| 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 | 57.6 | Low | 68.5 | Low | 162 Ų | 162 | 92.6 Ų | 92.6 | 80% | 0.798 | 53% | 0.526 | S | S | * | . | 0 | 129 | 0 | -99.3 | 167.2 | -178 | 0 | 0 | 107.4 | Q15 L58 | M1-Q15 HydrophobicContact CE-CB 4.15Å; M1-Q15 HydrophobicContact SD-CB 3.87Å; M1-L58 HydrophobicContact SD-CD2 4.39Å | |||
| 2 | E | 64.6 | Low | 70 | Confident | 181 Ų | 181 | 88.9 Ų | 88.9 | 85% | 0.846 | 50% | 0.503 | S | S | * | . | trans | -87.5 | 147.4 | 168.2 | -72.8 | -175.9 | 145.2 | 0 | 0 | 109.4 | K4 | E2-K4 PolarHBondContact O-N 3.12Š| ||
| 3 | C | 69.2 | Low | 71.1 | Confident | 30 Ų | 30 | 83.4 Ų | 83.4 | 20% | 0.203 | 47% | 0.473 | C | S | . | . | trans | -61.8 | 125.2 | 172.2 | -56.1 | 0 | 0 | 0 | 0 | 108.8 | H5 T7 C13 | C3-H5 VanDerWaalsContact C-N 3.25Å; C3-H5 PolarHBondContact O-N 3.28Å; C3-T7 HydrophobicContact CB-CG2 4.14Å; C3-C13 WeakPolarHBondContact CA-SG 3.45Å; C3-C13 HydrophobicContact CB-CB 4.04Å; C3-C13 WeakPolarHBondContact CB-SG 3.46Å; C3-C13 WeakPolarHBondContact SG-CB 3.39Å; C3-C13 CovalentContact SG-SG 2.01Å; C3-C13 PolarHBondContact SG-SG 2.79Å | ||
| 4 | K | 65.7 | Low | 71.9 | Confident | 122 Ų | 122 | 81.6 Ų | 81.6 | 53% | 0.53 | 46% | 0.464 | S | S | . | . | S | Bend | trans | -72.2 | -19.2 | -176.5 | -81.7 | -177.9 | 169.1 | 178.7 | 0 | 113 | E2 L51 D56 L58 | E2-K4 PolarHBondContact O-N 3.12Å; K4-L51 HydrophobicContact CB-CD1 3.84Å; K4-D56 HydrophobicContact CD-CB 4.31Å; K4-D56 IonicContact NZ-OD1 2.69Å; K4-D56 PolarHBondContact NZ-OD1 2.85Å; K4-D56 IonicContact NZ-OD2 2.78Å; K4-D56 PolarHBondContact NZ-OD2 2.9Å; K4-L58 HydrophobicContact CB-CD1 3.87Å; K4-L58 HydrophobicContact CD-CD1 4.28Å; K4-L58 HydrophobicContact CG-CD1 3.87Å |
| 5 | H | 66 | Low | 72.3 | Confident | 47 Ų | 47 | 82.8 Ų | 82.8 | 22% | 0.218 | 47% | 0.465 | C | S | . | . | S | Bend | trans | -101.1 | 152.4 | 173.8 | 80.7 | 83.4 | 0 | 0 | 0 | 111.9 | C3 T7 V49 E60 | C3-H5 VanDerWaalsContact C-N 3.25Å; C3-H5 PolarHBondContact O-N 3.28Å; H5-T7 WeakPolarHBondContact CE1-CG2 3.4Å; H5-T7 VanDerWaalsContact ND1-CG2 3.31Å; H5-T7 WeakPolarHBondContact ND1-CG2 3.21Å; H5-T7 WeakPolarHBondContact O-CG2 3.39Å; H5-T7 PolarHBondContact O-N 3.12Å; H5-T7 VanDerWaalsContact O-N 3.15Å; H5-V49 VanDerWaalsContact NE2-CG2 3.34Å; H5-V49 WeakPolarHBondContact NE2-CG2 3.46Å; H5-E60 VanDerWaalsContact CD2-CD 3.41Å; H5-E60 IonicContact CD2-OE1 2.91Å; H5-E60 PolarHBondContact CD2-OE1 2.89Å; H5-E60 IonicContact CD2-OE2 3.75Å; H5-E60 IonicContact CE1-OE1 3.66Å; H5-E60 IonicContact CE1-OE2 3.19Å; H5-E60 PolarHBondContact CE1-OE2 3.32Å; H5-E60 IonicContact CG-OE1 3.69Å; H5-E60 IonicContact NE2-OE1 2.99Å; H5-E60 PolarHBondContact NE2-OE1 2.01Å; H5-E60 IonicContact NE2-OE2 2.89Å; H5-E60 PolarHBondContact NE2-OE2 2.99Å |
| 6 | S | 65.4 | Low | 72.6 | Confident | 128 Ų | 128 | 78.8 Ų | 78.8 | 90% | 0.895 | 45% | 0.445 | S | S | * | . | trans | -61.4 | 119.1 | 172.1 | -170.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 7 | T | 64.3 | Low | 72.8 | Confident | 33 Ų | 33 | 77.4 Ų | 77.4 | 20% | 0.202 | 45% | 0.445 | C | S | . | . | trans | -121.3 | 137.4 | -176.7 | 46.7 | 0 | 0 | 0 | 0 | 109.2 | C3 H5 P11 E60 | C3-T7 HydrophobicContact CB-CG2 4.14Å; H5-T7 WeakPolarHBondContact CE1-CG2 3.4Å; H5-T7 VanDerWaalsContact ND1-CG2 3.31Å; H5-T7 WeakPolarHBondContact ND1-CG2 3.21Å; H5-T7 WeakPolarHBondContact O-CG2 3.39Å; H5-T7 PolarHBondContact O-N 3.12Å; H5-T7 VanDerWaalsContact O-N 3.15Å; T7-P11 HydrophobicContact CG2-CG 3.46Å; T7-P11 VanDerWaalsContact CG2-CG 3.46Å; T7-P11 WeakPolarHBondContact OG1-CD 3.45Å; T7-E60 WeakPolarHBondContact CG2-OE2 3.32Å | ||
