| 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 | 55.5 | Low | 74.5 | Confident | 222 Ų | 222 | 127.6 Ų | 127.6 | 100% | 1.094 | 64% | 0.637 | S | S | * | * | 0 | 102.1 | 0 | -91.9 | 173.1 | 159.4 | 0 | 0 | 105.8 | I3 | M1-I3 PolarHBondContact O-N 2.69Š| |||
| 2 | D | 69.1 | Low | 75.2 | Confident | 99 Ų | 99 | 119.6 Ų | 119.6 | 53% | 0.529 | 61% | 0.605 | S | S | . | * | trans | -84.3 | 68.7 | -177.7 | -61.1 | -27.4 | 0 | 0 | 0 | 108.7 | W4 K5 | D2-W4 PolarHBondContact O-N 3.03Å; D2-K5 HydrophobicContact CB-CB 4.2Å; D2-K5 HydrophobicContact CB-CD 3.63Å; D2-K5 HydrophobicContact CB-CG 3.81Å; D2-K5 WeakPolarHBondContact O-CB 3.29Å; D2-K5 PolarHBondContact O-N 2.99Å; D2-K5 VanDerWaalsContact OD2-CE 3.29Å; D2-K5 WeakPolarHBondContact OD2-CE 3.47Å; D2-K5 IonicContact OD2-NZ 2.69Å; D2-K5 PolarHBondContact OD2-NZ 3.16Å | ||
| 3 | I | 68.8 | Low | 75.8 | Confident | 123 Ų | 123 | 118.8 Ų | 118.8 | 63% | 0.631 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.5 | -19.8 | -178.2 | 44.6 | 154.9 | 0 | 0 | 0 | 113.4 | M1 | M1-I3 PolarHBondContact O-N 2.69Š|
| 4 | W | 66.1 | Low | 76.6 | Confident | 218 Ų | 218 | 117.2 Ų | 117.2 | 83% | 0.826 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.5 | -10.6 | 179.2 | -62.7 | 10.7 | 0 | 0 | 0 | 112.9 | D2 D6 F7 | D2-W4 PolarHBondContact O-N 3.03Å; W4-D6 VanDerWaalsContact C-N 3.31Å; W4-F7 PolarHBondContact O-N 2.94Å |
| 5 | K | 71.6 | Confident | 77.2 | Confident | 158 Ų | 158 | 112.9 Ų | 112.9 | 69% | 0.687 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -24.1 | 174.6 | -77.4 | -178 | -177.7 | 163.9 | 0 | 112.7 | D2 F7 | D2-K5 HydrophobicContact CB-CB 4.2Å; D2-K5 HydrophobicContact CB-CD 3.63Å; D2-K5 HydrophobicContact CB-CG 3.81Å; D2-K5 WeakPolarHBondContact O-CB 3.29Å; D2-K5 PolarHBondContact O-N 2.99Å; D2-K5 VanDerWaalsContact OD2-CE 3.29Å; D2-K5 WeakPolarHBondContact OD2-CE 3.47Å; D2-K5 IonicContact OD2-NZ 2.69Å; D2-K5 PolarHBondContact OD2-NZ 3.16Å; K5-F7 VanDerWaalsContact C-N 3.28Å |
| 6 | D | 73.1 | Confident | 77.8 | Confident | 139 Ų | 139 | 111.3 Ų | 111.3 | 74% | 0.743 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -84.4 | -9.3 | 176.4 | -58 | -29.8 | 0 | 0 | 0 | 111.9 | W4 S8 | W4-D6 VanDerWaalsContact C-N 3.31Å; D6-S8 PolarHBondContact O-N 3.45Å; D6-S8 VanDerWaalsContact O-N 3.16Å |
| 7 | F | 74.7 | Confident | 78.1 | Confident | 114 Ų | 114 | 110.5 Ų | 110.5 | 50% | 0.5 | 58% | 0.582 | S | S | . | * | trans | -75.1 | 105.3 | 174.7 | -164.9 | -113.7 | 0 | 0 | 0 | 108.9 | W4 K5 D11 A12 | W4-F7 PolarHBondContact O-N 2.94Å; K5-F7 VanDerWaalsContact C-N 3.28Å; F7-D11 HydrophobicContact CD2-CB 3.83Å; F7-D11 HydrophobicContact CE2-CB 3.6Å; F7-D11 HydrophobicContact CG-CB 4.48Å; F7-D11 HydrophobicContact CZ-CB 4.11Å; F7-A12 HydrophobicContact CD1-CB 4.04Å; F7-A12 HydrophobicContact CE1-CB 3.26Å; F7-A12 HydrophobicContact CZ-CB 3.93Å; F7-A12 VanDerWaalsContact CZ-N 3.34Å | ||
| 8 | S | 83.7 | Confident | 78.6 | Confident | 59 Ų | 59 | 113.1 Ų | 113.1 | 41% | 0.413 | 59% | 0.588 | S | S | . | * | trans | -67.6 | 148.6 | 176.3 | -178.4 | 0 | 0 | 0 | 0 | 109.7 | D6 A10 D11 A12 | D6-S8 PolarHBondContact O-N 3.45Å; D6-S8 VanDerWaalsContact O-N 3.16Å; S8-A10 PolarHBondContact O-N 3.08Å; S8-A10 VanDerWaalsContact O-N 3.15Å; S8-A10 PolarHBondContact OG-N 3.15Å; S8-D11 VanDerWaalsContact CB-OD2 3.29Å; S8-D11 WeakPolarHBondContact CB-OD2 3.33Å; S8-D11 PolarHBondContact N-OD2 2.97Å; S8-D11 VanDerWaalsContact N-OD2 3.08Å; S8-D11 WeakPolarHBondContact O-CB 3.48Å; S8-D11 PolarHBondContact O-N 3.06Å; S8-A12 PolarHBondContact O-N 2.96Å | ||
| 9 | I | 84.7 | Confident | 78.8 | Confident | 137 Ų | 137 | 109.8 Ų | 109.8 | 70% | 0.703 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -53.3 | -33.3 | 167.1 | -65.2 | 170.7 | 0 | 0 | 0 | 109.9 | A12 I13 | I9-A12 WeakPolarHBondContact O-CB 3.39Å; I9-A12 PolarHBondContact O-N 3.04Å; I9-I13 HydrophobicContact CG2-CD1 3.93Å; I9-I13 HydrophobicContact CG2-CG1 4.5Å; I9-I13 VanDerWaalsContact O-CG1 3.28Å; I9-I13 WeakPolarHBondContact O-CG1 3.29Å; I9-I13 PolarHBondContact O-N 3.05Å |
| 10 | A | 83.5 | Confident | 78.9 | Confident | 55 Ų | 55 | 109 Ų | 109 | 46% | 0.455 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.5 | -42.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | S8 A12 I13 V14 | S8-A10 PolarHBondContact O-N 3.08Å; S8-A10 VanDerWaalsContact O-N 3.15Å; S8-A10 PolarHBondContact OG-N 3.15Å; A10-A12 VanDerWaalsContact C-N 3.28Å; A10-A12 PolarHBondContact O-N 3.28Å; A10-I13 PolarHBondContact O-N 3.19Å; A10-V14 WeakPolarHBondContact O-CG2 3.34Å; A10-V14 PolarHBondContact O-N 3.33Å |
| 11 | D | 88.3 | Confident | 78.9 | Confident | 80 Ų | 80 | 108.7 Ų | 108.7 | 43% | 0.428 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -65.6 | -35.6 | 177.5 | -57.9 | -40.5 | 0 | 0 | 0 | 111 | F7 S8 A15 | F7-D11 HydrophobicContact CD2-CB 3.83Å; F7-D11 HydrophobicContact CE2-CB 3.6Å; F7-D11 HydrophobicContact CG-CB 4.48Å; F7-D11 HydrophobicContact CZ-CB 4.11Å; S8-D11 VanDerWaalsContact CB-OD2 3.29Å; S8-D11 WeakPolarHBondContact CB-OD2 3.33Å; S8-D11 PolarHBondContact N-OD2 2.97Å; S8-D11 VanDerWaalsContact N-OD2 3.08Å; S8-D11 WeakPolarHBondContact O-CB 3.48Å; S8-D11 PolarHBondContact O-N 3.06Å; D11-A15 WeakPolarHBondContact O-CB 3.28Å; D11-A15 PolarHBondContact O-N 3.43Å |
| 12 | A | 82.8 | Confident | 80 | Confident | 31 Ų | 31 | 102.2 Ų | 102.2 | 26% | 0.256 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -60 | -48.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | F7 S8 I9 A10 A15 V16 | F7-A12 HydrophobicContact CD1-CB 4.04Å; F7-A12 HydrophobicContact CE1-CB 3.26Å; F7-A12 HydrophobicContact CZ-CB 3.93Å; F7-A12 VanDerWaalsContact CZ-N 3.34Å; S8-A12 PolarHBondContact O-N 2.96Å; I9-A12 WeakPolarHBondContact O-CB 3.39Å; I9-A12 PolarHBondContact O-N 3.04Å; A10-A12 VanDerWaalsContact C-N 3.28Å; A10-A12 PolarHBondContact O-N 3.28Å; A12-A15 PolarHBondContact O-N 3.06Å; A12-V16 VanDerWaalsContact O-CG2 3.29Å; A12-V16 WeakPolarHBondContact O-CG2 3.33Å; A12-V16 PolarHBondContact O-N 2.98Å |
