 WeakPolarHBondContact O-CG 3.06Å; Y55-M59 PolarHBondContact O-N 2.88Å; Y55-M59 WeakPolarHBondContact OH-CE 3.35Å |
| 56 | N | 82.2 | Confident | 74.6 | Confident | 106 Ų | 106 | 121.5 Ų | 121.5 | 57% | 0.567 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -60.9 | -47 | 174.5 | -167.6 | -5.2 | 0 | 0 | 0 | 111.5 | L52 R58 M59 R60 | L52-N56 VanDerWaalsContact O-CB 3.3Å; L52-N56 WeakPolarHBondContact O-CB 3.18Å; L52-N56 PolarHBondContact O-N 2.76Å; N56-R58 PolarHBondContact O-N 2.83Å; N56-M59 PolarHBondContact O-N 3.24Å; N56-R60 PolarHBondContact O-N 3.22Å |
| 57 | R | 72.1 | Confident | 72.4 | Confident | 180 Ų | 180 | 122.8 Ų | 122.8 | 68% | 0.679 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -64.2 | -41.7 | 177.2 | -173.7 | 172.5 | -177.4 | -156.8 | 0.8 | 112.4 | K53 T54 M59 R60 V61 | K53-R57 WeakPolarHBondContact O-CB 3.44Å; K53-R57 PolarHBondContact O-N 3.42Å; T54-R57 PolarHBondContact O-N 2.89Å; R57-M59 VanDerWaalsContact C-N 3.34Å; R57-M59 PolarHBondContact O-N 3.12Å; R57-R60 PolarHBondContact O-N 3.38Å; R57-R60 VanDerWaalsContact O-N 3.15Å; R57-V61 WeakPolarHBondContact O-CG2 3.41Å; R57-V61 PolarHBondContact O-N 2.98Å; R57-V61 VanDerWaalsContact O-N 3.16Å |
| 58 | R | 67.7 | Low | 70 | Confident | 159 Ų | 159 | 126.5 Ų | 126.5 | 60% | 0.6 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -69.3 | -34.1 | -178.5 | -170.7 | 176.5 | -170.6 | -141.4 | 4.6 | 110.8 | T54 Y55 N56 R60 V61 K62 | T54-R58 WeakPolarHBondContact O-CA 3.23Å; T54-R58 WeakPolarHBondContact O-CB 3.29Å; T54-R58 PolarHBondContact O-N 3.44Å; Y55-R58 PolarHBondContact O-N 2.77Å; N56-R58 PolarHBondContact O-N 2.83Å; R58-R60 VanDerWaalsContact C-N 3.28Å; R58-R60 PolarHBondContact O-N 3.41Å; R58-V61 PolarHBondContact O-N 3.42Å; R58-K62 HydrophobicContact CG-CG 4.43Å; R58-K62 WeakPolarHBondContact O-CG 3.11Å; R58-K62 PolarHBondContact O-N 3.37Å |
| 59 | M | 59.7 | Low | 67.5 | Low | 87 Ų | 87 | 128.1 Ų | 128.1 | 43% | 0.429 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -63.7 | -31.6 | 171.9 | -72.7 | -67 | 171.1 | 0 | 0 | 112.6 | Y55 N56 R57 | Y55-M59 HydrophobicContact CD2-CE 4.41Å; Y55-M59 HydrophobicContact CE1-CE 4.29Å; Y55-M59 HydrophobicContact CE1-CG 4.45Å; Y55-M59 HydrophobicContact CE2-CE 3.61Å; Y55-M59 WeakPolarHBondContact O-CB 3.16Å; Y55-M59 VanDerWaalsContact O-CG 3.24Å; Y55-M59 WeakPolarHBondContact O-CG 3.06Å; Y55-M59 PolarHBondContact O-N 2.88Å; Y55-M59 WeakPolarHBondContact OH-CE 3.35Å; N56-M59 PolarHBondContact O-N 3.24Å; R57-M59 VanDerWaalsContact C-N 3.34Å; R57-M59 PolarHBondContact O-N 3.12Å |
| 60 | R | 56.9 | Low | 65.2 | Low | 200 Ų | 200 | 129.2 Ų | 129.2 | 76% | 0.755 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -73.9 | -30.7 | 171.6 | -67.3 | -151.7 | 174.3 | -145.3 | 0.3 | 113.8 | N56 R57 R58 | N56-R60 PolarHBondContact O-N 3.22Å; R57-R60 PolarHBondContact O-N 3.38Å; R57-R60 VanDerWaalsContact O-N 3.15Å; R58-R60 VanDerWaalsContact C-N 3.28Å; R58-R60 PolarHBondContact O-N 3.41Å |
