| 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 | 41.6 | Very low | 63.4 | Low | 235 Ų | 235 | 121.4 Ų | 121.4 | 100% | 1.158 | 66% | 0.657 | S | S | * | * | 0 | 89.5 | 0 | -70.4 | -176.8 | 178 | 0 | 0 | 106.9 | |||||
| 2 | E | 54.2 | Low | 65 | Low | 186 Ų | 186 | 116.9 Ų | 116.9 | 87% | 0.869 | 64% | 0.641 | S | S | * | * | trans | -97.5 | 88.3 | -171 | -64.8 | 178.7 | 170.3 | 0 | 0 | 109.4 | ||||
| 3 | T | 58.5 | Low | 66.6 | Low | 119 Ų | 119 | 116.6 Ų | 116.6 | 73% | 0.73 | 64% | 0.637 | S | S | * | * | trans | -138 | 5.3 | 172.7 | 54.3 | 0 | 0 | 0 | 0 | 114.2 | H5 | T3-H5 PolarHBondContact O-N 3.44Š| ||
| 4 | L | 58.7 | Low | 68.1 | Low | 133 Ų | 133 | 114.9 Ų | 114.9 | 70% | 0.696 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | -19.1 | 177.4 | -101.4 | 94.5 | 0 | 0 | 0 | 114.5 | G6 S7 | L4-G6 VanDerWaalsContact C-N 3.28Å; L4-G6 PolarHBondContact O-N 2.65Å; L4-S7 PolarHBondContact O-OG 3.06Å; L4-S7 VanDerWaalsContact O-OG 3.13Å |
| 5 | H | 59.1 | Low | 69.5 | Low | 160 Ų | 160 | 115.5 Ų | 115.5 | 74% | 0.741 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -69.5 | -26.5 | 179.6 | -70 | -71.2 | 0 | 0 | 0 | 112.7 | T3 V9 | T3-H5 PolarHBondContact O-N 3.44Å; H5-V9 WeakPolarHBondContact O-CG1 3.2Å |
| 6 | G | 62.5 | Low | 70.8 | Confident | 44 Ų | 44 | 110.5 Ų | 110.5 | 45% | 0.454 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -71.1 | -29.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | L4 V9 | L4-G6 VanDerWaalsContact C-N 3.28Å; L4-G6 PolarHBondContact O-N 2.65Å; G6-V9 WeakPolarHBondContact O-CG2 3.29Å |
| 7 | S | 66.1 | Low | 71.9 | Confident | 67 Ų | 67 | 107.2 Ų | 107.2 | 47% | 0.469 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -80.4 | -26.9 | -177.2 | 62.3 | 0 | 0 | 0 | 0 | 113.1 | L4 P11 | L4-S7 PolarHBondContact O-OG 3.06Å; L4-S7 VanDerWaalsContact O-OG 3.13Å; S7-P11 WeakPolarHBondContact O-CD 3.41Å |
| 8 | Q | 67.4 | Low | 73.1 | Confident | 143 Ų | 143 | 106.3 Ų | 106.3 | 67% | 0.668 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -81.2 | -26 | 178.5 | -66.3 | -84.9 | -35.1 | 0 | 0 | 112.7 | P11 S12 | Q8-P11 WeakPolarHBondContact O-CD 3.45Å; Q8-P11 WeakPolarHBondContact O-CG 3.47Å; Q8-S12 PolarHBondContact O-OG 3.46Å |
| 9 | V | 72.1 | Confident | 74.2 | Confident | 73 Ų | 73 | 106.2 Ų | 106.2 | 44% | 0.442 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -73.4 | -31.2 | 177.5 | -65.9 | 0 | 0 | 0 | 0 | 112.5 | H5 G6 S12 I13 | H5-V9 WeakPolarHBondContact O-CG1 3.2Å; G6-V9 WeakPolarHBondContact O-CG2 3.29Å; V9-S12 WeakPolarHBondContact CA-OG 3.27Å; V9-S12 PolarHBondContact O-N 3.14Å; V9-S12 PolarHBondContact O-OG 3.12Å; V9-I13 HydrophobicContact CB-CD1 4.32Å; V9-I13 WeakPolarHBondContact O-CB 3.28Å; V9-I13 VanDerWaalsContact O-CD1 3.31Å; V9-I13 WeakPolarHBondContact O-CD1 3.4Å; V9-I13 WeakPolarHBondContact O-CG1 3.29Å; V9-I13 PolarHBondContact O-N 3.37Å |
| 10 | L | 76 | Confident | 75.2 | Confident | 112 Ų | 112 | 104.9 Ų | 104.9 | 59% | 0.586 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -60.2 | -54.4 | 178.6 | -67.4 | 172.9 | 0 | 0 | 0 | 113.4 | S12 I13 I14 | L10-S12 VanDerWaalsContact C-N 3.3Å; L10-S12 PolarHBondContact O-N 3.33Å; L10-I13 PolarHBondContact O-N 3.07Å; L10-I14 WeakPolarHBondContact O-CD1 3.46Å; L10-I14 WeakPolarHBondContact O-CG1 3.25Å; L10-I14 PolarHBondContact O-N 3.29Å |
| 11 | P | 81.4 | Confident | 76.1 | Confident | 63 Ų | 63 | 104.4 Ų | 104.4 | 41% | 0.409 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -66.9 | -31.3 | -179.4 | 26.6 | -35.3 | 0 | 0 | 0 | 112.6 | S7 Q8 I14 L15 | S7-P11 WeakPolarHBondContact O-CD 3.41Å; Q8-P11 WeakPolarHBondContact O-CD 3.45Å; Q8-P11 WeakPolarHBondContact O-CG 3.47Å; P11-I14 PolarHBondContact O-N 3.27Å; P11-L15 WeakPolarHBondContact O-CB 3.12Å; P11-L15 WeakPolarHBondContact O-CD1 2.8Å; P11-L15 PolarHBondContact O-N 3.44Å |
| 12 | S | 82.7 | Confident | 78.7 | Confident | 68 Ų | 68 | 97 Ų | 97 | 48% | 0.476 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -71.4 | -39.6 | 177.8 | 49.9 | 0 | 0 | 0 | 0 | 112.3 | Q8 V9 L10 I14 L15 G16 | Q8-S12 PolarHBondContact O-OG 3.46Å; V9-S12 WeakPolarHBondContact CA-OG 3.27Å; V9-S12 PolarHBondContact O-N 3.14Å; V9-S12 PolarHBondContact O-OG 3.12Å; L10-S12 VanDerWaalsContact C-N 3.3Å; L10-S12 PolarHBondContact O-N 3.33Å; S12-I14 VanDerWaalsContact C-N 3.33Å; S12-L15 PolarHBondContact O-N 3.45Å; S12-G16 PolarHBondContact O-N 2.86Å |
| 13 | I | 85.4 | Confident | 80.6 | Confident | 113 Ų | 113 | 93.2 Ų | 93.2 | 58% | 0.579 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.9 | -41.8 | 171.9 | -66.7 | 162.7 | 0 | 0 | 0 | 110.5 | V9 L10 G16 S17 | V9-I13 HydrophobicContact CB-CD1 4.32Å; V9-I13 WeakPolarHBondContact O-CB 3.28Å; V9-I13 VanDerWaalsContact O-CD1 3.31Å; V9-I13 WeakPolarHBondContact O-CD1 3.4Å; V9-I13 WeakPolarHBondContact O-CG1 3.29Å; V9-I13 PolarHBondContact O-N 3.37Å; L10-I13 PolarHBondContact O-N 3.07Å; I13-G16 PolarHBondContact O-N 3.2Å; I13-S17 WeakPolarHBondContact O-CB 3.29Å; I13-S17 PolarHBondContact O-N 3.41Å; I13-S17 PolarHBondContact O-OG 3.12Å |