| 13 | I | 83.7 | Confident | 80.4 | Confident | 110 Ų | 110 | 101.2 Ų | 101.2 | 56% | 0.564 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -62.3 | -47.5 | -179.2 | -67.8 | 164 | 0 | 0 | 0 | 109.9 | I9 A10 A15 V16 D17 | I9-I13 HydrophobicContact CG2-CD1 3.93Å; I9-I13 HydrophobicContact CG2-CG1 4.5Å; I9-I13 VanDerWaalsContact O-CG1 3.28Å; I9-I13 WeakPolarHBondContact O-CG1 3.29Å; I9-I13 PolarHBondContact O-N 3.05Å; A10-I13 PolarHBondContact O-N 3.19Å; I13-A15 VanDerWaalsContact C-N 3.34Å; I13-A15 PolarHBondContact O-N 2.99Å; I13-V16 PolarHBondContact O-N 3.26Å; I13-D17 VanDerWaalsContact O-CB 3.3Å; I13-D17 WeakPolarHBondContact O-CB 3.34Å; I13-D17 PolarHBondContact O-N 3.34Å |
| 14 | V | 86.8 | Confident | 80.6 | Confident | 96 Ų | 96 | 103.2 Ų | 103.2 | 58% | 0.582 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -62.3 | -40 | 178.8 | 173.5 | 0 | 0 | 0 | 0 | 111.9 | A10 K18 | A10-V14 WeakPolarHBondContact O-CG2 3.34Å; A10-V14 PolarHBondContact O-N 3.33Å; V14-K18 WeakPolarHBondContact O-CB 3.3Å; V14-K18 PolarHBondContact O-N 3.4Å |
| 15 | A | 85 | Confident | 80.8 | Confident | 53 Ų | 53 | 96.4 Ų | 96.4 | 44% | 0.438 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.6 | -39.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.3 | D11 A12 I13 A19 | D11-A15 WeakPolarHBondContact O-CB 3.28Å; D11-A15 PolarHBondContact O-N 3.43Å; A12-A15 PolarHBondContact O-N 3.06Å; I13-A15 VanDerWaalsContact C-N 3.34Å; I13-A15 PolarHBondContact O-N 2.99Å; A15-A19 WeakPolarHBondContact O-CB 3.38Å; A15-A19 PolarHBondContact O-N 3.45Å |
| 16 | V | 86.9 | Confident | 80.7 | Confident | 86 Ų | 86 | 91.3 Ų | 91.3 | 52% | 0.521 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.5 | -46.1 | 176.4 | 170.4 | 0 | 0 | 0 | 0 | 110.6 | A12 I13 K18 A19 I20 | A12-V16 VanDerWaalsContact O-CG2 3.29Å; A12-V16 WeakPolarHBondContact O-CG2 3.33Å; A12-V16 PolarHBondContact O-N 2.98Å; I13-V16 PolarHBondContact O-N 3.26Å; V16-K18 PolarHBondContact O-N 2.87Å; V16-A19 WeakPolarHBondContact O-CB 3.17Å; V16-A19 PolarHBondContact O-N 3.27Å; V16-A19 VanDerWaalsContact O-N 3.1Å; V16-I20 HydrophobicContact CG1-CD1 3.59Å; V16-I20 HydrophobicContact CG1-CG1 4.25Å; V16-I20 WeakPolarHBondContact O-CG1 3.48Å; V16-I20 PolarHBondContact O-N 3.29Å |
| 17 | D | 82.8 | Confident | 80.8 | Confident | 98 Ų | 98 | 87.8 Ų | 87.8 | 52% | 0.524 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.1 | -45.9 | 178.2 | -174 | 63.6 | 0 | 0 | 0 | 111.9 | I13 A19 I20 T21 | I13-D17 VanDerWaalsContact O-CB 3.3Å; I13-D17 WeakPolarHBondContact O-CB 3.34Å; I13-D17 PolarHBondContact O-N 3.34Å; D17-A19 VanDerWaalsContact C-N 3.3Å; D17-A19 PolarHBondContact O-N 2.83Å; D17-I20 PolarHBondContact O-N 3.1Å; D17-T21 WeakPolarHBondContact O-CG2 3.42Å; D17-T21 PolarHBondContact O-N 3.35Å; D17-T21 PolarHBondContact O-OG1 3.43Å |
| 18 | K | 87.7 | Confident | 80.6 | Confident | 158 Ų | 158 | 85 Ų | 85 | 69% | 0.687 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.3 | -32.9 | 174.6 | -170.1 | 170.8 | -176.9 | 172 | 0 | 113.4 | V14 V16 T21 A22 | V14-K18 WeakPolarHBondContact O-CB 3.3Å; V14-K18 PolarHBondContact O-N 3.4Å; V16-K18 PolarHBondContact O-N 2.87Å; K18-T21 WeakPolarHBondContact CA-OG1 3.29Å; K18-T21 PolarHBondContact O-OG1 3.24Å; K18-T21 VanDerWaalsContact O-OG1 3.08Å; K18-A22 PolarHBondContact O-N 3.08Å |
| 19 | A | 82.6 | Confident | 80 | Confident | 50 Ų | 50 | 84.3 Ų | 84.3 | 41% | 0.413 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -73 | -41.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | A15 V16 D17 A22 I23 | A15-A19 WeakPolarHBondContact O-CB 3.38Å; A15-A19 PolarHBondContact O-N 3.45Å; V16-A19 WeakPolarHBondContact O-CB 3.17Å; V16-A19 PolarHBondContact O-N 3.27Å; V16-A19 VanDerWaalsContact O-N 3.1Å; D17-A19 VanDerWaalsContact C-N 3.3Å; D17-A19 PolarHBondContact O-N 2.83Å; A19-A22 PolarHBondContact O-N 3.25Å; A19-I23 WeakPolarHBondContact O-CD1 3.22Å; A19-I23 VanDerWaalsContact O-CG1 3.22Å; A19-I23 WeakPolarHBondContact O-CG1 3.43Å; A19-I23 PolarHBondContact O-N 3.21Å |
| 20 | I | 79.9 | Confident | 79.5 | Confident | 94 Ų | 94 | 82 Ų | 82 | 48% | 0.482 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67 | -43.5 | 179.4 | -69.2 | 171.3 | 0 | 0 | 0 | 110.7 | V16 D17 A22 I23 | V16-I20 HydrophobicContact CG1-CD1 3.59Å; V16-I20 HydrophobicContact CG1-CG1 4.25Å; V16-I20 WeakPolarHBondContact O-CG1 3.48Å; V16-I20 PolarHBondContact O-N 3.29Å; D17-I20 PolarHBondContact O-N 3.1Å; I20-A22 PolarHBondContact O-N 2.91Å; I20-I23 CarbonylContact O-C 3.55Å; I20-I23 WeakPolarHBondContact O-CA 3.31Å; I20-I23 PolarHBondContact O-N 2.9Å |
| 21 | T | 80.6 | Confident | 78.9 | Confident | 103 Ų | 103 | 82.7 Ų | 82.7 | 63% | 0.632 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.7 | -27.8 | 175.5 | 47.4 | 0 | 0 | 0 | 0 | 113.2 | D17 K18 | D17-T21 WeakPolarHBondContact O-CG2 3.42Å; D17-T21 PolarHBondContact O-N 3.35Å; D17-T21 PolarHBondContact O-OG1 3.43Å; K18-T21 WeakPolarHBondContact CA-OG1 3.29Å; K18-T21 PolarHBondContact O-OG1 3.24Å; K18-T21 VanDerWaalsContact O-OG1 3.08Å |
| 22 | A | 77.4 | Confident | 78.2 | Confident | 85 Ų | 85 | 84.6 Ų | 84.6 | 70% | 0.702 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -77.9 | -20.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | K18 A19 I20 | K18-A22 PolarHBondContact O-N 3.08Å; A19-A22 PolarHBondContact O-N 3.25Å; I20-A22 PolarHBondContact O-N 2.91Å |