| 8 | T | 65.7 | Low | 73 | Confident | 149 Ų | 149 | 77.8 Ų | 77.8 | 91% | 0.914 | 44% | 0.439 | S | S | * | . | S | Bend | trans | -82.8 | 132.4 | 166.6 | 32.8 | 0 | 0 | 0 | 0 | 109 | ||
| 9 | G | 71.2 | Confident | 73.2 | Confident | 52 Ų | 52 | 77.3 Ų | 77.3 | 54% | 0.536 | 44% | 0.438 | S | S | . | . | S | Bend | trans | 88 | 6.2 | 173 | 0 | 0 | 0 | 0 | 0 | 116.8 | R66 | G9-R66 WeakPolarHBondContact O-CD 3.31Š|
| 10 | N | 78.7 | Confident | 73.4 | Confident | 88 Ų | 88 | 83.7 Ų | 83.7 | 47% | 0.471 | 46% | 0.461 | S | S | . | . | trans | 52.1 | 71.1 | 176.4 | -68.9 | -44.9 | 0 | 0 | 0 | 113.8 | R66 | N10-R66 VanDerWaalsContact CB-NE 3.28Å; N10-R66 VanDerWaalsContact CB-NH1 3.29Å; N10-R66 PolarHBondContact ND2-NH1 3.28Å; N10-R66 WeakPolarHBondContact O-CD 3.25Å; N10-R66 PolarHBondContact O-NE 3.03Å | ||
| 11 | P | 85.3 | Confident | 73.4 | Confident | 27 Ų | 27 | 81.8 Ų | 81.8 | 18% | 0.175 | 46% | 0.461 | C | S | . | . | trans | -66.6 | 170.9 | -179.6 | 27.2 | -27.9 | 0 | 0 | 0 | 112.2 | T7 E60 Y61 | T7-P11 HydrophobicContact CG2-CG 3.46Å; T7-P11 VanDerWaalsContact CG2-CG 3.46Å; T7-P11 WeakPolarHBondContact OG1-CD 3.45Å; P11-E60 HydrophobicContact CB-CB 4.41Å; P11-Y61 CarbonylContact C-O 3.55Å; P11-Y61 WeakPolarHBondContact CA-O 3.11Å; P11-Y61 WeakPolarHBondContact CB-O 3.19Å | ||
| 12 | I | 86.9 | Confident | 74.1 | Confident | 48 Ų | 48 | 81 Ų | 81 | 25% | 0.246 | 46% | 0.456 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.5 | 122 | 168.9 | -60.9 | 168.1 | 0 | 0 | 0 | 107 | V14 L33 L42 E60 Y61 | I12-V14 HydrophobicContact CG2-CG2 4.17Å; I12-L33 HydrophobicContact CG2-CD2 4.15Å; I12-L42 HydrophobicContact CD1-CB 4.31Å; I12-L42 WeakPolarHBondContact CD1-O 3.06Å; I12-E60 WeakPolarHBondContact O-CA 3.49Å; I12-Y61 PolarHBondContact N-O 3.19Å; I12-Y61 PolarHBondContact O-N 2.91Å |
| 13 | C | 83.6 | Confident | 74.5 | Confident | 17 Ų | 17 | 74.6 Ų | 74.6 | 12% | 0.115 | 43% | 0.426 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.8 | 124.5 | 178.1 | -72.3 | 0 | 0 | 0 | 0 | 111.1 | C3 L58 V59 E60 | C3-C13 WeakPolarHBondContact CA-SG 3.45Å; C3-C13 HydrophobicContact CB-CB 4.04Å; C3-C13 WeakPolarHBondContact CB-SG 3.46Å; C3-C13 WeakPolarHBondContact SG-CB 3.39Å; C3-C13 CovalentContact SG-SG 2.01Å; C3-C13 PolarHBondContact SG-SG 2.79Å; C13-L58 HydrophobicContact CB-CD2 4.49Å; C13-V59 WeakPolarHBondContact CA-O 3.34Å; C13-E60 VanDerWaalsContact SG-CG 3.59Å; C13-E60 PolarHBondContact SG-OE1 2.96Å; C13-E60 VanDerWaalsContact SG-OE1 3.32Å |
| 14 | V | 81.9 | Confident | 74.6 | Confident | 58 Ų | 58 | 76.6 Ų | 76.6 | 35% | 0.352 | 44% | 0.438 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.8 | 129.7 | -179.1 | -175.4 | 0 | 0 | 0 | 0 | 108.3 | I12 A16 L58 V59 Y61 | I12-V14 HydrophobicContact CG2-CG2 4.17Å; V14-A16 PolarHBondContact O-N 2.87Å; V14-L58 WeakPolarHBondContact O-CA 3.09Å; V14-V59 PolarHBondContact N-O 3.19Å; V14-V59 PolarHBondContact O-N 3.01Å; V14-Y61 HydrophobicContact CB-CE2 4Å; V14-Y61 HydrophobicContact CG2-CD2 4.05Å; V14-Y61 HydrophobicContact CG2-CE2 3.68Å |
| 15 | Q | 78.5 | Confident | 74.8 | Confident | 100 Ų | 100 | 75.1 Ų | 75.1 | 47% | 0.467 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.9 | 121.4 | 172.5 | -171 | 165.9 | 30.9 | 0 | 0 | 109.3 | M1 L58 | M1-Q15 HydrophobicContact CE-CB 4.15Å; M1-Q15 HydrophobicContact SD-CB 3.87Å; Q15-L58 HydrophobicContact CB-CD2 4.31Å |
| 16 | A | 77.4 | Confident | 75.2 | Confident | 19 Ų | 19 | 75.3 Ų | 75.3 | 16% | 0.157 | 45% | 0.454 | C | S | . | . | P | Polyproline II helix | trans | -94 | 147.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | V14 I23 V57 V59 | V14-A16 PolarHBondContact O-N 2.87Å; A16-I23 HydrophobicContact CB-CG2 3.46Å; A16-I23 VanDerWaalsContact CB-CG2 3.46Å; A16-V57 HydrophobicContact CB-CG1 4.34Å; A16-V57 PolarHBondContact N-O 2.98Å; A16-V59 HydrophobicContact CB-CG2 3.69Å |