| 14 | I | 88.3 | Confident | 82.3 | Confident | 93 Ų | 93 | 92.2 Ų | 92.2 | 48% | 0.477 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.5 | -46 | 177.2 | -65.7 | 163.2 | 0 | 0 | 0 | 110.9 | L10 P11 S12 G16 S17 I18 | L10-I14 WeakPolarHBondContact O-CD1 3.46Å; L10-I14 WeakPolarHBondContact O-CG1 3.25Å; L10-I14 PolarHBondContact O-N 3.29Å; P11-I14 PolarHBondContact O-N 3.27Å; S12-I14 VanDerWaalsContact C-N 3.33Å; I14-G16 VanDerWaalsContact C-N 3.33Å; I14-G16 PolarHBondContact O-N 3.3Å; I14-S17 PolarHBondContact O-N 3.21Å; I14-S17 PolarHBondContact O-OG 3.44Å; I14-I18 HydrophobicContact CG2-CD1 3.75Å; I14-I18 HydrophobicContact CG2-CG1 4.46Å; I14-I18 WeakPolarHBondContact O-CD1 3.33Å; I14-I18 VanDerWaalsContact O-CG1 3.22Å; I14-I18 WeakPolarHBondContact O-CG1 3.32Å; I14-I18 PolarHBondContact O-N 2.96Å |
| 15 | L | 88.7 | Confident | 84 | Confident | 124 Ų | 124 | 90.9 Ų | 90.9 | 65% | 0.649 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.8 | -43.5 | 176.1 | -108.8 | 94.4 | 0 | 0 | 0 | 111.6 | P11 S12 I18 L19 | P11-L15 WeakPolarHBondContact O-CB 3.12Å; P11-L15 WeakPolarHBondContact O-CD1 2.8Å; P11-L15 PolarHBondContact O-N 3.44Å; S12-L15 PolarHBondContact O-N 3.45Å; L15-I18 PolarHBondContact O-N 2.72Å; L15-L19 WeakPolarHBondContact O-CB 3.21Å; L15-L19 PolarHBondContact O-N 3.17Å |
| 16 | G | 89.9 | Confident | 85.7 | Confident | 35 Ų | 35 | 88.7 Ų | 88.7 | 36% | 0.361 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.5 | -43.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | S12 I13 I14 L19 V20 | S12-G16 PolarHBondContact O-N 2.86Å; I13-G16 PolarHBondContact O-N 3.2Å; I14-G16 VanDerWaalsContact C-N 3.33Å; I14-G16 PolarHBondContact O-N 3.3Å; G16-L19 PolarHBondContact O-N 3.34Å; G16-V20 WeakPolarHBondContact O-CG2 3.08Å; G16-V20 PolarHBondContact O-N 3.39Å |
| 17 | S | 90.4 | Very high | 87.1 | Confident | 55 Ų | 55 | 88.2 Ų | 88.2 | 39% | 0.385 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67 | -41.8 | 178.1 | 69.4 | 0 | 0 | 0 | 0 | 112.1 | I13 I14 L19 V20 I21 | I13-S17 WeakPolarHBondContact O-CB 3.29Å; I13-S17 PolarHBondContact O-N 3.41Å; I13-S17 PolarHBondContact O-OG 3.12Å; I14-S17 PolarHBondContact O-N 3.21Å; I14-S17 PolarHBondContact O-OG 3.44Å; S17-L19 VanDerWaalsContact C-N 3.34Å; S17-L19 PolarHBondContact O-N 2.97Å; S17-V20 PolarHBondContact O-N 3.04Å; S17-I21 WeakPolarHBondContact O-CD1 3.3Å; S17-I21 VanDerWaalsContact O-CG1 3.26Å; S17-I21 WeakPolarHBondContact O-CG1 3.2Å; S17-I21 PolarHBondContact O-N 2.97Å |
| 18 | I | 93.3 | Very high | 88.3 | Confident | 90 Ų | 90 | 89.5 Ų | 89.5 | 46% | 0.462 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.9 | -45.1 | 174.8 | -67.8 | 166.1 | 0 | 0 | 0 | 110.5 | I14 L15 V20 I21 V22 | I14-I18 HydrophobicContact CG2-CD1 3.75Å; I14-I18 HydrophobicContact CG2-CG1 4.46Å; I14-I18 WeakPolarHBondContact O-CD1 3.33Å; I14-I18 VanDerWaalsContact O-CG1 3.22Å; I14-I18 WeakPolarHBondContact O-CG1 3.32Å; I14-I18 PolarHBondContact O-N 2.96Å; L15-I18 PolarHBondContact O-N 2.72Å; I18-V20 PolarHBondContact O-N 3.1Å; I18-I21 PolarHBondContact O-N 3.37Å; I18-V22 HydrophobicContact CG2-CG2 4.39Å; I18-V22 WeakPolarHBondContact O-CG2 3.36Å; I18-V22 PolarHBondContact O-N 2.88Å |
| 19 | L | 93.1 | Very high | 89.4 | Confident | 104 Ų | 104 | 90.5 Ų | 90.5 | 55% | 0.545 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.2 | -45.7 | 179 | -163.5 | 166 | 0 | 0 | 0 | 110.9 | L15 G16 S17 I21 V22 L23 | L15-L19 WeakPolarHBondContact O-CB 3.21Å; L15-L19 PolarHBondContact O-N 3.17Å; G16-L19 PolarHBondContact O-N 3.34Å; S17-L19 VanDerWaalsContact C-N 3.34Å; S17-L19 PolarHBondContact O-N 2.97Å; L19-I21 PolarHBondContact O-N 3.46Å; L19-V22 PolarHBondContact O-N 2.92Å; L19-L23 HydrophobicContact CD2-CD1 3.47Å; L19-L23 VanDerWaalsContact CD2-CD1 3.47Å; L19-L23 HydrophobicContact CD2-CG 3.86Å; L19-L23 WeakPolarHBondContact O-CG 3.38Å; L19-L23 PolarHBondContact O-N 3.06Å |
| 20 | V | 94.7 | Very high | 90.2 | Very high | 81 Ų | 81 | 89.7 Ų | 89.7 | 49% | 0.491 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.7 | -43.6 | 176.4 | 173.1 | 0 | 0 | 0 | 0 | 111.4 | G16 S17 I18 V22 L23 I24 | G16-V20 WeakPolarHBondContact O-CG2 3.08Å; G16-V20 PolarHBondContact O-N 3.39Å; S17-V20 PolarHBondContact O-N 3.04Å; I18-V20 PolarHBondContact O-N 3.1Å; V20-V22 VanDerWaalsContact C-N 3.35Å; V20-V22 PolarHBondContact O-N 2.98Å; V20-L23 PolarHBondContact O-N 3.18Å; V20-I24 HydrophobicContact CG1-CD1 3.95Å; V20-I24 VanDerWaalsContact O-CG1 3.32Å; V20-I24 WeakPolarHBondContact O-CG1 3.31Å; V20-I24 PolarHBondContact O-N 3.02Å |
| 21 | I | 94.9 | Very high | 90.7 | Very high | 95 Ų | 95 | 86.7 Ų | 86.7 | 49% | 0.487 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.8 | -44.7 | 176.7 | -67.7 | 163.2 | 0 | 0 | 0 | 110.8 | S17 I18 L19 L23 I24 L25 | S17-I21 WeakPolarHBondContact O-CD1 3.3Å; S17-I21 VanDerWaalsContact O-CG1 3.26Å; S17-I21 WeakPolarHBondContact O-CG1 3.2Å; S17-I21 PolarHBondContact O-N 2.97Å; I18-I21 PolarHBondContact O-N 3.37Å; L19-I21 PolarHBondContact O-N 3.46Å; I21-L23 VanDerWaalsContact C-N 3.34Å; I21-L23 PolarHBondContact O-N 3.39Å; I21-I24 PolarHBondContact O-N 2.61Å; I21-L25 HydrophobicContact CG2-CD1 4.14Å; I21-L25 HydrophobicContact CG2-CG 4.47Å; I21-L25 WeakPolarHBondContact O-CG 3.35Å; I21-L25 PolarHBondContact O-N 3.34Å |