| 23 | I | 77.5 | Confident | 77.4 | Confident | 78 Ų | 78 | 88.7 Ų | 88.7 | 40% | 0.4 | 50% | 0.502 | S | S | . | . | S | Bend | trans | -92.1 | 122.1 | 178.5 | -61.8 | 162.9 | 0 | 0 | 0 | 108.2 | A19 I20 L25 T27 V28 | A19-I23 WeakPolarHBondContact O-CD1 3.22Å; A19-I23 VanDerWaalsContact O-CG1 3.22Å; A19-I23 WeakPolarHBondContact O-CG1 3.43Å; A19-I23 PolarHBondContact O-N 3.21Å; I20-I23 CarbonylContact O-C 3.55Å; I20-I23 WeakPolarHBondContact O-CA 3.31Å; I20-I23 PolarHBondContact O-N 2.9Å; I23-L25 PolarHBondContact O-N 2.87Å; I23-T27 HydrophobicContact CG2-CG2 4.37Å; I23-V28 HydrophobicContact CB-CG2 4.45Å; I23-V28 HydrophobicContact CG2-CG2 3.55Å |
| 24 | K | 74.3 | Confident | 76.4 | Confident | 166 Ų | 166 | 87.9 Ų | 87.9 | 72% | 0.722 | 51% | 0.506 | S | S | * | . | trans | -59.1 | 129.6 | 173.4 | -65.2 | -178.4 | 178 | -176.5 | 0 | 109.4 | A26 T27 V28 | K24-A26 PolarHBondContact O-N 3.05Å; K24-A26 VanDerWaalsContact O-N 3.1Å; K24-T27 WeakPolarHBondContact O-CA 3.28Å; K24-T27 WeakPolarHBondContact O-CB 3.45Å; K24-T27 PolarHBondContact O-N 3.25Å; K24-V28 PolarHBondContact O-N 3.01Å | ||
| 25 | L | 69.1 | Low | 74.9 | Confident | 74 Ų | 74 | 89.9 Ų | 89.9 | 39% | 0.387 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -50.6 | -38.9 | 178.1 | -175.4 | 67.2 | 0 | 0 | 0 | 112.4 | I23 T27 V28 I29 | I23-L25 PolarHBondContact O-N 2.87Å; L25-T27 VanDerWaalsContact C-N 3.26Å; L25-T27 PolarHBondContact O-N 2.91Å; L25-V28 WeakPolarHBondContact O-CB 3.33Å; L25-V28 PolarHBondContact O-N 3.04Å; L25-V28 VanDerWaalsContact O-N 3.08Å; L25-I29 HydrophobicContact CG-CD1 4.08Å; L25-I29 WeakPolarHBondContact O-CG1 3.2Å; L25-I29 PolarHBondContact O-N 2.8Å |
| 26 | A | 68.9 | Low | 73.4 | Confident | 51 Ų | 51 | 90.6 Ų | 90.6 | 42% | 0.421 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -58.1 | -35.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | K24 T30 | K24-A26 PolarHBondContact O-N 3.05Å; K24-A26 VanDerWaalsContact O-N 3.1Å; A26-T30 WeakPolarHBondContact O-CB 3.21Å; A26-T30 VanDerWaalsContact O-CG2 3.25Å; A26-T30 WeakPolarHBondContact O-CG2 3.43Å; A26-T30 PolarHBondContact O-N 3.49Å; A26-T30 PolarHBondContact O-OG1 3.41Å |
| 27 | T | 75.5 | Confident | 71.9 | Confident | 66 Ų | 66 | 89.1 Ų | 89.1 | 41% | 0.405 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67.9 | -41.4 | 174.4 | -56.2 | 0 | 0 | 0 | 0 | 111.2 | I23 K24 L25 T30 C31 | I23-T27 HydrophobicContact CG2-CG2 4.37Å; K24-T27 WeakPolarHBondContact O-CA 3.28Å; K24-T27 WeakPolarHBondContact O-CB 3.45Å; K24-T27 PolarHBondContact O-N 3.25Å; L25-T27 VanDerWaalsContact C-N 3.26Å; L25-T27 PolarHBondContact O-N 2.91Å; T27-T30 WeakPolarHBondContact CA-OG1 3.22Å; T27-T30 PolarHBondContact O-N 3.48Å; T27-T30 PolarHBondContact O-OG1 2.68Å; T27-C31 WeakPolarHBondContact O-CB 3.36Å; T27-C31 PolarHBondContact O-N 2.81Å; T27-C31 PolarHBondContact O-SG 3.4Å |
| 28 | V | 71 | Confident | 70.6 | Confident | 56 Ų | 56 | 91.4 Ų | 91.4 | 34% | 0.339 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -60.9 | -48.8 | 175.5 | -179 | 0 | 0 | 0 | 0 | 110.8 | I23 K24 L25 T30 C31 W32 | I23-V28 HydrophobicContact CB-CG2 4.45Å; I23-V28 HydrophobicContact CG2-CG2 3.55Å; K24-V28 PolarHBondContact O-N 3.01Å; L25-V28 WeakPolarHBondContact O-CB 3.33Å; L25-V28 PolarHBondContact O-N 3.04Å; L25-V28 VanDerWaalsContact O-N 3.08Å; V28-T30 VanDerWaalsContact C-N 3.34Å; V28-T30 PolarHBondContact O-N 2.75Å; V28-C31 PolarHBondContact O-N 2.75Å; V28-W32 PolarHBondContact O-N 3.47Å |
| 29 | I | 71.8 | Confident | 69.3 | Low | 44 Ų | 44 | 87.6 Ų | 87.6 | 23% | 0.226 | 54% | 0.542 | C | S | . | . | H | α-helix | trans | -61.7 | -42.4 | 179.9 | -64.2 | 169 | 0 | 0 | 0 | 111 | L25 N33 M52 | L25-I29 HydrophobicContact CG-CD1 4.08Å; L25-I29 WeakPolarHBondContact O-CG1 3.2Å; L25-I29 PolarHBondContact O-N 2.8Å; I29-N33 PolarHBondContact O-N 2.99Å; I29-N33 PolarHBondContact O-ND2 3Å; I29-M52 HydrophobicContact CD1-CE 4.35Å; I29-M52 HydrophobicContact CG1-CE 4.5Å |
| 30 | T | 74.1 | Confident | 68 | Low | 87 Ų | 87 | 88.6 Ų | 88.6 | 53% | 0.534 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -68.9 | -40 | 179 | 49.5 | 0 | 0 | 0 | 0 | 112.6 | A26 T27 V28 N33 S34 | A26-T30 WeakPolarHBondContact O-CB 3.21Å; A26-T30 VanDerWaalsContact O-CG2 3.25Å; A26-T30 WeakPolarHBondContact O-CG2 3.43Å; A26-T30 PolarHBondContact O-N 3.49Å; A26-T30 PolarHBondContact O-OG1 3.41Å; T27-T30 WeakPolarHBondContact CA-OG1 3.22Å; T27-T30 PolarHBondContact O-N 3.48Å; T27-T30 PolarHBondContact O-OG1 2.68Å; V28-T30 VanDerWaalsContact C-N 3.34Å; V28-T30 PolarHBondContact O-N 2.75Å; T30-N33 PolarHBondContact O-N 3.2Å; T30-S34 PolarHBondContact O-N 2.86Å; T30-S34 VanDerWaalsContact O-N 3.15Å |
| 31 | C | 69.6 | Low | 66.8 | Low | 70 Ų | 70 | 87.9 Ų | 87.9 | 47% | 0.473 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -61.8 | -44.4 | 175.1 | -74.7 | 0 | 0 | 0 | 0 | 111.8 | T27 V28 N33 S34 D35 | T27-C31 WeakPolarHBondContact O-CB 3.36Å; T27-C31 PolarHBondContact O-N 2.81Å; T27-C31 PolarHBondContact O-SG 3.4Å; V28-C31 PolarHBondContact O-N 2.75Å; C31-N33 VanDerWaalsContact C-N 3.3Å; C31-N33 PolarHBondContact O-N 3.39Å; C31-S34 PolarHBondContact O-N 2.73Å; C31-S34 VanDerWaalsContact O-N 3.11Å; C31-S34 PolarHBondContact O-OG 2.76Å; C31-D35 PolarHBondContact O-N 3.14Å |
| 32 | W | 74.6 | Confident | 65.5 | Low | 120 Ų | 120 | 88.5 Ų | 88.5 | 46% | 0.455 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.5 | -37.7 | 180 | -153.7 | -16 | 0 | 0 | 0 | 112.3 | V28 S34 I48 | V28-W32 PolarHBondContact O-N 3.47Å; W32-S34 VanDerWaalsContact C-N 3.35Å; W32-I48 HydrophobicContact CH2-CB 4.48Å; W32-I48 HydrophobicContact CH2-CG1 4.33Å; W32-I48 HydrophobicContact CH2-CG2 3.68Å; W32-I48 HydrophobicContact CZ2-CB 4.26Å; W32-I48 HydrophobicContact CZ2-CD1 3.72Å; W32-I48 HydrophobicContact CZ2-CG1 3.71Å; W32-I48 HydrophobicContact CZ2-CG2 3.68Å; W32-I48 HydrophobicContact CZ3-CG2 4.27Å |