| 17 | A | 76.7 | Confident | 76.1 | Confident | 54 Ų | 54 | 71.3 Ų | 71.3 | 45% | 0.446 | 43% | 0.433 | S | S | . | . | P | Polyproline II helix | trans | -76.2 | 134 | 169.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | V19 T24 | A17-V19 HydrophobicContact CB-CG2 4.05Å; A17-T24 HydrophobicContact CB-CG2 4.27Å; A17-T24 PolarHBondContact N-OG1 2.78Å; A17-T24 VanDerWaalsContact N-OG1 3.12Å; A17-T24 PolarHBondContact O-N 2.91Å; A17-T24 PolarHBondContact O-OG1 2.69Å |
| 18 | Y | 75.5 | Confident | 77.2 | Confident | 85 Ų | 85 | 76.4 Ų | 76.4 | 33% | 0.333 | 46% | 0.459 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.1 | 111.1 | 170.7 | -169.4 | -105.1 | 0 | 0 | 0 | 109 | G21 Q22 I23 R54 | Y18-G21 VanDerWaalsContact CE2-C 3.44Å; Y18-G21 VanDerWaalsContact CE2-O 3.25Å; Y18-G21 WeakPolarHBondContact CE2-O 3.37Å; Y18-G21 WeakPolarHBondContact OH-CA 3.44Å; Y18-G21 PolarHBondContact OH-O 3.38Å; Y18-Q22 WeakPolarHBondContact CA-O 3.39Å; Y18-I23 HydrophobicContact CD2-CG1 4.15Å; Y18-I23 HydrophobicContact CE2-CG1 4.48Å; Y18-R54 HydrophobicContact CE1-CB 4.45Å; Y18-R54 HydrophobicContact CE1-CG 4.15Å; Y18-R54 PolarHBondContact OH-NE 3.17Å |
| 19 | V | 76.8 | Confident | 78.3 | Confident | 69 Ų | 69 | 73.5 Ų | 73.5 | 42% | 0.418 | 45% | 0.445 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.3 | 125.5 | -174.5 | -167.3 | 0 | 0 | 0 | 0 | 108.6 | A17 G21 Q22 T24 | A17-V19 HydrophobicContact CB-CG2 4.05Å; V19-G21 VanDerWaalsContact C-N 3.27Å; V19-G21 PolarHBondContact O-N 3.3Å; V19-G21 VanDerWaalsContact O-N 3.17Å; V19-Q22 PolarHBondContact N-O 2.99Å; V19-Q22 PolarHBondContact O-N 3.03Å; V19-Q22 VanDerWaalsContact O-O 3.11Å; V19-T24 HydrophobicContact CG2-CG2 4.46Å |
| 20 | F | 78.3 | Confident | 79.3 | Confident | 204 Ų | 204 | 73.5 Ų | 73.5 | 90% | 0.895 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.4 | 40.3 | 179.8 | -60.5 | -64.6 | 0 | 0 | 0 | 115.3 | Q22 | F20-Q22 PolarHBondContact O-N 3.02Š|
| 21 | G | 72.7 | Confident | 79.9 | Confident | 45 Ų | 45 | 70.1 Ų | 70.1 | 46% | 0.464 | 43% | 0.43 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 86.7 | -8.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y18 V19 | Y18-G21 VanDerWaalsContact CE2-C 3.44Å; Y18-G21 VanDerWaalsContact CE2-O 3.25Å; Y18-G21 WeakPolarHBondContact CE2-O 3.37Å; Y18-G21 WeakPolarHBondContact OH-CA 3.44Å; Y18-G21 PolarHBondContact OH-O 3.38Å; V19-G21 VanDerWaalsContact C-N 3.27Å; V19-G21 PolarHBondContact O-N 3.3Å; V19-G21 VanDerWaalsContact O-N 3.17Å |
| 22 | Q | 71.4 | Confident | 80.3 | Confident | 146 Ų | 146 | 72.8 Ų | 72.8 | 68% | 0.682 | 45% | 0.448 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -110.7 | 146.6 | -178.9 | -67.7 | -173.8 | -52.2 | 0 | 0 | 111.4 | Y18 V19 F20 | Y18-Q22 WeakPolarHBondContact CA-O 3.39Å; V19-Q22 PolarHBondContact N-O 2.99Å; V19-Q22 PolarHBondContact O-N 3.03Å; V19-Q22 VanDerWaalsContact O-O 3.11Å; F20-Q22 PolarHBondContact O-N 3.02Å |
| 23 | I | 73.6 | Confident | 80.5 | Confident | 46 Ų | 46 | 72.2 Ų | 72.2 | 24% | 0.236 | 45% | 0.445 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79 | 129.8 | 167 | -55 | 169.4 | 0 | 0 | 0 | 105.4 | A16 Y18 A25 T50 V57 V59 | A16-I23 HydrophobicContact CB-CG2 3.46Å; A16-I23 VanDerWaalsContact CB-CG2 3.46Å; Y18-I23 HydrophobicContact CD2-CG1 4.15Å; Y18-I23 HydrophobicContact CE2-CG1 4.48Å; I23-A25 PolarHBondContact O-N 3.08Å; I23-T50 HydrophobicContact CD1-CG2 3.29Å; I23-V57 HydrophobicContact CB-CG1 4.43Å; I23-V57 HydrophobicContact CD1-CG1 3.43Å; I23-V57 VanDerWaalsContact CD1-CG1 3.43Å; I23-V57 HydrophobicContact CD1-CG2 4.48Å; I23-V57 HydrophobicContact CG1-CG1 3.74Å; I23-V57 HydrophobicContact CG1-CG2 4.47Å; I23-V57 HydrophobicContact CG2-CG1 3.83Å; I23-V59 HydrophobicContact CG2-CG2 4.12Å |