| 22 | V | 95.4 | Very high | 90.8 | Very high | 79 Ų | 79 | 91.2 Ų | 91.2 | 48% | 0.479 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62 | -41.9 | 177.8 | 172 | 0 | 0 | 0 | 0 | 111.2 | I18 L19 V20 I24 L25 L26 | I18-V22 HydrophobicContact CG2-CG2 4.39Å; I18-V22 WeakPolarHBondContact O-CG2 3.36Å; I18-V22 PolarHBondContact O-N 2.88Å; L19-V22 PolarHBondContact O-N 2.92Å; V20-V22 VanDerWaalsContact C-N 3.35Å; V20-V22 PolarHBondContact O-N 2.98Å; V22-I24 PolarHBondContact O-N 2.7Å; V22-L25 PolarHBondContact O-N 3.2Å; V22-L26 WeakPolarHBondContact O-CB 3.46Å; V22-L26 PolarHBondContact O-N 2.78Å |
| 23 | L | 94.5 | Very high | 90.8 | Very high | 106 Ų | 106 | 93.6 Ų | 93.6 | 56% | 0.555 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.6 | -39.8 | 176.1 | -71.5 | 176.5 | 0 | 0 | 0 | 112.3 | L19 V20 I21 L26 G27 | L19-L23 HydrophobicContact CD2-CD1 3.47Å; L19-L23 VanDerWaalsContact CD2-CD1 3.47Å; L19-L23 HydrophobicContact CD2-CG 3.86Å; L19-L23 WeakPolarHBondContact O-CG 3.38Å; L19-L23 PolarHBondContact O-N 3.06Å; V20-L23 PolarHBondContact O-N 3.18Å; I21-L23 VanDerWaalsContact C-N 3.34Å; I21-L23 PolarHBondContact O-N 3.39Å; L23-L26 PolarHBondContact O-N 2.99Å; L23-G27 PolarHBondContact O-N 3.22Å |
| 24 | I | 94.5 | Very high | 90.4 | Very high | 98 Ų | 98 | 97.2 Ų | 97.2 | 50% | 0.503 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.3 | -47.2 | 175.2 | -67.8 | 166 | 0 | 0 | 0 | 110.1 | V20 I21 V22 L26 G27 L28 | V20-I24 HydrophobicContact CG1-CD1 3.95Å; V20-I24 VanDerWaalsContact O-CG1 3.32Å; V20-I24 WeakPolarHBondContact O-CG1 3.31Å; V20-I24 PolarHBondContact O-N 3.02Å; I21-I24 PolarHBondContact O-N 2.61Å; V22-I24 PolarHBondContact O-N 2.7Å; I24-L26 VanDerWaalsContact C-N 3.33Å; I24-L26 PolarHBondContact O-N 2.74Å; I24-G27 PolarHBondContact O-N 2.73Å; I24-L28 HydrophobicContact CG2-CD1 4.03Å; I24-L28 HydrophobicContact CG2-CG 4.39Å; I24-L28 WeakPolarHBondContact O-CG 3.43Å; I24-L28 PolarHBondContact O-N 3.48Å |
| 25 | L | 94.3 | Very high | 89.7 | Confident | 106 Ų | 106 | 97.8 Ų | 97.8 | 56% | 0.555 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.2 | -41.9 | 177.9 | -71.2 | 174.6 | 0 | 0 | 0 | 111.9 | I21 V22 L28 Y29 | I21-L25 HydrophobicContact CG2-CD1 4.14Å; I21-L25 HydrophobicContact CG2-CG 4.47Å; I21-L25 WeakPolarHBondContact O-CG 3.35Å; I21-L25 PolarHBondContact O-N 3.34Å; V22-L25 PolarHBondContact O-N 3.2Å; L25-L28 PolarHBondContact O-N 3.14Å; L25-Y29 VanDerWaalsContact O-CB 3.29Å; L25-Y29 WeakPolarHBondContact O-CB 3.32Å; L25-Y29 PolarHBondContact O-N 3.18Å |
| 26 | L | 94 | Very high | 88.8 | Confident | 114 Ų | 114 | 99 Ų | 99 | 60% | 0.597 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65.6 | -41 | 176.6 | -165.6 | 115.6 | 0 | 0 | 0 | 111.5 | V22 L23 I24 Y29 S30 | V22-L26 WeakPolarHBondContact O-CB 3.46Å; V22-L26 PolarHBondContact O-N 2.78Å; L23-L26 PolarHBondContact O-N 2.99Å; I24-L26 VanDerWaalsContact C-N 3.33Å; I24-L26 PolarHBondContact O-N 2.74Å; L26-Y29 PolarHBondContact O-N 2.84Å; L26-S30 WeakPolarHBondContact O-CB 3.4Å; L26-S30 PolarHBondContact O-N 3.36Å; L26-S30 PolarHBondContact O-OG 3.33Å |
| 27 | G | 92.8 | Very high | 87.7 | Confident | 34 Ų | 34 | 99.6 Ų | 99.6 | 35% | 0.351 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.5 | -49.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | L23 I24 S30 A31 | L23-G27 PolarHBondContact O-N 3.22Å; I24-G27 PolarHBondContact O-N 2.73Å; G27-S30 PolarHBondContact O-N 3.2Å; G27-S30 PolarHBondContact O-OG 3.22Å; G27-A31 WeakPolarHBondContact O-CB 3.44Å; G27-A31 PolarHBondContact O-N 3.06Å |
| 28 | L | 91.3 | Very high | 86.3 | Confident | 93 Ų | 93 | 107 Ų | 107 | 49% | 0.487 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -60.8 | -45.3 | 175.3 | -69.9 | 173.2 | 0 | 0 | 0 | 111.7 | I24 L25 S30 A31 F32 | I24-L28 HydrophobicContact CG2-CD1 4.03Å; I24-L28 HydrophobicContact CG2-CG 4.39Å; I24-L28 WeakPolarHBondContact O-CG 3.43Å; I24-L28 PolarHBondContact O-N 3.48Å; L25-L28 PolarHBondContact O-N 3.14Å; L28-S30 VanDerWaalsContact C-N 3.35Å; L28-S30 PolarHBondContact O-N 3.33Å; L28-A31 PolarHBondContact O-N 3.33Å; L28-F32 WeakPolarHBondContact O-CB 3.33Å; L28-F32 WeakPolarHBondContact O-CD2 3.29Å; L28-F32 PolarHBondContact O-N 3.27Å |
| 29 | Y | 90.5 | Very high | 84.8 | Confident | 164 Ų | 164 | 104.9 Ų | 104.9 | 64% | 0.643 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -59.4 | -45.6 | 177.3 | -177 | -97.8 | 0 | 0 | 0 | 111.5 | L25 L26 A31 F32 F33 | L25-Y29 VanDerWaalsContact O-CB 3.29Å; L25-Y29 WeakPolarHBondContact O-CB 3.32Å; L25-Y29 PolarHBondContact O-N 3.18Å; L26-Y29 PolarHBondContact O-N 2.84Å; Y29-A31 VanDerWaalsContact C-N 3.34Å; Y29-A31 PolarHBondContact O-N 2.96Å; Y29-F32 PolarHBondContact O-N 2.97Å; Y29-F33 WeakPolarHBondContact O-CB 3.36Å; Y29-F33 PolarHBondContact O-N 2.97Å |
| 30 | S | 89.1 | Confident | 83.3 | Confident | 57 Ų | 57 | 106.8 Ų | 106.8 | 40% | 0.399 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.2 | -38.3 | 177.5 | 78 | 0 | 0 | 0 | 0 | 112.5 | L26 G27 L28 R34 | L26-S30 WeakPolarHBondContact O-CB 3.4Å; L26-S30 PolarHBondContact O-N 3.36Å; L26-S30 PolarHBondContact O-OG 3.33Å; G27-S30 PolarHBondContact O-N 3.2Å; G27-S30 PolarHBondContact O-OG 3.22Å; L28-S30 VanDerWaalsContact C-N 3.35Å; L28-S30 PolarHBondContact O-N 3.33Å; S30-R34 WeakPolarHBondContact O-CB 3.32Å; S30-R34 WeakPolarHBondContact O-CG 3.39Å; S30-R34 PolarHBondContact O-N 3.38Å |