| 33 | N | 66.6 | Low | 64.4 | Low | 118 Ų | 118 | 88.4 Ų | 88.4 | 63% | 0.631 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -70 | -30.4 | 175.9 | -77.5 | -62.8 | 0 | 0 | 0 | 113.1 | I29 T30 C31 | I29-N33 PolarHBondContact O-N 2.99Å; I29-N33 PolarHBondContact O-ND2 3Å; T30-N33 PolarHBondContact O-N 3.2Å; C31-N33 VanDerWaalsContact C-N 3.3Å; C31-N33 PolarHBondContact O-N 3.39Å |
| 34 | S | 62.9 | Low | 63.4 | Low | 92 Ų | 92 | 92.4 Ų | 92.4 | 64% | 0.643 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -81.9 | -25.1 | -176.5 | 70.3 | 0 | 0 | 0 | 0 | 114.6 | T30 C31 W32 A36 | T30-S34 PolarHBondContact O-N 2.86Å; T30-S34 VanDerWaalsContact O-N 3.15Å; C31-S34 PolarHBondContact O-N 2.73Å; C31-S34 VanDerWaalsContact O-N 3.11Å; C31-S34 PolarHBondContact O-OG 2.76Å; W32-S34 VanDerWaalsContact C-N 3.35Å; S34-A36 PolarHBondContact O-N 3.4Å |
| 35 | D | 54.9 | Low | 62.7 | Low | 138 Ų | 138 | 87 Ų | 87 | 74% | 0.738 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.4 | 6.5 | -178.4 | -150.5 | 22.3 | 0 | 0 | 0 | 113.1 | C31 A37 | C31-D35 PolarHBondContact O-N 3.14Å; D35-A37 PolarHBondContact O-N 3.47Å |
| 36 | A | 52.5 | Low | 62.5 | Low | 68 Ų | 68 | 89.8 Ų | 89.8 | 56% | 0.562 | 56% | 0.564 | S | S | * | * | trans | -68.4 | 75.6 | 158.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | S34 | S34-A36 PolarHBondContact O-N 3.4Š| ||
| 37 | A | 55.2 | Low | 62 | Low | 56 Ų | 56 | 90.9 Ų | 90.9 | 46% | 0.463 | 57% | 0.566 | S | S | . | * | trans | -45.9 | 132.9 | 166.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | D35 G39 S40 | D35-A37 PolarHBondContact O-N 3.47Å; A37-G39 VanDerWaalsContact C-N 3.26Å; A37-G39 PolarHBondContact O-N 2.85Å; A37-S40 PolarHBondContact O-N 2.76Å | ||
| 38 | P | 56.3 | Low | 61.4 | Low | 145 Ų | 145 | 89.7 Ų | 89.7 | 94% | 0.942 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.8 | 88.8 | -179.1 | 24.3 | -31.8 | 0 | 0 | 0 | 109 | ||
| 39 | G | 61.2 | Low | 61.3 | Low | 78 Ų | 78 | 92.9 Ų | 92.9 | 80% | 0.804 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 135.6 | -12 | -171.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | A37 A41 | A37-G39 VanDerWaalsContact C-N 3.26Å; A37-G39 PolarHBondContact O-N 2.85Å; G39-A41 PolarHBondContact O-N 3.12Å |
| 40 | S | 54.3 | Low | 61.5 | Low | 72 Ų | 72 | 97.3 Ų | 97.3 | 50% | 0.503 | 59% | 0.586 | S | S | . | * | S | Bend | trans | -67.3 | 127 | 166.6 | -174.2 | 0 | 0 | 0 | 0 | 108.3 | A37 | A37-S40 PolarHBondContact O-N 2.76Š|
| 41 | A | 55.7 | Low | 61.4 | Low | 79 Ų | 79 | 96.1 Ų | 96.1 | 65% | 0.653 | 58% | 0.579 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 134 | 166.3 | 0 | 0 | 0 | 0 | 0 | 107.3 | G39 | G39-A41 PolarHBondContact O-N 3.12Š|
| 42 | P | 52.7 | Low | 61.2 | Low | 115 Ų | 115 | 95.7 Ų | 95.7 | 75% | 0.747 | 57% | 0.571 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 125 | 177.6 | 15.6 | -26.1 | 0 | 0 | 0 | 106.9 | K44 | P42-K44 PolarHBondContact O-N 2.73Å; P42-K44 VanDerWaalsContact O-N 3.14Å |
| 43 | P | 53.8 | Low | 61.3 | Low | 83 Ų | 83 | 96.2 Ų | 96.2 | 54% | 0.539 | 58% | 0.578 | S | S | . | * | P | Polyproline II helix | trans | -50.4 | 131.6 | 168.9 | 21.6 | -30.2 | 0 | 0 | 0 | 105.7 | A45 I48 | P43-A45 PolarHBondContact O-N 2.71Å; P43-I48 HydrophobicContact CB-CD1 3.9Å; P43-I48 HydrophobicContact CG-CD1 3.75Å |
| 44 | K | 56.9 | Low | 61.8 | Low | 163 Ų | 163 | 96.1 Ų | 96.1 | 71% | 0.709 | 57% | 0.574 | S | S | * | * | P | Polyproline II helix | trans | -49.4 | 120.3 | 178.3 | -75.9 | -179.3 | 179.9 | 172.8 | 0 | 106.1 | P42 E46 P47 | P42-K44 PolarHBondContact O-N 2.73Å; P42-K44 VanDerWaalsContact O-N 3.14Å; K44-E46 PolarHBondContact O-N 3.35Å; K44-P47 WeakPolarHBondContact O-CD 3.42Å; K44-P47 WeakPolarHBondContact O-CG 3.36Å |
| 45 | A | 59 | Low | 62.3 | Low | 53 Ų | 53 | 95.2 Ų | 95.2 | 44% | 0.438 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.7 | -9.1 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | P43 I48 K49 | P43-A45 PolarHBondContact O-N 2.71Å; A45-I48 PolarHBondContact O-N 3.02Å; A45-K49 WeakPolarHBondContact O-CG 3.14Å; A45-K49 PolarHBondContact O-N 3.4Å |
| 46 | E | 64.6 | Low | 63 | Low | 132 Ų | 132 | 91 Ų | 91 | 62% | 0.617 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.2 | -52.2 | -178.5 | -66 | -177.5 | 159.2 | 0 | 0 | 114 | K44 K49 | K44-E46 PolarHBondContact O-N 3.35Å; E46-K49 WeakPolarHBondContact O-CG 3.42Å |
| 47 | P | 59.5 | Low | 63.8 | Low | 73 Ų | 73 | 91.2 Ų | 91.2 | 47% | 0.474 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -69.4 | -33.7 | 174.6 | 21.9 | -35.5 | 0 | 0 | 0 | 114.1 | K44 E50 V51 | K44-P47 WeakPolarHBondContact O-CD 3.42Å; K44-P47 WeakPolarHBondContact O-CG 3.36Å; P47-E50 PolarHBondContact O-N 2.89Å; P47-V51 WeakPolarHBondContact O-CG2 3.4Å; P47-V51 PolarHBondContact O-N 3.22Å; P47-V51 VanDerWaalsContact O-N 3.14Å |
| 48 | I | 63.1 | Low | 64.5 | Low | 41 Ų | 41 | 93.4 Ų | 93.4 | 21% | 0.21 | 54% | 0.541 | C | S | . | . | H | α-helix | trans | -71 | -41.6 | -171.7 | -60.7 | 179.6 | 0 | 0 | 0 | 111.4 | W32 P43 A45 E50 V51 M52 | W32-I48 HydrophobicContact CH2-CB 4.48Å; W32-I48 HydrophobicContact CH2-CG1 4.33Å; W32-I48 HydrophobicContact CH2-CG2 3.68Å; W32-I48 HydrophobicContact CZ2-CB 4.26Å; W32-I48 HydrophobicContact CZ2-CD1 3.72Å; W32-I48 HydrophobicContact CZ2-CG1 3.71Å; W32-I48 HydrophobicContact CZ2-CG2 3.68Å; W32-I48 HydrophobicContact CZ3-CG2 4.27Å; P43-I48 HydrophobicContact CB-CD1 3.9Å; P43-I48 HydrophobicContact CG-CD1 3.75Å; A45-I48 PolarHBondContact O-N 3.02Å; I48-E50 VanDerWaalsContact C-N 3.27Å; I48-E50 PolarHBondContact O-N 3.31Å; I48-V51 PolarHBondContact O-N 3.09Å; I48-M52 WeakPolarHBondContact O-CB 3.43Å; I48-M52 PolarHBondContact O-N 3.09Å |