| 24 | T | 71.7 | Confident | 80.9 | Confident | 72 Ų | 72 | 74.6 Ų | 74.6 | 44% | 0.442 | 46% | 0.456 | S | S | . | . | trans | -50.2 | 114.8 | 172.6 | 22.7 | 0 | 0 | 0 | 0 | 108.2 | A17 V19 P26 | A17-T24 HydrophobicContact CB-CG2 4.27Å; A17-T24 PolarHBondContact N-OG1 2.78Å; A17-T24 VanDerWaalsContact N-OG1 3.12Å; A17-T24 PolarHBondContact O-N 2.91Å; A17-T24 PolarHBondContact O-OG1 2.69Å; V19-T24 HydrophobicContact CG2-CG2 4.46Å; T24-P26 WeakPolarHBondContact O-CD 3.4Å; T24-P26 VanDerWaalsContact O-N 3.11Å | ||
| 25 | A | 68.9 | Low | 81.1 | Confident | 91 Ų | 91 | 82.4 Ų | 82.4 | 75% | 0.752 | 48% | 0.479 | S | S | * | . | trans | -54.6 | 119.6 | -164.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | I23 G27 | I23-A25 PolarHBondContact O-N 3.08Å; A25-G27 PolarHBondContact O-N 3.02Å | ||
| 26 | P | 75.8 | Confident | 81.7 | Confident | 50 Ų | 50 | 80.2 Ų | 80.2 | 33% | 0.325 | 48% | 0.475 | S | S | . | . | trans | -71.7 | 1.6 | -175.9 | 29 | -35 | 0 | 0 | 0 | 113.6 | T24 V45 V59 | T24-P26 WeakPolarHBondContact O-CD 3.4Å; T24-P26 VanDerWaalsContact O-N 3.11Å; P26-V45 WeakPolarHBondContact O-CG2 3.43Å; P26-V59 HydrophobicContact CB-CB 4.24Å; P26-V59 HydrophobicContact CB-CG1 3.37Å; P26-V59 HydrophobicContact CB-CG2 3.97Å; P26-V59 HydrophobicContact CG-CG1 3.95Å; P26-V59 HydrophobicContact CG-CG2 4.26Å | ||
| 27 | G | 83.6 | Confident | 82.2 | Confident | 45 Ų | 45 | 84.6 Ų | 84.6 | 46% | 0.464 | 50% | 0.502 | S | S | . | . | trans | 104.4 | -171.9 | -169.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | A25 | A25-G27 PolarHBondContact O-N 3.02Š| ||
| 28 | D | 86.8 | Confident | 82.9 | Confident | 139 Ų | 139 | 90.4 Ų | 90.4 | 74% | 0.743 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -87.6 | 146.9 | -179.9 | -59.4 | -47.1 | 0 | 0 | 0 | 111.2 | G30 G31 V45 | D28-G30 PolarHBondContact O-N 3.24Å; D28-G31 WeakPolarHBondContact O-CA 3.05Å; D28-G31 PolarHBondContact O-N 3.49Å; D28-V45 WeakPolarHBondContact O-CB 3.21Å; D28-V45 WeakPolarHBondContact O-CG1 3.49Å |
| 29 | S | 89.3 | Confident | 83.7 | Confident | 88 Ų | 88 | 87.3 Ų | 87.3 | 62% | 0.615 | 51% | 0.514 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.8 | 127.2 | 176.5 | -173.1 | 0 | 0 | 0 | 0 | 111.3 | G31 | S29-G31 VanDerWaalsContact C-N 3.29Š|
| 30 | G | 91.6 | Very high | 84.4 | Confident | 52 Ų | 52 | 88.5 Ų | 88.5 | 54% | 0.536 | 52% | 0.523 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.1 | -5.1 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | D28 V45 | D28-G30 PolarHBondContact O-N 3.24Å; G30-V45 PolarHBondContact N-O 2.89Å |
| 31 | G | 92.4 | Very high | 85.1 | Confident | 17 Ų | 17 | 82 Ų | 82 | 18% | 0.175 | 50% | 0.5 | C | S | . | . | trans | -71.2 | 161 | 177 | 0 | 0 | 0 | 0 | 0 | 113.5 | D28 S29 V44 V45 | D28-G31 WeakPolarHBondContact O-CA 3.05Å; D28-G31 PolarHBondContact O-N 3.49Å; S29-G31 VanDerWaalsContact C-N 3.29Å; G31-V44 CarbonylContact O-C 3.59Å; G31-V44 WeakPolarHBondContact O-CA 3.3Å; G31-V45 WeakPolarHBondContact O-CG2 3.15Å; G31-V45 PolarHBondContact O-N 2.94Å | ||
| 32 | P | 93.2 | Very high | 86.1 | Confident | 83 Ų | 83 | 83.2 Ų | 83.2 | 54% | 0.539 | 50% | 0.495 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.4 | 138.1 | -177.6 | 33 | -34.4 | 0 | 0 | 0 | 112.7 | L34 V41 | P32-L34 HydrophobicContact CB-CD2 3.93Å; P32-L34 HydrophobicContact CB-CG 4.07Å; P32-L34 HydrophobicContact CG-CD1 4.44Å; P32-L34 HydrophobicContact CG-CG 4.35Å; P32-V41 HydrophobicContact CB-CG1 3.96Å; P32-V41 HydrophobicContact CB-CG2 4.44Å |