| 31 | A | 86.8 | Confident | 81.6 | Confident | 48 Ų | 48 | 110.7 Ų | 110.7 | 40% | 0.397 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -67 | -46.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | G27 L28 Y29 F33 R34 V35 | G27-A31 WeakPolarHBondContact O-CB 3.44Å; G27-A31 PolarHBondContact O-N 3.06Å; L28-A31 PolarHBondContact O-N 3.33Å; Y29-A31 VanDerWaalsContact C-N 3.34Å; Y29-A31 PolarHBondContact O-N 2.96Å; A31-F33 PolarHBondContact O-N 3.44Å; A31-R34 PolarHBondContact O-N 2.93Å; A31-V35 VanDerWaalsContact O-CG2 3.31Å; A31-V35 WeakPolarHBondContact O-CG2 3.43Å; A31-V35 PolarHBondContact O-N 3.48Å |
| 32 | F | 83.1 | Confident | 79.7 | Confident | 158 Ų | 158 | 113.3 Ų | 113.3 | 69% | 0.693 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -60.1 | -44.7 | 175.4 | -97.8 | -82.3 | 0 | 0 | 0 | 112 | L28 Y29 V35 K36 | L28-F32 WeakPolarHBondContact O-CB 3.33Å; L28-F32 WeakPolarHBondContact O-CD2 3.29Å; L28-F32 PolarHBondContact O-N 3.27Å; Y29-F32 PolarHBondContact O-N 2.97Å; F32-V35 PolarHBondContact O-N 3.34Å; F32-K36 WeakPolarHBondContact O-CB 3.41Å; F32-K36 PolarHBondContact O-N 3.24Å |
| 33 | F | 81.4 | Confident | 77.9 | Confident | 119 Ų | 119 | 117.2 Ų | 117.2 | 52% | 0.522 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.9 | -43.8 | 178.5 | -166.1 | -94.4 | 0 | 0 | 0 | 111.3 | Y29 A31 V35 K36 V37 | Y29-F33 WeakPolarHBondContact O-CB 3.36Å; Y29-F33 PolarHBondContact O-N 2.97Å; A31-F33 PolarHBondContact O-N 3.44Å; F33-V35 VanDerWaalsContact C-N 3.35Å; F33-V35 PolarHBondContact O-N 2.96Å; F33-K36 PolarHBondContact O-N 3.46Å; F33-V37 HydrophobicContact CD1-CG2 3.94Å; F33-V37 HydrophobicContact CE1-CG2 3.62Å; F33-V37 HydrophobicContact CZ-CG2 4.05Å; F33-V37 WeakPolarHBondContact O-CG2 3.33Å; F33-V37 PolarHBondContact O-N 2.84Å |
| 34 | R | 77.8 | Confident | 76.2 | Confident | 188 Ų | 188 | 118.2 Ų | 118.2 | 71% | 0.709 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -60.9 | -41.2 | 175.3 | -79.5 | -176.4 | 174.5 | -173.7 | 0.3 | 112.7 | S30 A31 R38 | S30-R34 WeakPolarHBondContact O-CB 3.32Å; S30-R34 WeakPolarHBondContact O-CG 3.39Å; S30-R34 PolarHBondContact O-N 3.38Å; A31-R34 PolarHBondContact O-N 2.93Å; R34-R38 VanDerWaalsContact O-CG 3.3Å; R34-R38 WeakPolarHBondContact O-CG 3.33Å; R34-R38 PolarHBondContact O-N 2.78Å; R34-R38 VanDerWaalsContact O-N 3.14Å |
| 35 | V | 73.3 | Confident | 74.5 | Confident | 106 Ų | 106 | 124.3 Ų | 124.3 | 64% | 0.642 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -66.2 | -42.6 | 177 | 172.7 | 0 | 0 | 0 | 0 | 110.7 | A31 F32 F33 R38 G39 | A31-V35 VanDerWaalsContact O-CG2 3.31Å; A31-V35 WeakPolarHBondContact O-CG2 3.43Å; A31-V35 PolarHBondContact O-N 3.48Å; F32-V35 PolarHBondContact O-N 3.34Å; F33-V35 VanDerWaalsContact C-N 3.35Å; F33-V35 PolarHBondContact O-N 2.96Å; V35-R38 PolarHBondContact O-N 3.48Å; V35-G39 PolarHBondContact O-N 3.33Å |
| 36 | K | 70.8 | Confident | 72.7 | Confident | 148 Ų | 148 | 125.3 Ų | 125.3 | 64% | 0.643 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -63.8 | -43.8 | 179.7 | -167.5 | 174.9 | -179.3 | 176.9 | 0 | 112.4 | F32 F33 G39 Q40 | F32-K36 WeakPolarHBondContact O-CB 3.41Å; F32-K36 PolarHBondContact O-N 3.24Å; F33-K36 PolarHBondContact O-N 3.46Å; K36-G39 PolarHBondContact O-N 2.88Å; K36-Q40 PolarHBondContact O-N 2.86Å |
| 37 | V | 65.4 | Low | 70.7 | Confident | 49 Ų | 49 | 127.6 Ų | 127.6 | 30% | 0.297 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -66.4 | -39.5 | 177.9 | 176.2 | 0 | 0 | 0 | 0 | 111.3 | F33 G39 Q40 F41 | F33-V37 HydrophobicContact CD1-CG2 3.94Å; F33-V37 HydrophobicContact CE1-CG2 3.62Å; F33-V37 HydrophobicContact CZ-CG2 4.05Å; F33-V37 WeakPolarHBondContact O-CG2 3.33Å; F33-V37 PolarHBondContact O-N 2.84Å; V37-G39 PolarHBondContact O-N 3.45Å; V37-Q40 PolarHBondContact O-N 2.87Å; V37-F41 HydrophobicContact CG1-CE2 4.16Å |
| 38 | R | 61.8 | Low | 68.9 | Low | 209 Ų | 209 | 130 Ų | 130 | 79% | 0.789 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -64.9 | -28.7 | 175.3 | -71.4 | 176.3 | 98.1 | 154 | 6.6 | 112.7 | R34 V35 | R34-R38 VanDerWaalsContact O-CG 3.3Å; R34-R38 WeakPolarHBondContact O-CG 3.33Å; R34-R38 PolarHBondContact O-N 2.78Å; R34-R38 VanDerWaalsContact O-N 3.14Å; V35-R38 PolarHBondContact O-N 3.48Å |
| 39 | G | 60.7 | Low | 67.2 | Low | 47 Ų | 47 | 132.7 Ų | 132.7 | 49% | 0.485 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -71.8 | -26.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | V35 K36 V37 K42 | V35-G39 PolarHBondContact O-N 3.33Å; K36-G39 PolarHBondContact O-N 2.88Å; V37-G39 PolarHBondContact O-N 3.45Å; G39-K42 PolarHBondContact O-N 3.44Å |
| 40 | Q | 61.7 | Low | 65.6 | Low | 144 Ų | 144 | 131.6 Ų | 131.6 | 67% | 0.673 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -75.7 | -29.2 | -178.8 | -72.5 | -175.7 | -25.3 | 0 | 0 | 113.5 | K36 V37 | K36-Q40 PolarHBondContact O-N 2.86Å; V37-Q40 PolarHBondContact O-N 2.87Å |
| 41 | F | 59.2 | Low | 64 | Low | 162 Ų | 162 | 135.8 Ų | 135.8 | 71% | 0.711 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -90.1 | -4.2 | 175.5 | -65.6 | -69.9 | 0 | 0 | 0 | 113.7 | V37 H43 | V37-F41 HydrophobicContact CG1-CE2 4.16Å; F41-H43 PolarHBondContact O-N 3.42Å |