| 49 | K | 69.1 | Low | 64.8 | Low | 124 Ų | 124 | 90.3 Ų | 90.3 | 54% | 0.539 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.5 | -37.1 | 177.8 | 67.5 | -179.9 | -174.7 | 172.7 | 0 | 112.1 | A45 E46 M52 E53 | A45-K49 WeakPolarHBondContact O-CG 3.14Å; A45-K49 PolarHBondContact O-N 3.4Å; E46-K49 WeakPolarHBondContact O-CG 3.42Å; K49-M52 PolarHBondContact O-N 3.25Å; K49-E53 WeakPolarHBondContact O-CB 3.5Å; K49-E53 WeakPolarHBondContact O-CG 3.34Å; K49-E53 PolarHBondContact O-N 2.94Å |
| 50 | E | 75.7 | Confident | 64.9 | Low | 136 Ų | 136 | 92.7 Ų | 92.7 | 64% | 0.636 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -68.8 | -44.9 | 179.7 | -172.9 | 174.7 | -175.3 | 0 | 0 | 110.3 | P47 I48 M52 E53 E54 | P47-E50 PolarHBondContact O-N 2.89Å; I48-E50 VanDerWaalsContact C-N 3.27Å; I48-E50 PolarHBondContact O-N 3.31Å; E50-M52 VanDerWaalsContact C-N 3.32Å; E50-M52 PolarHBondContact O-N 2.85Å; E50-E53 PolarHBondContact O-N 3.05Å; E50-E54 WeakPolarHBondContact O-CB 3.48Å; E50-E54 PolarHBondContact O-N 3.42Å |
| 51 | V | 71.1 | Confident | 65.2 | Low | 63 Ų | 63 | 96 Ų | 96 | 38% | 0.382 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.2 | -40 | 174.2 | 174.4 | 0 | 0 | 0 | 0 | 111.1 | P47 I48 E54 I55 | P47-V51 WeakPolarHBondContact O-CG2 3.4Å; P47-V51 PolarHBondContact O-N 3.22Å; P47-V51 VanDerWaalsContact O-N 3.14Å; I48-V51 PolarHBondContact O-N 3.09Å; V51-E54 PolarHBondContact O-N 2.93Å; V51-I55 HydrophobicContact CG1-CD1 3.72Å; V51-I55 HydrophobicContact CG1-CG1 4.36Å; V51-I55 WeakPolarHBondContact O-CD1 3.36Å; V51-I55 WeakPolarHBondContact O-CG1 3.39Å; V51-I55 PolarHBondContact O-N 2.93Å |
| 52 | M | 66.2 | Low | 65.3 | Low | 61 Ų | 61 | 98.5 Ų | 98.5 | 30% | 0.3 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -70.8 | -40.7 | 179.7 | -163.9 | 135.8 | -173.7 | 0 | 0 | 112.7 | I29 I48 K49 E50 E54 I55 V56 L100 | I29-M52 HydrophobicContact CD1-CE 4.35Å; I29-M52 HydrophobicContact CG1-CE 4.5Å; I48-M52 WeakPolarHBondContact O-CB 3.43Å; I48-M52 PolarHBondContact O-N 3.09Å; K49-M52 PolarHBondContact O-N 3.25Å; E50-M52 VanDerWaalsContact C-N 3.32Å; E50-M52 PolarHBondContact O-N 2.85Å; M52-E54 VanDerWaalsContact C-N 3.31Å; M52-I55 PolarHBondContact O-N 3.35Å; M52-V56 WeakPolarHBondContact O-CB 3.4Å; M52-V56 VanDerWaalsContact O-CG2 3.28Å; M52-V56 WeakPolarHBondContact O-CG2 3.36Å; M52-V56 PolarHBondContact O-N 3.08Å; M52-L100 HydrophobicContact CE-CD2 3.51Å |
| 53 | E | 77.3 | Confident | 65.4 | Low | 131 Ų | 131 | 99.1 Ų | 99.1 | 61% | 0.612 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.7 | -36.6 | 172.2 | -76.2 | 177.3 | -174.4 | 0 | 0 | 111.6 | K49 E50 S57 | K49-E53 WeakPolarHBondContact O-CB 3.5Å; K49-E53 WeakPolarHBondContact O-CG 3.34Å; K49-E53 PolarHBondContact O-N 2.94Å; E50-E53 PolarHBondContact O-N 3.05Å; E53-S57 WeakPolarHBondContact O-CB 3.49Å; E53-S57 PolarHBondContact O-N 3.32Å; E53-S57 PolarHBondContact O-OG 2.64Å |
| 54 | E | 76 | Confident | 65.3 | Low | 116 Ų | 116 | 102 Ų | 102 | 54% | 0.542 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66 | -46.6 | 174.7 | -172.2 | 176.6 | -175.7 | 0 | 0 | 111.6 | E50 V51 M52 S57 L58 | E50-E54 WeakPolarHBondContact O-CB 3.48Å; E50-E54 PolarHBondContact O-N 3.42Å; V51-E54 PolarHBondContact O-N 2.93Å; M52-E54 VanDerWaalsContact C-N 3.31Å; E54-S57 PolarHBondContact O-N 2.9Å; E54-L58 HydrophobicContact CG-CD1 4.45Å; E54-L58 WeakPolarHBondContact O-CB 3.34Å; E54-L58 WeakPolarHBondContact O-CG 3.39Å; E54-L58 PolarHBondContact O-N 3.3Å |
| 55 | I | 72.6 | Confident | 65.2 | Low | 73 Ų | 73 | 97.7 Ų | 97.7 | 37% | 0.374 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.5 | -45.7 | 177.5 | -60.9 | 157 | 0 | 0 | 0 | 110.6 | V51 M52 S57 L58 E59 | V51-I55 HydrophobicContact CG1-CD1 3.72Å; V51-I55 HydrophobicContact CG1-CG1 4.36Å; V51-I55 WeakPolarHBondContact O-CD1 3.36Å; V51-I55 WeakPolarHBondContact O-CG1 3.39Å; V51-I55 PolarHBondContact O-N 2.93Å; M52-I55 PolarHBondContact O-N 3.35Å; I55-S57 VanDerWaalsContact C-N 3.31Å; I55-S57 PolarHBondContact O-N 2.97Å; I55-L58 PolarHBondContact O-N 3.39Å; I55-E59 PolarHBondContact O-N 3.1Å |
| 56 | V | 70.2 | Confident | 65 | Low | 48 Ų | 48 | 101 Ų | 101 | 29% | 0.291 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.7 | -36.1 | 177.3 | 171.6 | 0 | 0 | 0 | 0 | 111.4 | M52 E59 M60 | M52-V56 WeakPolarHBondContact O-CB 3.4Å; M52-V56 VanDerWaalsContact O-CG2 3.28Å; M52-V56 WeakPolarHBondContact O-CG2 3.36Å; M52-V56 PolarHBondContact O-N 3.08Å; V56-E59 PolarHBondContact O-N 2.99Å; V56-M60 HydrophobicContact CG1-CE 4.16Å; V56-M60 WeakPolarHBondContact O-CG 3.33Å; V56-M60 PolarHBondContact O-N 2.8Å |
| 57 | S | 70.2 | Confident | 64.5 | Low | 74 Ų | 74 | 99 Ų | 99 | 52% | 0.517 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -69.5 | -35.6 | 175.7 | -62.3 | 0 | 0 | 0 | 0 | 112.4 | E53 E54 I55 K61 | E53-S57 WeakPolarHBondContact O-CB 3.49Å; E53-S57 PolarHBondContact O-N 3.32Å; E53-S57 PolarHBondContact O-OG 2.64Å; E54-S57 PolarHBondContact O-N 2.9Å; I55-S57 VanDerWaalsContact C-N 3.31Å; I55-S57 PolarHBondContact O-N 2.97Å; S57-K61 WeakPolarHBondContact O-CB 3.35Å; S57-K61 PolarHBondContact O-N 3.2Å; S57-K61 VanDerWaalsContact O-N 3.09Å |
| 58 | L | 68.7 | Low | 64.1 | Low | 101 Ų | 101 | 100.4 Ų | 100.4 | 53% | 0.529 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -68.4 | -43.4 | 173.1 | -73.6 | 177.2 | 0 | 0 | 0 | 110.9 | E54 I55 K61 E62 | E54-L58 HydrophobicContact CG-CD1 4.45Å; E54-L58 WeakPolarHBondContact O-CB 3.34Å; E54-L58 WeakPolarHBondContact O-CG 3.39Å; E54-L58 PolarHBondContact O-N 3.3Å; I55-L58 PolarHBondContact O-N 3.39Å; L58-K61 CarbonylContact O-C 3.5Å; L58-K61 WeakPolarHBondContact O-CB 3.44Å; L58-K61 PolarHBondContact O-N 3.28Å; L58-K61 VanDerWaalsContact O-N 3.12Å; L58-E62 WeakPolarHBondContact O-CB 3.44Å; L58-E62 PolarHBondContact O-N 2.76Å |