| 61 | V | 51.7 | Low | 62.7 | Low | 80 Ų | 80 | 134 Ų | 134 | 49% | 0.485 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -79.7 | -23.7 | 174.7 | -177.8 | 0 | 0 | 0 | 0 | 111.9 | R57 R58 R63 E64 L65 | R57-V61 WeakPolarHBondContact O-CG2 3.41Å; R57-V61 PolarHBondContact O-N 2.98Å; R57-V61 VanDerWaalsContact O-N 3.16Å; R58-V61 PolarHBondContact O-N 3.42Å; V61-R63 PolarHBondContact O-N 2.91Å; V61-E64 PolarHBondContact O-N 2.85Å; V61-E64 VanDerWaalsContact O-N 3.14Å; V61-L65 PolarHBondContact O-N 3.46Å |
| 62 | K | 51.8 | Low | 60.3 | Low | 113 Ų | 113 | 134.3 Ų | 134.3 | 49% | 0.491 | 64% | 0.637 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69.7 | -18.4 | 173.5 | -64.3 | -126.4 | -178.3 | -175.9 | 0 | 113.6 | R58 E64 | R58-K62 HydrophobicContact CG-CG 4.43Å; R58-K62 WeakPolarHBondContact O-CG 3.11Å; R58-K62 PolarHBondContact O-N 3.37Å; K62-E64 PolarHBondContact O-N 2.77Å |
| 63 | R | 56.4 | Low | 58.3 | Low | 219 Ų | 219 | 135 Ų | 135 | 83% | 0.826 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.1 | 0.8 | 171.4 | -71.9 | 176.9 | 84.5 | 132.5 | -2.2 | 113.3 | V61 | V61-R63 PolarHBondContact O-N 2.91Š|
| 64 | E | 51.5 | Low | 56.3 | Low | 152 Ų | 152 | 135.3 Ų | 135.3 | 71% | 0.71 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -127.7 | 1.2 | 176.2 | -62.9 | -69.7 | 149.6 | 0 | 0 | 112.6 | V61 K62 E66 | V61-E64 PolarHBondContact O-N 2.85Å; V61-E64 VanDerWaalsContact O-N 3.14Å; K62-E64 PolarHBondContact O-N 2.77Å; E64-E66 PolarHBondContact O-N 3.2Å |
| 65 | L | 49.2 | Very low | 54.4 | Low | 127 Ų | 127 | 137.9 Ų | 137.9 | 67% | 0.665 | 67% | 0.674 | S | S | * | * | trans | -85.4 | 32.6 | 162.9 | -71.5 | -179.2 | 0 | 0 | 0 | 112.2 | V61 | V61-L65 PolarHBondContact O-N 3.46Š| ||
| 66 | E | 49.5 | Very low | 52.5 | Low | 152 Ų | 152 | 136.6 Ų | 136.6 | 71% | 0.71 | 68% | 0.684 | S | S | * | * | trans | -75.6 | 81.6 | 135.8 | -92.5 | -76 | 134.9 | 0 | 0 | 107.1 | E64 | E64-E66 PolarHBondContact O-N 3.2Š| ||
| 67 | P | 50.2 | Low | 50.7 | Low | 96 Ų | 96 | 135.8 Ų | 135.8 | 62% | 0.623 | 69% | 0.692 | S | S | * | * | -120.1 | 63.6 | 126.9 | 34.2 | -31.6 | 0 | 0 | 0 | 107.5 | |||||
| 68 | K | 46.4 | Very low | 49.8 | Very low | 147 Ų | 147 | 135.9 Ų | 135.9 | 64% | 0.639 | 71% | 0.705 | S | S | * | * | trans | -106.3 | 75.9 | 149.6 | -140 | -179.1 | 179.9 | 176.4 | 0 | 107.5 | T70 | K68-T70 WeakPolarHBondContact CG-OG1 3.44Å; K68-T70 PolarHBondContact O-N 3.45Å; K68-T70 PolarHBondContact O-OG1 2.93Å | ||