| 42 | K | 55.8 | Low | 62.4 | Low | 151 Ų | 151 | 136.4 Ų | 136.4 | 66% | 0.657 | 64% | 0.636 | S | S | * | * | trans | -70.5 | 90.6 | 159.8 | -166.1 | 174.9 | 179.7 | -172.4 | 0 | 104.8 | G39 N44 | G39-K42 PolarHBondContact O-N 3.44Å; K42-N44 PolarHBondContact O-N 2.85Å | ||
| 43 | H | 57.3 | Low | 61.2 | Low | 161 Ų | 161 | 133.3 Ų | 133.3 | 75% | 0.745 | 63% | 0.632 | S | S | * | * | trans | -48.1 | 100.4 | 149.9 | -76.8 | -134.6 | 0 | 0 | 0 | 103.3 | F41 R45 | F41-H43 PolarHBondContact O-N 3.42Å; H43-R45 PolarHBondContact O-N 3.24Å | ||
| 44 | N | 59.3 | Low | 60.1 | Low | 126 Ų | 126 | 131 Ų | 131 | 67% | 0.674 | 64% | 0.635 | S | S | * | * | trans | -52.4 | 103.3 | 149.2 | -95.4 | 3.9 | 0 | 0 | 0 | 101.1 | K42 M46 | K42-N44 PolarHBondContact O-N 2.85Å; N44-M46 PolarHBondContact O-N 3.38Å | ||
| 45 | R | 58.4 | Low | 59 | Low | 226 Ų | 226 | 128.2 Ų | 128.2 | 85% | 0.853 | 63% | 0.628 | S | S | * | * | trans | -52.3 | 94.6 | 146.4 | -69.9 | -179 | 178.8 | 176.9 | -2.7 | 101.1 | H43 H47 | H43-R45 PolarHBondContact O-N 3.24Å; R45-H47 PolarHBondContact O-N 2.88Å | ||
| 46 | M | 55.4 | Low | 58.3 | Low | 127 Ų | 127 | 127.9 Ų | 127.9 | 63% | 0.626 | 62% | 0.622 | S | S | * | * | trans | -43.7 | 128 | 151.9 | -74.6 | 179.2 | 162.6 | 0 | 0 | 102.3 | N44 D48 | N44-M46 PolarHBondContact O-N 3.38Å; M46-D48 WeakPolarHBondContact CB-OD1 3.49Å; M46-D48 PolarHBondContact O-N 3.44Å | ||
| 47 | H | 53.5 | Low | 57.6 | Low | 162 Ų | 162 | 129.3 Ų | 129.3 | 75% | 0.75 | 63% | 0.625 | S | S | * | * | trans | -63.7 | 70.6 | 171.3 | -70.5 | -92 | 0 | 0 | 0 | 105.7 | R45 E49 L50 | R45-H47 PolarHBondContact O-N 2.88Å; H47-E49 PolarHBondContact O-N 2.82Å; H47-L50 PolarHBondContact O-N 2.98Å | ||
| 48 | D | 55.1 | Low | 57.1 | Low | 85 Ų | 85 | 129.7 Ų | 129.7 | 46% | 0.455 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -68.9 | -10.6 | -179.6 | -78.7 | -15.2 | 0 | 0 | 0 | 108 | M46 L50 Q51 N52 | M46-D48 WeakPolarHBondContact CB-OD1 3.49Å; M46-D48 PolarHBondContact O-N 3.44Å; D48-L50 PolarHBondContact O-N 3.49Å; D48-Q51 PolarHBondContact O-N 3.25Å; D48-N52 HydrophobicContact CB-CB 4.48Å; D48-N52 VanDerWaalsContact O-CA 3.32Å; D48-N52 WeakPolarHBondContact O-CA 3.26Å; D48-N52 WeakPolarHBondContact O-CB 3.41Å; D48-N52 PolarHBondContact O-N 3.28Å |
| 49 | E | 55 | Low | 56.8 | Low | 149 Ų | 149 | 128.3 Ų | 128.3 | 70% | 0.696 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -57.4 | -29.9 | 165.4 | -64.2 | 173.1 | -159.6 | 0 | 0 | 112 | H47 F55 | H47-E49 PolarHBondContact O-N 2.82Å; E49-F55 WeakPolarHBondContact O-CB 3.48Å |
| 50 | L | 56.8 | Low | 56.7 | Low | 142 Ų | 142 | 133.3 Ų | 133.3 | 74% | 0.743 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -99.5 | -16 | 177.7 | -162.7 | 69.4 | 0 | 0 | 0 | 113.9 | H47 D48 L56 | H47-L50 PolarHBondContact O-N 2.98Å; D48-L50 PolarHBondContact O-N 3.49Å; L50-L56 WeakPolarHBondContact O-CD1 3.49Å |
| 51 | Q | 54.6 | Low | 56.2 | Low | 144 Ų | 144 | 134.2 Ų | 134.2 | 67% | 0.673 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -110.1 | -12.2 | 178.2 | -95.7 | -170.3 | -23.9 | 0 | 0 | 114.3 | D48 P53 | D48-Q51 PolarHBondContact O-N 3.25Å; Q51-P53 WeakPolarHBondContact O-CD 3.44Å |
| 52 | N | 53.4 | Low | 55.9 | Low | 61 Ų | 61 | 134.9 Ų | 134.9 | 33% | 0.326 | 67% | 0.666 | S | S | . | * | S | Bend | trans | -72.5 | 115.5 | 172.4 | 179.2 | 1.7 | 0 | 0 | 0 | 106.9 | D48 A54 F55 L56 | D48-N52 HydrophobicContact CB-CB 4.48Å; D48-N52 VanDerWaalsContact O-CA 3.32Å; D48-N52 WeakPolarHBondContact O-CA 3.26Å; D48-N52 WeakPolarHBondContact O-CB 3.41Å; D48-N52 PolarHBondContact O-N 3.28Å; N52-A54 PolarHBondContact O-N 2.93Å; N52-A54 VanDerWaalsContact OD1-CB 3.25Å; N52-A54 WeakPolarHBondContact OD1-CB 3.22Å; N52-A54 PolarHBondContact OD1-N 3.47Å; N52-F55 HydrophobicContact CB-CD2 3.8Å; N52-F55 HydrophobicContact CB-CE2 4.44Å; N52-F55 VanDerWaalsContact ND2-CD2 3.33Å; N52-F55 WeakPolarHBondContact ND2-CD2 3.33Å; N52-F55 VanDerWaalsContact ND2-CE2 3.29Å; N52-F55 WeakPolarHBondContact ND2-CE2 3.49Å; N52-F55 PolarHBondContact O-N 3.33Å; N52-L56 PolarHBondContact O-N 2.95Å |
| 53 | P | 58 | Low | 55.7 | Low | 94 Ų | 94 | 136.8 Ų | 136.8 | 61% | 0.61 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -58.8 | -17.7 | 179.4 | 23.4 | -32.6 | 0 | 0 | 0 | 112.6 | Q51 F55 | Q51-P53 WeakPolarHBondContact O-CD 3.44Å; P53-F55 VanDerWaalsContact C-N 3.25Å; P53-F55 PolarHBondContact O-N 3.46Å |
| 54 | A | 59.4 | Low | 55.5 | Low | 69 Ų | 69 | 137.7 Ų | 137.7 | 57% | 0.57 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -65 | -25.5 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | N52 | N52-A54 PolarHBondContact O-N 2.93Å; N52-A54 VanDerWaalsContact OD1-CB 3.25Å; N52-A54 WeakPolarHBondContact OD1-CB 3.22Å; N52-A54 PolarHBondContact OD1-N 3.47Å |
| 55 | F | 54.1 | Low | 55.3 | Low | 130 Ų | 130 | 137.1 Ų | 137.1 | 57% | 0.57 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -102.8 | -19.3 | -177.9 | -70.1 | -84 | 0 | 0 | 0 | 113.7 | E49 N52 P53 Y57 | E49-F55 WeakPolarHBondContact O-CB 3.48Å; N52-F55 HydrophobicContact CB-CD2 3.8Å; N52-F55 HydrophobicContact CB-CE2 4.44Å; N52-F55 VanDerWaalsContact ND2-CD2 3.33Å; N52-F55 WeakPolarHBondContact ND2-CD2 3.33Å; N52-F55 VanDerWaalsContact ND2-CE2 3.29Å; N52-F55 WeakPolarHBondContact ND2-CE2 3.49Å; N52-F55 PolarHBondContact O-N 3.33Å; P53-F55 VanDerWaalsContact C-N 3.25Å; P53-F55 PolarHBondContact O-N 3.46Å; F55-Y57 VanDerWaalsContact C-N 3.26Å; F55-Y57 PolarHBondContact O-N 3.24Å |