| 59 | E | 64 | Low | 63.7 | Low | 81 Ų | 81 | 103 Ų | 103 | 38% | 0.379 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.5 | -42.9 | 173.9 | -79.1 | -173.9 | 120.8 | 0 | 0 | 111.5 | I55 V56 K61 E62 E63 | I55-E59 PolarHBondContact O-N 3.1Å; V56-E59 PolarHBondContact O-N 2.99Å; E59-K61 PolarHBondContact O-N 3.02Å; E59-E62 PolarHBondContact O-N 3.37Å; E59-E63 VanDerWaalsContact O-CB 3.27Å; E59-E63 WeakPolarHBondContact O-CB 3.22Å; E59-E63 PolarHBondContact O-N 3.23Å |
| 60 | M | 63.2 | Low | 63.1 | Low | 127 Ų | 127 | 102 Ų | 102 | 63% | 0.626 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.2 | -32.3 | 174.9 | -76.2 | -169.2 | -175.3 | 0 | 0 | 112.5 | V56 Q64 | V56-M60 HydrophobicContact CG1-CE 4.16Å; V56-M60 WeakPolarHBondContact O-CG 3.33Å; V56-M60 PolarHBondContact O-N 2.8Å; M60-Q64 VanDerWaalsContact O-CB 3.26Å; M60-Q64 WeakPolarHBondContact O-CB 3.36Å; M60-Q64 PolarHBondContact O-N 2.9Å; M60-Q64 VanDerWaalsContact O-N 3.08Å |
| 61 | K | 60.8 | Low | 62 | Low | 141 Ų | 141 | 102.1 Ų | 102.1 | 61% | 0.613 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -75.8 | -36.8 | 175.5 | -175.3 | 173.5 | 178.3 | 177.9 | 0 | 111.8 | S57 L58 E59 T65 | S57-K61 WeakPolarHBondContact O-CB 3.35Å; S57-K61 PolarHBondContact O-N 3.2Å; S57-K61 VanDerWaalsContact O-N 3.09Å; L58-K61 CarbonylContact O-C 3.5Å; L58-K61 WeakPolarHBondContact O-CB 3.44Å; L58-K61 PolarHBondContact O-N 3.28Å; L58-K61 VanDerWaalsContact O-N 3.12Å; E59-K61 PolarHBondContact O-N 3.02Å; K61-T65 PolarHBondContact O-N 3.11Å; K61-T65 PolarHBondContact O-OG1 3.04Å |
| 62 | E | 57.4 | Low | 61.2 | Low | 133 Ų | 133 | 105.3 Ų | 105.3 | 62% | 0.621 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -71.1 | -44.8 | 176.3 | -171.4 | 168.5 | -168.2 | 0 | 0 | 110.9 | L58 E59 Q64 T65 E66 | L58-E62 WeakPolarHBondContact O-CB 3.44Å; L58-E62 PolarHBondContact O-N 2.76Å; E59-E62 PolarHBondContact O-N 3.37Å; E62-Q64 VanDerWaalsContact C-N 3.26Å; E62-Q64 PolarHBondContact O-N 2.96Å; E62-T65 CarbonylContact O-C 3.54Å; E62-T65 WeakPolarHBondContact O-CA 3.47Å; E62-T65 WeakPolarHBondContact O-CB 3.28Å; E62-T65 PolarHBondContact O-N 3.42Å; E62-E66 PolarHBondContact O-N 3.22Å |
| 63 | E | 54.4 | Low | 60.5 | Low | 127 Ų | 127 | 106 Ų | 106 | 59% | 0.593 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -58.4 | -39.7 | 171.7 | -173.5 | 177 | -177.1 | 0 | 0 | 110.4 | E59 T65 E66 D67 | E59-E63 VanDerWaalsContact O-CB 3.27Å; E59-E63 WeakPolarHBondContact O-CB 3.22Å; E59-E63 PolarHBondContact O-N 3.23Å; E63-T65 VanDerWaalsContact C-N 3.27Å; E63-T65 PolarHBondContact O-N 3.08Å; E63-E66 PolarHBondContact O-N 3.38Å; E63-D67 VanDerWaalsContact O-CB 3.24Å; E63-D67 WeakPolarHBondContact O-CB 3.27Å; E63-D67 PolarHBondContact O-N 3.35Å |
| 64 | Q | 51.5 | Low | 59.1 | Low | 143 Ų | 143 | 103 Ų | 103 | 67% | 0.668 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.6 | -29.7 | 173.3 | -165.2 | 174.8 | 40.1 | 0 | 0 | 112.5 | M60 E62 D68 | M60-Q64 VanDerWaalsContact O-CB 3.26Å; M60-Q64 WeakPolarHBondContact O-CB 3.36Å; M60-Q64 PolarHBondContact O-N 2.9Å; M60-Q64 VanDerWaalsContact O-N 3.08Å; E62-Q64 VanDerWaalsContact C-N 3.26Å; E62-Q64 PolarHBondContact O-N 2.96Å; Q64-D68 WeakPolarHBondContact O-CB 3.24Å; Q64-D68 PolarHBondContact O-N 3.45Å; Q64-D68 VanDerWaalsContact O-N 3.09Å |
| 65 | T | 54.5 | Low | 57.9 | Low | 73 Ų | 73 | 101.5 Ų | 101.5 | 45% | 0.448 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -78.5 | -39.6 | 175.7 | -44 | 0 | 0 | 0 | 0 | 110.7 | K61 E62 E63 D68 L69 | K61-T65 PolarHBondContact O-N 3.11Å; K61-T65 PolarHBondContact O-OG1 3.04Å; E62-T65 CarbonylContact O-C 3.54Å; E62-T65 WeakPolarHBondContact O-CA 3.47Å; E62-T65 WeakPolarHBondContact O-CB 3.28Å; E62-T65 PolarHBondContact O-N 3.42Å; E63-T65 VanDerWaalsContact C-N 3.27Å; E63-T65 PolarHBondContact O-N 3.08Å; T65-D68 PolarHBondContact O-N 3.14Å; T65-L69 WeakPolarHBondContact O-CB 3.26Å; T65-L69 WeakPolarHBondContact O-CG 3.36Å; T65-L69 PolarHBondContact O-N 3.42Å |
| 66 | E | 54.4 | Low | 56.7 | Low | 124 Ų | 124 | 105.1 Ų | 105.1 | 58% | 0.579 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -67.1 | -40.4 | 175.9 | -164.1 | 172.4 | -163.2 | 0 | 0 | 110.7 | E62 E63 L69 L70 | E62-E66 PolarHBondContact O-N 3.22Å; E63-E66 PolarHBondContact O-N 3.38Å; E66-L69 CarbonylContact O-C 3.49Å; E66-L69 WeakPolarHBondContact O-CA 3.45Å; E66-L69 WeakPolarHBondContact O-CB 3.12Å; E66-L69 PolarHBondContact O-N 3.14Å; E66-L70 WeakPolarHBondContact O-CB 3.42Å; E66-L70 WeakPolarHBondContact O-CG 3.41Å; E66-L70 PolarHBondContact O-N 2.88Å |
| 67 | D | 53.9 | Low | 55.2 | Low | 90 Ų | 90 | 108.9 Ų | 108.9 | 48% | 0.481 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -65 | -41.4 | 172.8 | -164.9 | 63.3 | 0 | 0 | 0 | 111.7 | E63 L69 L70 E71 | E63-D67 VanDerWaalsContact O-CB 3.24Å; E63-D67 WeakPolarHBondContact O-CB 3.27Å; E63-D67 PolarHBondContact O-N 3.35Å; D67-L69 VanDerWaalsContact C-N 3.3Å; D67-L69 PolarHBondContact O-N 3.42Å; D67-L70 CarbonylContact O-C 3.45Å; D67-L70 PolarHBondContact O-N 2.88Å; D67-L70 VanDerWaalsContact O-N 3.14Å; D67-E71 PolarHBondContact O-N 3.42Å |
| 68 | D | 52.7 | Low | 53.8 | Low | 102 Ų | 102 | 115 Ų | 115 | 55% | 0.545 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -61.3 | -39.5 | 171.3 | -115.4 | 8.5 | 0 | 0 | 0 | 111.2 | Q64 T65 E71 M72 | Q64-D68 WeakPolarHBondContact O-CB 3.24Å; Q64-D68 PolarHBondContact O-N 3.45Å; Q64-D68 VanDerWaalsContact O-N 3.09Å; T65-D68 PolarHBondContact O-N 3.14Å; D68-E71 PolarHBondContact O-N 3.37Å; D68-M72 VanDerWaalsContact O-CG 3.22Å; D68-M72 WeakPolarHBondContact O-CG 3.37Å; D68-M72 PolarHBondContact O-N 3.39Å; D68-M72 VanDerWaalsContact O-SD 3.34Å |