| 33 | L | 90.8 | Very high | 87.1 | Confident | 36 Ų | 36 | 76.2 Ų | 76.2 | 19% | 0.188 | 46% | 0.463 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.4 | 113.5 | 160.3 | 177.3 | 65.8 | 0 | 0 | 0 | 109 | I12 L42 G43 Y61 | I12-L33 HydrophobicContact CG2-CD2 4.15Å; L33-L42 PolarHBondContact O-N 2.92Å; L33-G43 PolarHBondContact N-O 3.3Å; L33-G43 PolarHBondContact O-N 2.86Å; L33-Y61 HydrophobicContact CB-CD1 3.7Å; L33-Y61 HydrophobicContact CB-CE1 3.93Å; L33-Y61 HydrophobicContact CB-CG 4.31Å; L33-Y61 HydrophobicContact CD1-CD1 4.47Å; L33-Y61 HydrophobicContact CD1-CE1 3.98Å; L33-Y61 HydrophobicContact CD2-CD1 3.95Å; L33-Y61 HydrophobicContact CD2-CD2 3.86Å; L33-Y61 HydrophobicContact CD2-CE1 4.21Å; L33-Y61 HydrophobicContact CD2-CE2 4.16Å; L33-Y61 HydrophobicContact CD2-CG 3.76Å; L33-Y61 HydrophobicContact CG-CD1 4.24Å; L33-Y61 HydrophobicContact CG-CE1 4.25Å |
| 34 | L | 91.4 | Very high | 87.9 | Confident | 67 Ų | 67 | 76.5 Ų | 76.5 | 35% | 0.351 | 47% | 0.467 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.3 | 146.7 | -177.9 | -55.2 | 179.2 | 0 | 0 | 0 | 111.1 | P32 S36 V41 | P32-L34 HydrophobicContact CB-CD2 3.93Å; P32-L34 HydrophobicContact CB-CG 4.07Å; P32-L34 HydrophobicContact CG-CD1 4.44Å; P32-L34 HydrophobicContact CG-CG 4.35Å; L34-S36 WeakPolarHBondContact CB-O 3.34Å; L34-V41 HydrophobicContact CD2-CB 4.3Å; L34-V41 HydrophobicContact CD2-CG2 3.93Å |
| 35 | R | 87.2 | Confident | 88.8 | Confident | 222 Ų | 222 | 73.6 Ų | 73.6 | 84% | 0.838 | 45% | 0.449 | S | S | * | . | S | Bend | trans | -77.4 | -29.4 | 168.9 | -166.2 | 177.3 | -179.3 | -165.6 | -0.2 | 112.5 | L42 | R35-L42 HydrophobicContact CB-CD1 4.07Š|
| 36 | S | 90.8 | Very high | 89.4 | Confident | 55 Ų | 55 | 72.3 Ų | 72.3 | 39% | 0.385 | 43% | 0.434 | S | S | . | . | S | Bend | trans | -154 | 160.6 | 179.3 | 59.6 | 0 | 0 | 0 | 0 | 109.1 | L34 Q38 G39 | L34-S36 WeakPolarHBondContact CB-O 3.34Å; S36-Q38 PolarHBondContact O-N 3.35Å; S36-Q38 VanDerWaalsContact O-N 3.12Å; S36-G39 PolarHBondContact O-N 3.06Å; S36-G39 WeakPolarHBondContact OG-CA 3.13Å; S36-G39 PolarHBondContact OG-N 2.88Å |
| 37 | P | 89 | Confident | 89.2 | Confident | 111 Ų | 111 | 77.9 Ų | 77.9 | 72% | 0.721 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.3 | -31.9 | -174.5 | -28.1 | 36 | 0 | 0 | 0 | 115.2 | ||
| 38 | Q | 90.9 | Very high | 88.3 | Confident | 176 Ų | 176 | 77.5 Ų | 77.5 | 82% | 0.822 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.1 | 12.8 | 175.2 | -55.4 | 86.5 | 4 | 0 | 0 | 113.2 | S36 | S36-Q38 PolarHBondContact O-N 3.35Å; S36-Q38 VanDerWaalsContact O-N 3.12Å |
| 39 | G | 91 | Very high | 86.8 | Confident | 19 Ų | 19 | 74.3 Ų | 74.3 | 20% | 0.196 | 44% | 0.437 | C | S | . | . | S | Bend | trans | -77.9 | 169.8 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | S36 | S36-G39 PolarHBondContact O-N 3.06Å; S36-G39 WeakPolarHBondContact OG-CA 3.13Å; S36-G39 PolarHBondContact OG-N 2.88Å |
| 40 | P | 91.9 | Very high | 85.2 | Confident | 95 Ų | 95 | 74.5 Ų | 74.5 | 62% | 0.617 | 44% | 0.435 | S | S | * | . | trans | -64.3 | 148.9 | 174.4 | 28.7 | -35 | 0 | 0 | 0 | 111.3 | L42 | P40-L42 HydrophobicContact CG-CD2 4.26Å; P40-L42 PolarHBondContact O-N 2.85Å | ||
| 41 | V | 93.6 | Very high | 83.4 | Confident | 68 Ų | 68 | 75.2 Ų | 75.2 | 41% | 0.412 | 43% | 0.426 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.1 | 112.4 | 171.7 | -169.3 | 0 | 0 | 0 | 0 | 108.9 | P32 L34 G43 V64 | P32-V41 HydrophobicContact CB-CG1 3.96Å; P32-V41 HydrophobicContact CB-CG2 4.44Å; L34-V41 HydrophobicContact CD2-CB 4.3Å; L34-V41 HydrophobicContact CD2-CG2 3.93Å; V41-G43 WeakPolarHBondContact CG1-O 3.16Å; V41-V64 HydrophobicContact CB-CG2 4.43Å; V41-V64 HydrophobicContact CG1-CG2 3.86Å; V41-V64 WeakPolarHBondContact O-CB 3.44Å |