| 69 | S | 45.4 | Very low | 48.8 | Very low | 114 Ų | 114 | 131.3 Ų | 131.3 | 80% | 0.797 | 71% | 0.707 | S | S | * | * | trans | -46.5 | 79.5 | 146.2 | 56.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 70 | T | 44.1 | Very low | 48 | Very low | 101 Ų | 101 | 136.4 Ų | 136.4 | 62% | 0.62 | 73% | 0.73 | S | S | * | * | trans | -135.3 | 55.7 | 163.2 | 27.3 | 0 | 0 | 0 | 0 | 106.6 | K68 | K68-T70 WeakPolarHBondContact CG-OG1 3.44Å; K68-T70 PolarHBondContact O-N 3.45Å; K68-T70 PolarHBondContact O-OG1 2.93Å | ||
| 71 | K | 41.4 | Very low | 47.1 | Very low | 205 Ų | 205 | 133.5 Ų | 133.5 | 89% | 0.891 | 73% | 0.73 | S | S | * | * | trans | -103.3 | 89.3 | 145.6 | -155.8 | 169.7 | -175 | 177.4 | 0 | 106 | T73 | K71-T73 PolarHBondContact O-N 3.23Š| ||
| 72 | T | 42.2 | Very low | 46.6 | Very low | 116 Ų | 116 | 134.4 Ų | 134.4 | 71% | 0.712 | 74% | 0.739 | S | S | * | * | trans | -7 | 120.9 | 145.7 | -55.2 | 0 | 0 | 0 | 0 | 111.7 | L74 | T72-L74 PolarHBondContact O-N 3.06Š| ||
| 73 | T | 48.2 | Very low | 46 | Very low | 118 Ų | 118 | 135.9 Ų | 135.9 | 72% | 0.724 | 75% | 0.753 | S | S | * | * | S | Bend | trans | 12.4 | 106.7 | 139.9 | -49.4 | 0 | 0 | 0 | 0 | 113.1 | K71 | K71-T73 PolarHBondContact O-N 3.23Š|
| 74 | L | 47 | Very low | 45.2 | Very low | 155 Ų | 155 | 130.6 Ų | 130.6 | 81% | 0.812 | 75% | 0.749 | S | S | * | * | trans | 163 | 103.8 | 133.7 | -82.1 | 174.4 | 0 | 0 | 0 | 107.2 | T72 P76 | T72-L74 PolarHBondContact O-N 3.06Å; L74-P76 VanDerWaalsContact O-CD 3.29Å; L74-P76 WeakPolarHBondContact O-CD 3.17Å | ||
| 75 | S | 44.7 | Very low | 44.8 | Very low | 121 Ų | 121 | 130 Ų | 130 | 85% | 0.846 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 126 | 167.9 | -158.7 | 0 | 0 | 0 | 0 | 109.9 | ||
| 76 | P | 44.1 | Very low | 44.6 | Very low | 121 Ų | 121 | 130.4 Ų | 130.4 | 79% | 0.786 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -98.4 | 121.2 | 154.9 | 6.3 | 15 | 0 | 0 | 0 | 107.6 | L74 | L74-P76 VanDerWaalsContact O-CD 3.29Å; L74-P76 WeakPolarHBondContact O-CD 3.17Å |
| 77 | A | 45 | Very low | 44.5 | Very low | 89 Ų | 89 | 131.6 Ų | 131.6 | 74% | 0.736 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 139.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | G79 | A77-G79 PolarHBondContact O-N 2.88Š|
| 78 | L | 53.8 | Low | 44.2 | Very low | 182 Ų | 182 | 134.9 Ų | 134.9 | 95% | 0.953 | 77% | 0.77 | S | S | * | * | S | Bend | trans | 0.6 | 111.1 | 145.1 | -168.3 | 69.9 | 0 | 0 | 0 | 115.5 | ||
| 79 | G | 46.8 | Very low | 44.4 | Very low | 62 Ų | 62 | 134 Ų | 134 | 64% | 0.639 | 78% | 0.779 | S | S | * | * | trans | 158.8 | 131 | 162.1 | 0 | 0 | 0 | 0 | 0 | 115.8 | A77 | A77-G79 PolarHBondContact O-N 2.88Š| ||
| 80 | Q | 42.1 | Very low | 44.4 | Very low | 194 Ų | 194 | 134.6 Ų | 134.6 | 91% | 0.907 | 78% | 0.778 | S | S | * | * | trans | 81.5 | 99.7 | 153.9 | -60.4 | 176.6 | -46.3 | 0 | 0 | 116.5 | ||||
| 81 | N | 38.3 | Very low | 44.6 | Very low | 140 Ų | 140 | 135.2 Ų | 135.2 | 75% | 0.749 | 78% | 0.781 | S | S | * | * | 71.9 | 102.4 | 84.9 | -173.8 | -3.3 | 0 | 0 | 0 | 112.3 | |||||