| 56 | L | 57.6 | Low | 55.1 | Low | 100 Ų | 100 | 134.4 Ų | 134.4 | 52% | 0.524 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -66.9 | -25.2 | 176.2 | -94.1 | 108.6 | 0 | 0 | 0 | 113.8 | L50 N52 | L50-L56 WeakPolarHBondContact O-CD1 3.49Å; N52-L56 PolarHBondContact O-N 2.95Å |
| 57 | Y | 57.9 | Low | 55 | Low | 177 Ų | 177 | 134.6 Ų | 134.6 | 69% | 0.694 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.7 | 20.8 | -174.5 | -64.2 | -74 | 0 | 0 | 0 | 112.9 | F55 | F55-Y57 VanDerWaalsContact C-N 3.26Å; F55-Y57 PolarHBondContact O-N 3.24Å |
| 58 | G | 54.1 | Low | 55 | Low | 57 Ų | 57 | 134 Ų | 134 | 59% | 0.588 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -104.2 | -16.9 | -157.4 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||
| 59 | E | 56.2 | Low | 55 | Low | 180 Ų | 180 | 137.9 Ų | 137.9 | 84% | 0.841 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -121.5 | -30.9 | -174 | -129.9 | 176.3 | -178.6 | 0 | 0 | 116.2 | ||
| 60 | D | 57 | Low | 55.1 | Low | 152 Ų | 152 | 133.6 Ų | 133.6 | 81% | 0.813 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -129.1 | -1.6 | -169.3 | -72.9 | -27.4 | 0 | 0 | 0 | 117.6 | ||
| 61 | E | 53 | Low | 55 | Low | 163 Ų | 163 | 131.4 Ų | 131.4 | 76% | 0.762 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -116.1 | 83.6 | 178.8 | -78.4 | 179 | 176.6 | 0 | 0 | 112.2 | M63 | E61-M63 PolarHBondContact O-N 2.92Š|
| 62 | E | 51.2 | Low | 55 | Low | 177 Ų | 177 | 127.9 Ų | 127.9 | 83% | 0.827 | 67% | 0.67 | S | S | * | * | trans | 21.7 | 79.2 | 133.1 | -60.4 | 179.3 | 178.5 | 0 | 0 | 116.1 | E64 | E62-E64 PolarHBondContact O-N 3.23Š| ||
| 63 | M | 52.8 | Low | 55.5 | Low | 191 Ų | 191 | 133.2 Ų | 133.2 | 94% | 0.941 | 69% | 0.691 | S | S | * | * | S | Bend | trans | 11.5 | 30 | 132.8 | -141.9 | 166 | -165.1 | 0 | 0 | 122.8 | E61 | E61-M63 PolarHBondContact O-N 2.92Š|
| 64 | E | 53.7 | Low | 55.7 | Low | 179 Ų | 179 | 133.6 Ų | 133.6 | 84% | 0.836 | 70% | 0.696 | S | S | * | * | trans | -114.8 | -16.7 | 178.7 | -71.6 | -131.3 | 162.1 | 0 | 0 | 116.6 | E62 | E62-E64 PolarHBondContact O-N 3.23Š| ||
| 65 | T | 53.4 | Low | 55.8 | Low | 114 Ų | 114 | 133.2 Ų | 133.2 | 70% | 0.699 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -102.2 | 3.1 | -176.6 | -4.5 | 0 | 0 | 0 | 0 | 115.7 | N67 | T65-N67 PolarHBondContact O-N 2.97Å; T65-N67 VanDerWaalsContact O-N 3.17Å |
| 66 | F | 55 | Low | 56.2 | Low | 170 Ų | 170 | 131.6 Ų | 131.6 | 75% | 0.746 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.7 | -18.5 | -177.8 | -171.5 | -101.5 | 0 | 0 | 0 | 113.8 | A70 | F66-A70 VanDerWaalsContact O-CB 3.29Å; F66-A70 WeakPolarHBondContact O-CB 3.48Å |
| 67 | N | 53.8 | Low | 56.3 | Low | 131 Ų | 131 | 132.4 Ų | 132.4 | 70% | 0.701 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | -21.7 | -174.6 | -67.9 | -40.7 | 0 | 0 | 0 | 114.7 | T65 | T65-N67 PolarHBondContact O-N 2.97Å; T65-N67 VanDerWaalsContact O-N 3.17Å |
| 68 | D | 54 | Low | 56.2 | Low | 150 Ų | 150 | 130.5 Ų | 130.5 | 80% | 0.802 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -22.5 | -172.7 | -77.4 | -9.7 | 0 | 0 | 0 | 113.5 | ||
| 69 | E | 55 | Low | 56.4 | Low | 165 Ų | 165 | 132.2 Ų | 132.2 | 77% | 0.771 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -110 | -0.4 | -178.4 | -160.4 | 153.2 | -161.8 | 0 | 0 | 113.9 | T71 | E69-T71 VanDerWaalsContact C-N 3.26Å; E69-T71 PolarHBondContact O-N 3.45Å |
| 70 | A | 57.1 | Low | 56.7 | Low | 60 Ų | 60 | 126.8 Ų | 126.8 | 50% | 0.496 | 66% | 0.657 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -75.4 | -2.7 | -174.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | F66 | F66-A70 VanDerWaalsContact O-CB 3.29Å; F66-A70 WeakPolarHBondContact O-CB 3.48Å |
| 71 | T | 53.2 | Low | 56.7 | Low | 95 Ų | 95 | 123.5 Ų | 123.5 | 58% | 0.583 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.2 | 57 | 176.5 | 44.6 | 0 | 0 | 0 | 0 | 112 | E69 F73 | E69-T71 VanDerWaalsContact C-N 3.26Å; E69-T71 PolarHBondContact O-N 3.45Å; T71-F73 VanDerWaalsContact CB-CE2 3.45Å; T71-F73 HydrophobicContact CG2-CD2 4.1Å; T71-F73 HydrophobicContact CG2-CE2 3.35Å; T71-F73 HydrophobicContact CG2-CZ 3.97Å; T71-F73 PolarHBondContact O-N 3.06Å |
| 72 | N | 56.2 | Low | 56.8 | Low | 70 Ų | 70 | 124.3 Ų | 124.3 | 37% | 0.374 | 64% | 0.639 | S | S | . | * | trans | -73.2 | 62 | 167.6 | -165.7 | -11.5 | 0 | 0 | 0 | 111.3 | S74 N75 | N72-S74 PolarHBondContact O-N 2.96Å; N72-S74 PolarHBondContact OD1-OG 3.41Å; N72-N75 PolarHBondContact O-N 3.38Å; N72-N75 WeakPolarHBondContact OD1-CB 3.31Å; N72-N75 PolarHBondContact OD1-N 3.45Å | ||
| 73 | F | 63.7 | Low | 57 | Low | 173 Ų | 173 | 122.2 Ų | 122.2 | 76% | 0.759 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70 | -6.6 | 170.9 | -66.1 | -68.2 | 0 | 0 | 0 | 112.7 | T71 | T71-F73 VanDerWaalsContact CB-CE2 3.45Å; T71-F73 HydrophobicContact CG2-CD2 4.1Å; T71-F73 HydrophobicContact CG2-CE2 3.35Å; T71-F73 HydrophobicContact CG2-CZ 3.97Å; T71-F73 PolarHBondContact O-N 3.06Å |
| 74 | S | 62.2 | Low | 57.2 | Low | 103 Ų | 103 | 118.2 Ų | 118.2 | 72% | 0.72 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.6 | -1.6 | 175 | 53.2 | 0 | 0 | 0 | 0 | 113.4 | N72 P76 | N72-S74 PolarHBondContact O-N 2.96Å; N72-S74 PolarHBondContact OD1-OG 3.41Å; S74-P76 VanDerWaalsContact O-CD 3.27Å; S74-P76 WeakPolarHBondContact O-CD 3.43Å |