| 42 | L | 92.8 | Very high | 81.7 | Confident | 69 Ų | 69 | 80.7 Ų | 80.7 | 36% | 0.361 | 46% | 0.461 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.3 | -41.6 | -179.1 | -59.5 | -176.1 | 0 | 0 | 0 | 111.3 | I12 L33 R35 P40 V64 | I12-L42 HydrophobicContact CD1-CB 4.31Å; I12-L42 WeakPolarHBondContact CD1-O 3.06Å; L33-L42 PolarHBondContact O-N 2.92Å; R35-L42 HydrophobicContact CB-CD1 4.07Å; P40-L42 HydrophobicContact CG-CD2 4.26Å; P40-L42 PolarHBondContact O-N 2.85Å; L42-V64 PolarHBondContact O-N 2.86Å |
| 43 | G | 92 | Very high | 79.9 | Confident | 0 Ų | 0 | 81.8 Ų | 81.8 | 0% | 0 | 46% | 0.463 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149 | 171.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L33 V41 A62 | L33-G43 PolarHBondContact N-O 3.3Å; L33-G43 PolarHBondContact O-N 2.86Å; V41-G43 WeakPolarHBondContact CG1-O 3.16Å; G43-A62 CarbonylContact C-O 3.49Å; G43-A62 WeakPolarHBondContact CA-O 2.96Å |
| 44 | V | 92.3 | Very high | 78.3 | Confident | 52 Ų | 52 | 88.1 Ų | 88.1 | 32% | 0.315 | 48% | 0.484 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.9 | 129.1 | 174.2 | -179.2 | 0 | 0 | 0 | 0 | 107.8 | G31 S46 Y61 A62 V64 | G31-V44 CarbonylContact O-C 3.59Å; G31-V44 WeakPolarHBondContact O-CA 3.3Å; V44-S46 PolarHBondContact O-N 2.81Å; V44-Y61 CarbonylContact O-C 3.47Å; V44-Y61 VanDerWaalsContact O-CA 3.3Å; V44-Y61 WeakPolarHBondContact O-CA 3.46Å; V44-A62 HydrophobicContact CB-CB 4.44Å; V44-A62 PolarHBondContact N-O 2.93Å; V44-A62 PolarHBondContact O-N 3.25Å; V44-V64 HydrophobicContact CG2-CG2 3.89Å |
| 45 | V | 89.6 | Confident | 76.8 | Confident | 11 Ų | 11 | 91.9 Ų | 91.9 | 7% | 0.067 | 50% | 0.504 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -56.4 | 125.5 | 176.6 | 179.3 | 0 | 0 | 0 | 0 | 108.3 | P26 D28 G30 G31 Y61 | P26-V45 WeakPolarHBondContact O-CG2 3.43Å; D28-V45 WeakPolarHBondContact O-CB 3.21Å; D28-V45 WeakPolarHBondContact O-CG1 3.49Å; G30-V45 PolarHBondContact N-O 2.89Å; G31-V45 WeakPolarHBondContact O-CG2 3.15Å; G31-V45 PolarHBondContact O-N 2.94Å; V45-Y61 HydrophobicContact CB-CD1 4.38Å; V45-Y61 HydrophobicContact CB-CE1 4.45Å; V45-Y61 HydrophobicContact CG2-CD1 3.97Å; V45-Y61 HydrophobicContact CG2-CE1 3.71Å |
| 46 | S | 82.5 | Confident | 75.8 | Confident | 64 Ų | 64 | 83.9 Ų | 83.9 | 45% | 0.448 | 48% | 0.478 | S | S | . | . | trans | -124.5 | 172.6 | 174.2 | -159.5 | 0 | 0 | 0 | 0 | 109.9 | V44 G48 | V44-S46 PolarHBondContact O-N 2.81Å; S46-G48 PolarHBondContact O-N 2.92Å | ||
| 47 | H | 71.6 | Confident | 74.8 | Confident | 166 Ų | 166 | 81.6 Ų | 81.6 | 77% | 0.769 | 46% | 0.462 | S | S | * | . | trans | -64.7 | 111.1 | 171.1 | -78.8 | 107.7 | 0 | 0 | 0 | 109 | ||||
| 48 | G | 63.5 | Low | 74.2 | Confident | 37 Ų | 37 | 77.1 Ų | 77.1 | 38% | 0.381 | 43% | 0.431 | S | S | . | . | trans | -76.8 | 147.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | S46 | S46-G48 PolarHBondContact O-N 2.92Š| ||
| 49 | V | 56.2 | Low | 73.7 | Confident | 72 Ų | 72 | 69.2 Ų | 69.2 | 44% | 0.436 | 40% | 0.395 | S | S | . | . | trans | -83.5 | 114.1 | 168.1 | 178.6 | 0 | 0 | 0 | 0 | 108.6 | H5 L51 | H5-V49 VanDerWaalsContact NE2-CG2 3.34Å; H5-V49 WeakPolarHBondContact NE2-CG2 3.46Å; V49-L51 HydrophobicContact CG1-CD2 4.38Å; V49-L51 PolarHBondContact O-N 3.04Å | ||
| 50 | T | 55.4 | Low | 73.3 | Confident | 93 Ų | 93 | 69.1 Ų | 69.1 | 57% | 0.571 | 39% | 0.39 | S | S | * | . | trans | -76.8 | 103.2 | 169.8 | 48 | 0 | 0 | 0 | 0 | 109.7 | I23 | I23-T50 HydrophobicContact CD1-CG2 3.29Š| ||