| 69 | L | 53.3 | Low | 52.4 | Low | 94 Ų | 94 | 115.8 Ų | 115.8 | 49% | 0.492 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -66.3 | -36.4 | 174.5 | -70.9 | -178.1 | 0 | 0 | 0 | 111.7 | T65 E66 D67 M72 T73 | T65-L69 WeakPolarHBondContact O-CB 3.26Å; T65-L69 WeakPolarHBondContact O-CG 3.36Å; T65-L69 PolarHBondContact O-N 3.42Å; E66-L69 CarbonylContact O-C 3.49Å; E66-L69 WeakPolarHBondContact O-CA 3.45Å; E66-L69 WeakPolarHBondContact O-CB 3.12Å; E66-L69 PolarHBondContact O-N 3.14Å; D67-L69 VanDerWaalsContact C-N 3.3Å; D67-L69 PolarHBondContact O-N 3.42Å; L69-M72 HydrophobicContact CD2-CG 4.5Å; L69-M72 HydrophobicContact CD2-SD 3.62Å; L69-M72 VanDerWaalsContact O-CG 3.28Å; L69-M72 WeakPolarHBondContact O-CG 3.41Å; L69-T73 WeakPolarHBondContact O-CB 3.21Å; L69-T73 VanDerWaalsContact O-CG2 3.31Å; L69-T73 WeakPolarHBondContact O-CG2 3.34Å; L69-T73 PolarHBondContact O-N 2.9Å; L69-T73 PolarHBondContact O-OG1 2.68Å |
| 70 | L | 56.6 | Low | 51 | Low | 103 Ų | 103 | 115.3 Ų | 115.3 | 54% | 0.539 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -72.8 | -34.9 | 175.5 | -70.8 | 171.4 | 0 | 0 | 0 | 111.3 | E66 D67 T73 G74 | E66-L70 WeakPolarHBondContact O-CB 3.42Å; E66-L70 WeakPolarHBondContact O-CG 3.41Å; E66-L70 PolarHBondContact O-N 2.88Å; D67-L70 CarbonylContact O-C 3.45Å; D67-L70 PolarHBondContact O-N 2.88Å; D67-L70 VanDerWaalsContact O-N 3.14Å; L70-T73 WeakPolarHBondContact CA-OG1 3.14Å; L70-T73 PolarHBondContact O-N 2.89Å; L70-T73 PolarHBondContact O-OG1 2.75Å; L70-G74 WeakPolarHBondContact O-CA 3.25Å; L70-G74 PolarHBondContact O-N 2.86Å |
| 71 | E | 53.1 | Low | 50 | Low | 140 Ų | 140 | 115 Ų | 115 | 65% | 0.654 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -67.3 | -42.1 | 173.8 | -77 | -157.3 | 164.5 | 0 | 0 | 111.4 | D67 D68 G74 | D67-E71 PolarHBondContact O-N 3.42Å; D68-E71 PolarHBondContact O-N 3.37Å; E71-G74 PolarHBondContact O-N 2.74Å |
| 72 | M | 53.6 | Low | 49.4 | Very low | 129 Ų | 129 | 117.4 Ų | 117.4 | 64% | 0.635 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -73.6 | -27 | 177.2 | 63.5 | -151.2 | -67.2 | 0 | 0 | 113.2 | D68 L69 | D68-M72 VanDerWaalsContact O-CG 3.22Å; D68-M72 WeakPolarHBondContact O-CG 3.37Å; D68-M72 PolarHBondContact O-N 3.39Å; D68-M72 VanDerWaalsContact O-SD 3.34Å; L69-M72 HydrophobicContact CD2-CG 4.5Å; L69-M72 HydrophobicContact CD2-SD 3.62Å; L69-M72 VanDerWaalsContact O-CG 3.28Å; L69-M72 WeakPolarHBondContact O-CG 3.41Å |
| 73 | T | 51.6 | Low | 48.7 | Very low | 75 Ų | 75 | 117.7 Ų | 117.7 | 46% | 0.46 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -89.7 | -15.5 | 174.5 | 55.8 | 0 | 0 | 0 | 0 | 113.6 | L69 L70 A75 E76 | L69-T73 WeakPolarHBondContact O-CB 3.21Å; L69-T73 VanDerWaalsContact O-CG2 3.31Å; L69-T73 WeakPolarHBondContact O-CG2 3.34Å; L69-T73 PolarHBondContact O-N 2.9Å; L69-T73 PolarHBondContact O-OG1 2.68Å; L70-T73 WeakPolarHBondContact CA-OG1 3.14Å; L70-T73 PolarHBondContact O-N 2.89Å; L70-T73 PolarHBondContact O-OG1 2.75Å; T73-A75 PolarHBondContact O-N 3.27Å; T73-E76 PolarHBondContact O-N 3.15Å |
| 74 | G | 49.2 | Very low | 48.4 | Very low | 70 Ų | 70 | 120 Ų | 120 | 72% | 0.722 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.2 | -11.3 | 179 | 0 | 0 | 0 | 0 | 0 | 115 | L70 E71 | L70-G74 WeakPolarHBondContact O-CA 3.25Å; L70-G74 PolarHBondContact O-N 2.86Å; E71-G74 PolarHBondContact O-N 2.74Å |
| 75 | A | 50.1 | Low | 48.3 | Very low | 83 Ų | 83 | 120 Ų | 120 | 69% | 0.686 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.8 | -11.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 114 | T73 T77 | T73-A75 PolarHBondContact O-N 3.27Å; A75-T77 VanDerWaalsContact C-N 3.3Å; A75-T77 PolarHBondContact O-N 3.39Å |
| 76 | E | 47.7 | Very low | 48.2 | Very low | 149 Ų | 149 | 124.8 Ų | 124.8 | 70% | 0.696 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -85 | 84.1 | 171.9 | -73.9 | -152.4 | 120.9 | 0 | 0 | 108.6 | T73 F78 | T73-E76 PolarHBondContact O-N 3.15Å; E76-F78 PolarHBondContact O-N 2.84Å |
| 77 | T | 39.5 | Very low | 48 | Very low | 127 Ų | 127 | 127 Ų | 127 | 78% | 0.779 | 70% | 0.697 | S | S | * | * | trans | -39.6 | 98.2 | 162.4 | 54.3 | 0 | 0 | 0 | 0 | 109.9 | A75 P79 | A75-T77 VanDerWaalsContact C-N 3.3Å; A75-T77 PolarHBondContact O-N 3.39Å; T77-P79 WeakPolarHBondContact O-CD 3.43Å; T77-P79 VanDerWaalsContact O-N 3.12Å | ||
| 78 | F | 40.5 | Very low | 47.6 | Very low | 204 Ų | 204 | 130.8 Ų | 130.8 | 90% | 0.895 | 71% | 0.712 | S | S | * | * | trans | -66.1 | 111.6 | 171.3 | -121.3 | -96 | 0 | 0 | 0 | 106.6 | E76 G80 | E76-F78 PolarHBondContact O-N 2.84Å; F78-G80 PolarHBondContact O-N 3.42Å | ||
| 79 | P | 37.9 | Very low | 47.5 | Very low | 117 Ų | 117 | 130.3 Ų | 130.3 | 76% | 0.76 | 72% | 0.722 | S | S | * | * | trans | -84.4 | 111 | -169.2 | 31.4 | -27.2 | 0 | 0 | 0 | 109.4 | T77 | T77-P79 WeakPolarHBondContact O-CD 3.43Å; T77-P79 VanDerWaalsContact O-N 3.12Å | ||
| 80 | G | 35.2 | Very low | 47.1 | Very low | 71 Ų | 71 | 132.3 Ų | 132.3 | 73% | 0.732 | 73% | 0.731 | S | S | * | * | trans | 70.8 | 89.2 | 139 | 0 | 0 | 0 | 0 | 0 | 117.9 | F78 | F78-G80 PolarHBondContact O-N 3.42Š| ||
| 81 | N | 43.1 | Very low | 46.9 | Very low | 121 Ų | 121 | 132.5 Ų | 132.5 | 65% | 0.647 | 74% | 0.739 | S | S | * | * | -178.6 | 102.8 | 127.9 | 50.4 | 2.3 | 0 | 0 | 0 | 107.3 | D83 | N81-D83 PolarHBondContact O-N 2.98Š| |||
| 82 | E | 46.8 | Very low | 46.8 | Very low | 191 Ų | 191 | 134.6 Ų | 134.6 | 89% | 0.893 | 75% | 0.748 | S | S | * | * | 36.4 | 35.9 | 101.8 | 78.7 | -178.3 | 172.8 | 0 | 0 | 117.1 | |||||
| 83 | D | 43.9 | Very low | 46.7 | Very low | 139 Ų | 139 | 134 Ų | 134 | 74% | 0.743 | 75% | 0.748 | S | S | * | * | trans | -96.8 | 84.7 | 151.8 | -72.7 | -46.1 | 0 | 0 | 0 | 108.4 | N81 | N81-D83 PolarHBondContact O-N 2.98Š| ||
| 84 | E | 47 | Very low | 46.8 | Very low | 176 Ų | 176 | 139.4 Ų | 139.4 | 82% | 0.822 | 77% | 0.765 | S | S | * | * | trans | -28.8 | 141.2 | 152.8 | -129.6 | 161.4 | -173.7 | 0 | 0 | 112.3 | ||||
| 85 | D | 49.2 | Very low | 46.8 | Very low | 141 Ų | 141 | 142.1 Ų | 142.1 | 75% | 0.754 | 76% | 0.762 | S | S | * | * | trans | 86.2 | 22.1 | 164.1 | -54.6 | -26 | 0 | 0 | 0 | 120.7 | E87 | D85-E87 PolarHBondContact O-N 2.86Š| ||