| 75 | N | 59.9 | Low | 57.3 | Low | 60 Ų | 60 | 114 Ų | 114 | 32% | 0.321 | 60% | 0.597 | S | S | . | * | trans | -68.2 | 117.8 | 177.1 | -178.4 | -8.6 | 0 | 0 | 0 | 109.8 | N72 M77 Y78 | N72-N75 PolarHBondContact O-N 3.38Å; N72-N75 WeakPolarHBondContact OD1-CB 3.31Å; N72-N75 PolarHBondContact OD1-N 3.45Å; N75-M77 PolarHBondContact O-N 3.46Å; N75-M77 WeakPolarHBondContact OD1-CB 3.14Å; N75-M77 PolarHBondContact OD1-N 3.31Å; N75-M77 VanDerWaalsContact OD1-N 3.1Å; N75-Y78 HydrophobicContact CB-CD2 3.86Å; N75-Y78 HydrophobicContact CB-CE2 4.14Å; N75-Y78 PolarHBondContact O-N 2.89Å | ||
| 76 | P | 63.9 | Low | 57.3 | Low | 96 Ų | 96 | 114 Ų | 114 | 62% | 0.623 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -57.9 | -18.9 | -177.6 | -23.4 | 33.1 | 0 | 0 | 0 | 114.6 | S74 Y78 D79 | S74-P76 VanDerWaalsContact O-CD 3.27Å; S74-P76 WeakPolarHBondContact O-CD 3.43Å; P76-Y78 VanDerWaalsContact C-N 3.28Å; P76-Y78 PolarHBondContact O-N 3.38Å; P76-D79 PolarHBondContact O-N 3.46Å |
| 77 | M | 59.7 | Low | 57.3 | Low | 117 Ų | 117 | 109.4 Ų | 109.4 | 58% | 0.576 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -64.4 | -27.2 | 173.3 | -89.2 | -63 | -40.6 | 0 | 0 | 113.6 | N75 T80 | N75-M77 PolarHBondContact O-N 3.46Å; N75-M77 WeakPolarHBondContact OD1-CB 3.14Å; N75-M77 PolarHBondContact OD1-N 3.31Å; N75-M77 VanDerWaalsContact OD1-N 3.1Å; M77-T80 PolarHBondContact O-OG1 3Å |
| 78 | Y | 55 | Low | 57.2 | Low | 137 Ų | 137 | 107.1 Ų | 107.1 | 54% | 0.537 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -77.7 | -30.1 | 177.3 | -71.9 | -70.6 | 0 | 0 | 0 | 112.5 | N75 P76 T80 Y82 | N75-Y78 HydrophobicContact CB-CD2 3.86Å; N75-Y78 HydrophobicContact CB-CE2 4.14Å; N75-Y78 PolarHBondContact O-N 2.89Å; P76-Y78 VanDerWaalsContact C-N 3.28Å; P76-Y78 PolarHBondContact O-N 3.38Å; Y78-T80 VanDerWaalsContact C-N 3.28Å; Y78-T80 PolarHBondContact O-N 3.41Å; Y78-Y82 PolarHBondContact O-N 2.89Å |
| 79 | D | 59.2 | Low | 57.2 | Low | 93 Ų | 93 | 105.7 Ų | 105.7 | 50% | 0.497 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.7 | -34.7 | 177.4 | -96 | 12.2 | 0 | 0 | 0 | 111.8 | P76 K83 | P76-D79 PolarHBondContact O-N 3.46Å; D79-K83 VanDerWaalsContact O-CB 3.29Å; D79-K83 WeakPolarHBondContact O-CB 3.4Å; D79-K83 WeakPolarHBondContact O-CG 3.21Å; D79-K83 PolarHBondContact O-N 2.98Å; D79-K83 VanDerWaalsContact O-N 3.12Å; D79-K83 IonicContact OD2-NZ 3.98Å |
| 80 | T | 61.4 | Low | 57.2 | Low | 67 Ų | 67 | 107 Ų | 107 | 41% | 0.411 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -72.8 | -43.9 | -179.3 | 57.4 | 0 | 0 | 0 | 0 | 111.6 | M77 Y78 Y82 K83 D84 | M77-T80 PolarHBondContact O-OG1 3Å; Y78-T80 VanDerWaalsContact C-N 3.28Å; Y78-T80 PolarHBondContact O-N 3.41Å; T80-Y82 PolarHBondContact O-N 3.33Å; T80-K83 PolarHBondContact O-N 3.43Å; T80-D84 WeakPolarHBondContact O-CB 3.36Å; T80-D84 PolarHBondContact O-N 3.05Å |
| 81 | V | 58.1 | Low | 57.1 | Low | 82 Ų | 82 | 111.2 Ų | 111.2 | 50% | 0.497 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -63.2 | -43.7 | 179.2 | -178.1 | 0 | 0 | 0 | 0 | 111.1 | T85 | V81-T85 WeakPolarHBondContact O-CB 2.99Å; V81-T85 PolarHBondContact O-N 3.43Å; V81-T85 VanDerWaalsContact O-N 3.14Å; V81-T85 PolarHBondContact O-OG1 2.92Å |
| 82 | Y | 53.8 | Low | 56.8 | Low | 180 Ų | 180 | 113.1 Ų | 113.1 | 71% | 0.706 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -68.6 | -38.2 | 178.2 | -95.3 | -77.8 | 0 | 0 | 0 | 112.8 | Y78 T80 V86 | Y78-Y82 PolarHBondContact O-N 2.89Å; T80-Y82 PolarHBondContact O-N 3.33Å; Y82-V86 WeakPolarHBondContact O-CG2 3.41Å; Y82-V86 PolarHBondContact O-N 3.4Å |
| 83 | K | 56.2 | Low | 56.5 | Low | 133 Ų | 133 | 114.3 Ų | 114.3 | 58% | 0.578 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -71.4 | -36.8 | 179.3 | -74 | 177.6 | -176.2 | 171.2 | 0 | 112.9 | D79 T80 V86 A87 | D79-K83 VanDerWaalsContact O-CB 3.29Å; D79-K83 WeakPolarHBondContact O-CB 3.4Å; D79-K83 WeakPolarHBondContact O-CG 3.21Å; D79-K83 PolarHBondContact O-N 2.98Å; D79-K83 VanDerWaalsContact O-N 3.12Å; D79-K83 IonicContact OD2-NZ 3.98Å; T80-K83 PolarHBondContact O-N 3.43Å; K83-V86 VanDerWaalsContact O-CG2 3.28Å; K83-V86 WeakPolarHBondContact O-CG2 3.1Å; K83-A87 PolarHBondContact O-N 2.86Å |
| 84 | D | 56.9 | Low | 56 | Low | 107 Ų | 107 | 113.2 Ų | 113.2 | 57% | 0.572 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -71.8 | -34.9 | 178 | -74.3 | -9.2 | 0 | 0 | 0 | 111.6 | T80 V86 A87 N88 | T80-D84 WeakPolarHBondContact O-CB 3.36Å; T80-D84 PolarHBondContact O-N 3.05Å; D84-V86 PolarHBondContact O-N 2.99Å; D84-A87 PolarHBondContact O-N 2.93Å; D84-N88 PolarHBondContact O-N 3.47Å; D84-N88 VanDerWaalsContact O-N 3.12Å |
| 85 | T | 55.3 | Low | 55.6 | Low | 92 Ų | 92 | 114 Ų | 114 | 56% | 0.564 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -66.7 | -35.4 | 179.6 | -49 | 0 | 0 | 0 | 0 | 112.5 | V81 | V81-T85 WeakPolarHBondContact O-CB 2.99Å; V81-T85 PolarHBondContact O-N 3.43Å; V81-T85 VanDerWaalsContact O-N 3.14Å; V81-T85 PolarHBondContact O-OG1 2.92Å |