| 51 | L | 54 | Low | 73.1 | Confident | 66 Ų | 66 | 65.5 Ų | 65.5 | 35% | 0.346 | 36% | 0.364 | S | S | . | . | trans | -67.7 | 134.8 | 170.4 | -66.2 | 171.5 | 0 | 0 | 0 | 109.3 | K4 V49 N53 | K4-L51 HydrophobicContact CB-CD1 3.84Å; V49-L51 HydrophobicContact CG1-CD2 4.38Å; V49-L51 PolarHBondContact O-N 3.04Å; L51-N53 PolarHBondContact O-N 3.35Å | ||
| 52 | S | 55.7 | Low | 72.9 | Confident | 132 Ų | 132 | 64.2 Ų | 64.2 | 92% | 0.923 | 36% | 0.36 | S | S | * | . | S | Bend | trans | -60.1 | -8.9 | -170.7 | -47.7 | 0 | 0 | 0 | 0 | 115.3 | ||
| 53 | N | 56.9 | Low | 72.8 | Confident | 107 Ų | 107 | 61.5 Ų | 61.5 | 57% | 0.572 | 35% | 0.347 | S | S | * | . | S | Bend | trans | -96.5 | 104.2 | 176.9 | -154.1 | -2.5 | 0 | 0 | 0 | 110.3 | L51 L55 D56 | L51-N53 PolarHBondContact O-N 3.35Å; N53-L55 PolarHBondContact O-N 3.29Å; N53-D56 PolarHBondContact O-N 2.84Å; N53-D56 VanDerWaalsContact O-N 3.08Å |
| 54 | R | 56.4 | Low | 72.8 | Confident | 168 Ų | 168 | 63.1 Ų | 63.1 | 63% | 0.634 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.5 | -18.4 | -169.8 | -76.6 | -177.7 | 166.9 | 131.4 | 1 | 116.1 | Y18 | Y18-R54 HydrophobicContact CE1-CB 4.45Å; Y18-R54 HydrophobicContact CE1-CG 4.15Å; Y18-R54 PolarHBondContact OH-NE 3.17Å |
| 55 | L | 59.6 | Low | 72.8 | Confident | 146 Ų | 146 | 64.1 Ų | 64.1 | 76% | 0.764 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.7 | -13.8 | -177.6 | -65.6 | 173.1 | 0 | 0 | 0 | 113.8 | N53 | N53-L55 PolarHBondContact O-N 3.29Š|
| 56 | D | 66.6 | Low | 72.7 | Confident | 54 Ų | 54 | 70.7 Ų | 70.7 | 29% | 0.289 | 39% | 0.394 | S | S | . | . | trans | -121.3 | 35.1 | -173.1 | -79.1 | -44.9 | 0 | 0 | 0 | 112.5 | K4 N53 L58 | K4-D56 HydrophobicContact CD-CB 4.31Å; K4-D56 IonicContact NZ-OD1 2.69Å; K4-D56 PolarHBondContact NZ-OD1 2.85Å; K4-D56 IonicContact NZ-OD2 2.78Å; K4-D56 PolarHBondContact NZ-OD2 2.9Å; N53-D56 PolarHBondContact O-N 2.84Å; N53-D56 VanDerWaalsContact O-N 3.08Å; D56-L58 PolarHBondContact O-N 3.06Å | ||
| 57 | V | 69.8 | Low | 73.1 | Confident | 8 Ų | 8 | 71.5 Ų | 71.5 | 5% | 0.048 | 39% | 0.392 | C | S | . | . | trans | -68.7 | 111.8 | 176.6 | -177.9 | 0 | 0 | 0 | 0 | 109.2 | A16 I23 | A16-V57 HydrophobicContact CB-CG1 4.34Å; A16-V57 PolarHBondContact N-O 2.98Å; I23-V57 HydrophobicContact CB-CG1 4.43Å; I23-V57 HydrophobicContact CD1-CG1 3.43Å; I23-V57 VanDerWaalsContact CD1-CG1 3.43Å; I23-V57 HydrophobicContact CD1-CG2 4.48Å; I23-V57 HydrophobicContact CG1-CG1 3.74Å; I23-V57 HydrophobicContact CG1-CG2 4.47Å; I23-V57 HydrophobicContact CG2-CG1 3.83Å | ||
| 58 | L | 75.5 | Confident | 74 | Confident | 17 Ų | 17 | 68.1 Ų | 68.1 | 9% | 0.089 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 133.7 | 168.6 | -67 | 168.5 | 0 | 0 | 0 | 108.4 | M1 K4 C13 V14 Q15 D56 | M1-L58 HydrophobicContact SD-CD2 4.39Å; K4-L58 HydrophobicContact CB-CD1 3.87Å; K4-L58 HydrophobicContact CD-CD1 4.28Å; K4-L58 HydrophobicContact CG-CD1 3.87Å; C13-L58 HydrophobicContact CB-CD2 4.49Å; V14-L58 WeakPolarHBondContact O-CA 3.09Å; Q15-L58 HydrophobicContact CB-CD2 4.31Å; D56-L58 PolarHBondContact O-N 3.06Å |
| 59 | V | 79.9 | Confident | 75.4 | Confident | 10 Ų | 10 | 68.7 Ų | 68.7 | 6% | 0.061 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.3 | 131.3 | 164.9 | 176 | 0 | 0 | 0 | 0 | 107.4 | C13 V14 A16 I23 P26 Y61 | C13-V59 WeakPolarHBondContact CA-O 3.34Å; V14-V59 PolarHBondContact N-O 3.19Å; V14-V59 PolarHBondContact O-N 3.01Å; A16-V59 HydrophobicContact CB-CG2 3.69Å; I23-V59 HydrophobicContact CG2-CG2 4.12Å; P26-V59 HydrophobicContact CB-CB 4.24Å; P26-V59 HydrophobicContact CB-CG1 3.37Å; P26-V59 HydrophobicContact CB-CG2 3.97Å; P26-V59 HydrophobicContact CG-CG1 3.95Å; P26-V59 HydrophobicContact CG-CG2 4.26Å; V59-Y61 HydrophobicContact CB-CE2 3.93Å; V59-Y61 HydrophobicContact CG1-CD2 4.07Å; V59-Y61 HydrophobicContact CG1-CE1 4.31Å; V59-Y61 HydrophobicContact CG1-CE2 3.38Å |