| 86 | L | 53.9 | Low | 47.2 | Very low | 175 Ų | 175 | 143 Ų | 143 | 92% | 0.916 | 75% | 0.754 | S | S | * | * | trans | -76.9 | 78.6 | 147.5 | -84.5 | 170.3 | 0 | 0 | 0 | 107.7 | E88 | L86-E88 PolarHBondContact O-N 3.24Š| ||
| 87 | E | 48.3 | Very low | 47.5 | Very low | 170 Ų | 170 | 141 Ų | 141 | 79% | 0.794 | 75% | 0.748 | S | S | * | * | trans | -40.5 | 120.8 | 164.5 | -73.8 | -152.5 | 166.6 | 0 | 0 | 107.7 | D85 A89 | D85-E87 PolarHBondContact O-N 2.86Å; E87-A89 PolarHBondContact O-N 2.7Å | ||
| 88 | E | 46.9 | Very low | 48.2 | Very low | 169 Ų | 169 | 141.8 Ų | 141.8 | 79% | 0.79 | 74% | 0.743 | S | S | * | * | trans | -43.8 | 81.9 | 168.7 | -171.6 | 168.5 | -167.6 | 0 | 0 | 108.6 | L86 M90 | L86-E88 PolarHBondContact O-N 3.24Å; E88-M90 HydrophobicContact CG-CG 4.07Å; E88-M90 PolarHBondContact O-N 3.23Å | ||
| 89 | A | 49.5 | Very low | 48.9 | Very low | 92 Ų | 92 | 137.6 Ų | 137.6 | 76% | 0.76 | 73% | 0.729 | S | S | * | * | trans | -73.5 | 67.7 | 171 | 0 | 0 | 0 | 0 | 0 | 105.7 | E87 P91 | E87-A89 PolarHBondContact O-N 2.7Å; A89-P91 WeakPolarHBondContact O-CD 3.44Å | ||
| 90 | M | 45.9 | Very low | 49.8 | Very low | 137 Ų | 137 | 135.7 Ų | 135.7 | 68% | 0.675 | 71% | 0.712 | S | S | * | * | trans | -48.6 | 114.2 | 160.7 | -84.7 | 174 | 70.3 | 0 | 0 | 105.4 | E88 E92 | E88-M90 HydrophobicContact CG-CG 4.07Å; E88-M90 PolarHBondContact O-N 3.23Å; M90-E92 VanDerWaalsContact C-N 3.28Å; M90-E92 PolarHBondContact O-N 3.36Å | ||
| 91 | P | 52.1 | Low | 50.7 | Low | 107 Ų | 107 | 138.4 Ų | 138.4 | 70% | 0.695 | 72% | 0.715 | S | S | * | * | trans | -68.4 | 102.3 | 168.3 | 28.2 | -28.1 | 0 | 0 | 0 | 104.6 | A89 N93 | A89-P91 WeakPolarHBondContact O-CD 3.44Å; P91-N93 HydrophobicContact CB-CB 4.26Å; P91-N93 PolarHBondContact O-N 2.82Å | ||
| 92 | E | 50 | Low | 51.4 | Low | 183 Ų | 183 | 141.6 Ų | 141.6 | 86% | 0.855 | 72% | 0.723 | S | S | * | * | G | 310 helix | trans | -58.8 | 16.6 | 164.7 | -69.1 | -172.9 | 149.7 | 0 | 0 | 112.4 | M90 K94 | M90-E92 VanDerWaalsContact C-N 3.28Å; M90-E92 PolarHBondContact O-N 3.36Å; E92-K94 VanDerWaalsContact C-N 3.25Å; E92-K94 PolarHBondContact O-N 3.31Å |
| 93 | N | 52 | Low | 51.8 | Low | 118 Ų | 118 | 135.6 Ų | 135.6 | 63% | 0.631 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -82.6 | 4.6 | -175.1 | -127.4 | 13.7 | 0 | 0 | 0 | 113.6 | P91 L95 | P91-N93 HydrophobicContact CB-CB 4.26Å; P91-N93 PolarHBondContact O-N 2.82Å; N93-L95 PolarHBondContact O-N 2.92Å |
| 94 | K | 53.9 | Low | 51.9 | Low | 187 Ų | 187 | 140 Ų | 140 | 81% | 0.813 | 73% | 0.726 | S | S | * | * | G | 310 helix | trans | -73.5 | -0.8 | 177.9 | -110.4 | -178.1 | -178.2 | 176.3 | 0 | 115.2 | E92 | E92-K94 VanDerWaalsContact C-N 3.25Å; E92-K94 PolarHBondContact O-N 3.31Å |
| 95 | L | 48.7 | Very low | 52.1 | Low | 127 Ų | 127 | 138.3 Ų | 138.3 | 67% | 0.665 | 72% | 0.721 | S | S | * | * | G | 310 helix | trans | -110.6 | 7.6 | -168.5 | -82 | 174.3 | 0 | 0 | 0 | 117.7 | N93 | N93-L95 PolarHBondContact O-N 2.92Š|
| 96 | I | 60 | Low | 52.3 | Low | 102 Ų | 102 | 138.1 Ų | 138.1 | 52% | 0.523 | 72% | 0.719 | S | S | . | * | S | Bend | trans | -112.2 | -19.8 | -169.1 | -27.8 | 179.7 | 0 | 0 | 0 | 115.4 | ||
| 97 | L | 53.2 | Low | 52.2 | Low | 108 Ų | 108 | 136.1 Ų | 136.1 | 57% | 0.565 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -74.5 | -34.6 | -177.3 | -70.4 | 174.4 | 0 | 0 | 0 | 113.7 | N99 L100 | L97-N99 PolarHBondContact O-N 3.36Å; L97-L100 WeakPolarHBondContact O-CB 3.43Å; L97-L100 PolarHBondContact O-N 3.4Å |
| 98 | E | 53.2 | Low | 52.4 | Low | 143 Ų | 143 | 134.1 Ų | 134.1 | 67% | 0.668 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -63.1 | -31.4 | -179.1 | -51.6 | -175.1 | -130.1 | 0 | 0 | 112.8 | L100 | E98-L100 VanDerWaalsContact C-N 3.34Å |
| 99 | N | 56 | Low | 52.8 | Low | 115 Ų | 115 | 131.9 Ų | 131.9 | 62% | 0.615 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -76.5 | -22.9 | 177.9 | -70.4 | -40.7 | 0 | 0 | 0 | 112.4 | L97 G103 | L97-N99 PolarHBondContact O-N 3.36Å; N99-G103 PolarHBondContact O-N 3.49Å |
| 100 | L | 56.5 | Low | 53 | Low | 77 Ų | 77 | 134.5 Ų | 134.5 | 40% | 0.403 | 69% | 0.693 | S | S | . | * | H | α-helix | trans | -73.2 | -42.7 | 179.3 | -165.6 | 69 | 0 | 0 | 0 | 111.4 | M52 L97 E98 K102 G103 | M52-L100 HydrophobicContact CE-CD2 3.51Å; L97-L100 WeakPolarHBondContact O-CB 3.43Å; L97-L100 PolarHBondContact O-N 3.4Å; E98-L100 VanDerWaalsContact C-N 3.34Å; L100-K102 VanDerWaalsContact C-N 3.28Å; L100-K102 PolarHBondContact O-N 3.05Å; L100-G103 PolarHBondContact O-N 3.26Å |
| 101 | V | 54.6 | Low | 53.5 | Low | 129 Ų | 129 | 134.4 Ų | 134.4 | 78% | 0.782 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -68.1 | -29.2 | 177.5 | 175.1 | 0 | 0 | 0 | 0 | 111.8 | G103 | V101-G103 VanDerWaalsContact C-N 3.31Å; V101-G103 PolarHBondContact O-N 3.47Å |
| 102 | K | 58 | Low | 53.6 | Low | 187 Ų | 187 | 136.5 Ų | 136.5 | 81% | 0.813 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | -9.7 | -179.1 | -153.5 | 169.9 | -173.3 | 174.7 | 0 | 114 | L100 | L100-K102 VanDerWaalsContact C-N 3.28Å; L100-K102 PolarHBondContact O-N 3.05Å |
| 103 | G | 54.2 | Low | 53.9 | Low | 66 Ų | 66 | 132.6 Ų | 132.6 | 68% | 0.68 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.6 | -2.1 | -176.3 | 0 | 0 | 0 | 0 | 0 | 116 | N99 L100 V101 | N99-G103 PolarHBondContact O-N 3.49Å; L100-G103 PolarHBondContact O-N 3.26Å; V101-G103 VanDerWaalsContact C-N 3.31Å; V101-G103 PolarHBondContact O-N 3.47Å |
| 104 | F | 46.9 | Very low | 54.1 | Low | 232 Ų | 232 | 133.9 Ų | 133.9 | 100% | 1.018 | 69% | 0.686 | S | S | * | * | trans | -82.1 | 0 | -179.5 | -136.6 | -83.4 | 0 | 0 | 0 | 113.1 |
Retrieved 104 of 104 residues in 162.4 ms
(Link to these results)