| 86 | V | 54.2 | Low | 55.3 | Low | 113 Ų | 113 | 114.3 Ų | 114.3 | 69% | 0.685 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -79.3 | -25.5 | 175.7 | -70.8 | 0 | 0 | 0 | 0 | 113.3 | Y82 K83 D84 | Y82-V86 WeakPolarHBondContact O-CG2 3.41Å; Y82-V86 PolarHBondContact O-N 3.4Å; K83-V86 VanDerWaalsContact O-CG2 3.28Å; K83-V86 WeakPolarHBondContact O-CG2 3.1Å; D84-V86 PolarHBondContact O-N 2.99Å |
| 87 | A | 54.4 | Low | 54.8 | Low | 73 Ų | 73 | 117.5 Ų | 117.5 | 60% | 0.603 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -78 | -30.9 | 179 | 0 | 0 | 0 | 0 | 0 | 112.9 | K83 D84 | K83-A87 PolarHBondContact O-N 2.86Å; D84-A87 PolarHBondContact O-N 2.93Å |
| 88 | N | 51.1 | Low | 54.4 | Low | 84 Ų | 84 | 115.6 Ų | 115.6 | 45% | 0.449 | 62% | 0.618 | S | S | . | * | trans | -112.3 | 35.8 | -172.6 | -84.6 | -4.8 | 0 | 0 | 0 | 114.6 | D84 E90 E91 | D84-N88 PolarHBondContact O-N 3.47Å; D84-N88 VanDerWaalsContact O-N 3.12Å; N88-E90 PolarHBondContact O-N 3.39Å; N88-E90 VanDerWaalsContact O-N 3.07Å; N88-E91 PolarHBondContact O-N 3.47Å | ||
| 89 | V | 55.4 | Low | 54.3 | Low | 119 Ų | 119 | 112.4 Ų | 112.4 | 72% | 0.721 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.2 | -18.1 | 172.2 | -179.5 | 0 | 0 | 0 | 0 | 112.2 | ||
| 90 | E | 54.6 | Low | 54.1 | Low | 192 Ų | 192 | 114.8 Ų | 114.8 | 90% | 0.897 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | -20.4 | -175.7 | -147.7 | 145.9 | -154.3 | 0 | 0 | 114.2 | N88 | N88-E90 PolarHBondContact O-N 3.39Å; N88-E90 VanDerWaalsContact O-N 3.07Å |
| 91 | E | 55.4 | Low | 53.6 | Low | 150 Ų | 150 | 119.9 Ų | 119.9 | 70% | 0.701 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.1 | -11.2 | -174.1 | -70.3 | -165.4 | 163.3 | 0 | 0 | 115.6 | N88 S93 | N88-E91 PolarHBondContact O-N 3.47Å; E91-S93 PolarHBondContact O-N 3.39Å |
| 92 | H | 46.9 | Very low | 53.5 | Low | 134 Ų | 134 | 120.1 Ų | 120.1 | 62% | 0.62 | 66% | 0.661 | S | S | * | * | trans | -96.2 | 25.3 | -175 | -80.1 | -78.4 | 0 | 0 | 0 | 115.8 | L94 | H92-L94 PolarHBondContact O-N 3.13Š| ||
| 93 | S | 49.5 | Very low | 53.3 | Low | 96 Ų | 96 | 114.9 Ų | 114.9 | 67% | 0.671 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.5 | 3 | 172.5 | -170.8 | 0 | 0 | 0 | 0 | 114.6 | E91 | E91-S93 PolarHBondContact O-N 3.39Š|
| 94 | L | 53.1 | Low | 53 | Low | 149 Ų | 149 | 116.9 Ų | 116.9 | 78% | 0.78 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.6 | -15.4 | 176.8 | -79 | 168.2 | 0 | 0 | 0 | 114.2 | H92 | H92-L94 PolarHBondContact O-N 3.13Š|
| 95 | L | 53.8 | Low | 52.5 | Low | 121 Ų | 121 | 120.7 Ų | 120.7 | 63% | 0.634 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -94.8 | -12.1 | -178.8 | -68.2 | 174.5 | 0 | 0 | 0 | 114.1 | ||
| 96 | A | 53.8 | Low | 51.9 | Low | 66 Ų | 66 | 120 Ų | 120 | 55% | 0.545 | 70% | 0.698 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -76.8 | -27.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 97 | E | 52.2 | Low | 51 | Low | 163 Ų | 163 | 119.3 Ų | 119.3 | 76% | 0.762 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | -32.6 | -174.4 | -162.9 | 164.7 | 173 | 0 | 0 | 112.6 | ||
| 98 | S | 52.3 | Low | 50.5 | Low | 77 Ų | 77 | 128.9 Ų | 128.9 | 54% | 0.538 | 74% | 0.736 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82.9 | -14.2 | -179.2 | 61 | 0 | 0 | 0 | 0 | 114.8 | ||
| 99 | A | 52.7 | Low | 50.5 | Low | 70 Ų | 70 | 131.1 Ų | 131.1 | 58% | 0.579 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.2 | -19.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 100 | I | 55.4 | Low | 50.3 | Low | 143 Ų | 143 | 131.7 Ų | 131.7 | 73% | 0.733 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | -26.8 | -177.7 | -58.9 | 178.2 | 0 | 0 | 0 | 111.5 | ||
| 101 | E | 51.5 | Low | 50 | Low | 174 Ų | 174 | 128.4 Ų | 128.4 | 81% | 0.813 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.4 | -28.8 | -179.7 | -88.2 | -174.2 | 154.5 | 0 | 0 | 114 | ||
| 102 | A | 55.1 | Low | 49.7 | Very low | 87 Ų | 87 | 127.1 Ų | 127.1 | 72% | 0.719 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -6.5 | -170.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 103 | G | 50.1 | Low | 49.9 | Very low | 70 Ų | 70 | 126.7 Ų | 126.7 | 72% | 0.722 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.4 | -9.5 | -175.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 104 | H | 49.5 | Very low | 49.9 | Very low | 174 Ų | 174 | 128.7 Ų | 128.7 | 81% | 0.806 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -89.8 | 0 | -174.1 | -164.6 | 49.6 | 0 | 0 | 0 | 114.5 | ||
| 105 | E | 47.4 | Very low | 49.7 | Very low | 188 Ų | 188 | 127.3 Ų | 127.3 | 88% | 0.879 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -115.4 | 92.4 | 178.6 | -65.6 | -167.2 | 169.9 | 0 | 0 | 110.7 | ||
| 106 | G | 40.9 | Very low | 49.4 | Very low | 77 Ų | 77 | 127.8 Ų | 127.8 | 79% | 0.794 | 77% | 0.768 | S | S | * | * | trans | 163.3 | 38.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 107 | A | 36.6 | Very low | 49 | Very low | 98 Ų | 98 | 132.9 Ų | 132.9 | 81% | 0.81 | 79% | 0.786 | S | S | * | * | trans | -88.4 | 107.5 | 162.8 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 108 | E | 44.4 | Very low | 48.7 | Very low | 274 Ų | 274 | 130.2 Ų | 130.2 | 100% | 1.28 | 79% | 0.788 | S | S | * | * | trans | -154 | 0 | 145.7 | -68.9 | -156.6 | 160.7 | 0 | 0 | 109.8 |
Retrieved 108 of 108 residues in 134.2 ms
(Link to these results)