| 82 | S | 40.3 | Very low | 45.3 | Very low | 99 Ų | 99 | 130.5 Ų | 130.5 | 69% | 0.692 | 77% | 0.77 | S | S | * | * | 178.6 | 122.8 | 123.5 | 31.1 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 83 | N | 40.2 | Very low | 45.8 | Very low | 144 Ų | 144 | 134 Ų | 134 | 77% | 0.77 | 78% | 0.776 | S | S | * | * | trans | 59.7 | 100.1 | 133.9 | -54.1 | -19.1 | 0 | 0 | 0 | 120.4 | ||||
| 84 | S | 39.3 | Very low | 46.3 | Very low | 107 Ų | 107 | 135.1 Ų | 135.1 | 75% | 0.748 | 78% | 0.776 | S | S | * | * | 159.6 | 83.4 | 129.5 | 47.8 | 0 | 0 | 0 | 0 | 109.6 | T86 | S84-T86 PolarHBondContact O-N 3.28Š| |||
| 85 | I | 43.7 | Very low | 46.8 | Very low | 141 Ų | 141 | 132.8 Ų | 132.8 | 72% | 0.723 | 77% | 0.77 | S | S | * | * | 49 | 74.4 | 102.1 | -52.9 | 171.4 | 0 | 0 | 0 | 111.8 | Q87 | I85-Q87 HydrophobicContact CG2-CG 4.06Š| |||
| 86 | T | 43.8 | Very low | 47.4 | Very low | 134 Ų | 134 | 132.2 Ų | 132.2 | 82% | 0.822 | 76% | 0.761 | S | S | * | * | trans | -99 | 92 | 140.8 | 32.8 | 0 | 0 | 0 | 0 | 106.1 | S84 Q88 | S84-T86 PolarHBondContact O-N 3.28Å; T86-Q88 PolarHBondContact O-N 3.16Å | ||
| 87 | Q | 46.8 | Very low | 48 | Very low | 177 Ų | 177 | 133.6 Ų | 133.6 | 83% | 0.827 | 76% | 0.762 | S | S | * | * | trans | -61.7 | 105.3 | 170.4 | -96.6 | 162.3 | -2.3 | 0 | 0 | 108.6 | I85 | I85-Q87 HydrophobicContact CG2-CG 4.06Š| ||
| 88 | Q | 44.6 | Very low | 48.7 | Very low | 165 Ų | 165 | 136 Ų | 136 | 77% | 0.771 | 76% | 0.761 | S | S | * | * | trans | -83.8 | 131 | 156.1 | -67.1 | -170.5 | -18 | 0 | 0 | 107.6 | T86 T90 | T86-Q88 PolarHBondContact O-N 3.16Å; Q88-T90 PolarHBondContact O-N 2.87Å; Q88-T90 VanDerWaalsContact O-N 3.12Å | ||
| 89 | P | 50.2 | Low | 48.7 | Very low | 129 Ų | 129 | 134.4 Ų | 134.4 | 84% | 0.838 | 75% | 0.748 | S | S | * | * | trans | -81.6 | 96.7 | -179.9 | 32.5 | -28 | 0 | 0 | 0 | 107.4 | ||||
| 90 | T | 45.2 | Very low | 49.2 | Very low | 127 Ų | 127 | 139.2 Ų | 139.2 | 78% | 0.779 | 76% | 0.756 | S | S | * | * | trans | -115.8 | 116 | 167.7 | -59.7 | 0 | 0 | 0 | 0 | 108.9 | Q88 | Q88-T90 PolarHBondContact O-N 2.87Å; Q88-T90 VanDerWaalsContact O-N 3.12Å | ||
| 91 | V | 49.1 | Very low | 49.4 | Very low | 113 Ų | 113 | 137.3 Ų | 137.3 | 69% | 0.685 | 75% | 0.747 | S | S | * | * | trans | -58.5 | 135 | -169 | 170.7 | 0 | 0 | 0 | 0 | 111.7 | F93 | V91-F93 PolarHBondContact O-N 3Š| ||
| 92 | T | 56.6 | Low | 49.9 | Very low | 107 Ų | 107 | 137.1 Ų | 137.1 | 66% | 0.656 | 75% | 0.746 | S | S | * | * | trans | -21.9 | 114.5 | 160 | -51.4 | 0 | 0 | 0 | 0 | 114.6 | I94 | T92-I94 HydrophobicContact CG2-CG1 4.38Š| ||
| 93 | F | 52.9 | Low | 50.1 | Low | 189 Ų | 189 | 146.8 Ų | 146.8 | 83% | 0.829 | 77% | 0.768 | S | S | * | * | trans | -136.3 | 108 | 141.6 | -76.8 | -80.9 | 0 | 0 | 0 | 107.9 | V91 P95 | V91-F93 PolarHBondContact O-N 3Å; F93-P95 WeakPolarHBondContact O-CD 3.38Å | ||
| 94 | I | 57.9 | Low | 50.6 | Low | 141 Ų | 141 | 147 Ų | 147 | 72% | 0.723 | 77% | 0.768 | S | S | * | * | trans | -78.4 | 120.1 | 166.7 | -61.3 | 165.5 | 0 | 0 | 0 | 106.2 | T92 V96 | T92-I94 HydrophobicContact CG2-CG1 4.38Å; I94-V96 HydrophobicContact CG2-CG2 4.12Å | ||
| 95 | P | 58.1 | Low | 51.2 | Low | 107 Ų | 107 | 149.1 Ų | 149.1 | 70% | 0.695 | 77% | 0.769 | S | S | * | * | trans | -96.7 | 107 | 147.2 | 29.4 | -26.9 | 0 | 0 | 0 | 108 | F93 D97 | F93-P95 WeakPolarHBondContact O-CD 3.38Å; P95-D97 PolarHBondContact O-N 2.82Å | ||
| 96 | V | 57.8 | Low | 51.6 | Low | 108 Ų | 108 | 149.5 Ų | 149.5 | 66% | 0.655 | 77% | 0.771 | S | S | * | * | trans | -58.4 | 113.5 | 150.5 | 156.8 | 0 | 0 | 0 | 0 | 105.3 | I94 I98 | I94-V96 HydrophobicContact CG2-CG2 4.12Å; V96-I98 HydrophobicContact CG1-CD1 4.27Å; V96-I98 HydrophobicContact CG1-CG1 4.29Å | ||
| 97 | D | 55 | Low | 52.1 | Low | 150 Ų | 150 | 150.4 Ų | 150.4 | 80% | 0.802 | 77% | 0.768 | S | S | * | * | trans | -133.5 | 104.1 | 156 | -104.5 | -46.8 | 0 | 0 | 0 | 109.2 | P95 H99 | P95-D97 PolarHBondContact O-N 2.82Å; D97-H99 PolarHBondContact O-N 2.91Å | ||
| 98 | I | 59.6 | Low | 52.4 | Low | 140 Ų | 140 | 148.8 Ų | 148.8 | 72% | 0.718 | 76% | 0.764 | S | S | * | * | trans | -66.9 | 103.2 | 169.4 | -66.3 | 157.6 | 0 | 0 | 0 | 105.9 | V96 M100 | V96-I98 HydrophobicContact CG1-CD1 4.27Å; V96-I98 HydrophobicContact CG1-CG1 4.29Å; I98-M100 HydrophobicContact CG2-CG 4.32Å | ||
| 99 | H | 55.1 | Low | 53 | Low | 149 Ų | 149 | 147.7 Ų | 147.7 | 69% | 0.69 | 76% | 0.764 | S | S | * | * | trans | -100.5 | 102.2 | 162.2 | -171.6 | 67.7 | 0 | 0 | 0 | 109.4 | D97 Q101 | D97-H99 PolarHBondContact O-N 2.91Å; H99-Q101 PolarHBondContact NE2-OE1 3.35Å; H99-Q101 PolarHBondContact O-N 3.17Å | ||
| 100 | M | 56.5 | Low | 53.2 | Low | 163 Ų | 163 | 149 Ų | 149 | 80% | 0.803 | 76% | 0.759 | S | S | * | * | trans | -57.7 | 122.6 | 166.8 | -65.3 | 168.2 | 64.8 | 0 | 0 | 110.3 | I98 | I98-M100 HydrophobicContact CG2-CG 4.32Š| ||
| 101 | Q | 47 | Very low | 53.8 | Low | 153 Ų | 153 | 150.7 Ų | 150.7 | 72% | 0.715 | 76% | 0.757 | S | S | * | * | trans | -159.3 | 93.3 | 154.7 | -145.8 | 148.5 | -33.4 | 0 | 0 | 109.8 | H99 | H99-Q101 PolarHBondContact NE2-OE1 3.35Å; H99-Q101 PolarHBondContact O-N 3.17Å | ||
| 102 | N | 47.4 | Very low | 54.2 | Low | 137 Ų | 137 | 153.8 Ų | 153.8 | 73% | 0.733 | 76% | 0.763 | S | S | * | * | 65.7 | 82.9 | 89 | -169.2 | 20.6 | 0 | 0 | 0 | 113 | |||||
| 103 | R | 46.2 | Very low | 53.9 | Low | 302 Ų | 302 | 158.1 Ų | 158.1 | 100% | 1.14 | 77% | 0.773 | S | S | * | * | 172.6 | 0 | 107.8 | -91.9 | -163.2 | 174.5 | -169.7 | -1 | 110.6 |
Retrieved 103 of 103 residues in 34.7 ms
(Link to these results)