| 60 | E | 83 | Confident | 77.2 | Confident | 17 Ų | 17 | 71.7 Ų | 71.7 | 8% | 0.079 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.4 | 135.2 | 179.3 | -49.8 | -152.9 | 153.8 | 0 | 0 | 111.2 | H5 T7 P11 I12 C13 | H5-E60 VanDerWaalsContact CD2-CD 3.41Å; H5-E60 IonicContact CD2-OE1 2.91Å; H5-E60 PolarHBondContact CD2-OE1 2.89Å; H5-E60 IonicContact CD2-OE2 3.75Å; H5-E60 IonicContact CE1-OE1 3.66Å; H5-E60 IonicContact CE1-OE2 3.19Å; H5-E60 PolarHBondContact CE1-OE2 3.32Å; H5-E60 IonicContact CG-OE1 3.69Å; H5-E60 IonicContact NE2-OE1 2.99Å; H5-E60 PolarHBondContact NE2-OE1 2.01Å; H5-E60 IonicContact NE2-OE2 2.89Å; H5-E60 PolarHBondContact NE2-OE2 2.99Å; T7-E60 WeakPolarHBondContact CG2-OE2 3.32Å; P11-E60 HydrophobicContact CB-CB 4.41Å; I12-E60 WeakPolarHBondContact O-CA 3.49Å; C13-E60 VanDerWaalsContact SG-CG 3.59Å; C13-E60 PolarHBondContact SG-OE1 2.96Å; C13-E60 VanDerWaalsContact SG-OE1 3.32Å |
| 61 | Y | 87.9 | Confident | 78.9 | Confident | 18 Ų | 18 | 70.7 Ų | 70.7 | 7% | 0.071 | 39% | 0.386 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.7 | 139.1 | 176.6 | -55.4 | -103.7 | 0 | 0 | 0 | 108.9 | P11 I12 V14 L33 V44 V45 V59 S63 | P11-Y61 CarbonylContact C-O 3.55Å; P11-Y61 WeakPolarHBondContact CA-O 3.11Å; P11-Y61 WeakPolarHBondContact CB-O 3.19Å; I12-Y61 PolarHBondContact N-O 3.19Å; I12-Y61 PolarHBondContact O-N 2.91Å; V14-Y61 HydrophobicContact CB-CE2 4Å; V14-Y61 HydrophobicContact CG2-CD2 4.05Å; V14-Y61 HydrophobicContact CG2-CE2 3.68Å; L33-Y61 HydrophobicContact CB-CD1 3.7Å; L33-Y61 HydrophobicContact CB-CE1 3.93Å; L33-Y61 HydrophobicContact CB-CG 4.31Å; L33-Y61 HydrophobicContact CD1-CD1 4.47Å; L33-Y61 HydrophobicContact CD1-CE1 3.98Å; L33-Y61 HydrophobicContact CD2-CD1 3.95Å; L33-Y61 HydrophobicContact CD2-CD2 3.86Å; L33-Y61 HydrophobicContact CD2-CE1 4.21Å; L33-Y61 HydrophobicContact CD2-CE2 4.16Å; L33-Y61 HydrophobicContact CD2-CG 3.76Å; L33-Y61 HydrophobicContact CG-CD1 4.24Å; L33-Y61 HydrophobicContact CG-CE1 4.25Å; V44-Y61 CarbonylContact O-C 3.47Å; V44-Y61 VanDerWaalsContact O-CA 3.3Å; V44-Y61 WeakPolarHBondContact O-CA 3.46Å; V45-Y61 HydrophobicContact CB-CD1 4.38Å; V45-Y61 HydrophobicContact CB-CE1 4.45Å; V45-Y61 HydrophobicContact CG2-CD1 3.97Å; V45-Y61 HydrophobicContact CG2-CE1 3.71Å; V59-Y61 HydrophobicContact CB-CE2 3.93Å; V59-Y61 HydrophobicContact CG1-CD2 4.07Å; V59-Y61 HydrophobicContact CG1-CE1 4.31Å; V59-Y61 HydrophobicContact CG1-CE2 3.38Å; Y61-S63 PolarHBondContact O-N 3.15Å |
| 62 | A | 89.4 | Confident | 80.8 | Confident | 41 Ų | 41 | 70.7 Ų | 70.7 | 34% | 0.339 | 39% | 0.392 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.2 | 126.5 | 170.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | G43 V44 V64 | G43-A62 CarbonylContact C-O 3.49Å; G43-A62 WeakPolarHBondContact CA-O 2.96Å; V44-A62 HydrophobicContact CB-CB 4.44Å; V44-A62 PolarHBondContact N-O 2.93Å; V44-A62 PolarHBondContact O-N 3.25Å; A62-V64 PolarHBondContact O-N 3.4Å |
| 63 | S | 91 | Very high | 82.8 | Confident | 12 Ų | 12 | 69 Ų | 69 | 8% | 0.084 | 38% | 0.38 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.2 | 116.7 | -177.7 | -177.5 | 0 | 0 | 0 | 0 | 111.3 | Y61 A65 R66 M67 | Y61-S63 PolarHBondContact O-N 3.15Å; S63-A65 VanDerWaalsContact C-N 3.34Å; S63-R66 PolarHBondContact O-N 2.94Å; S63-M67 PolarHBondContact O-N 3.2Å |
| 64 | V | 92.3 | Very high | 84.6 | Confident | 35 Ų | 35 | 69.2 Ų | 69.2 | 21% | 0.212 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -65.2 | -40.7 | 176.5 | 172 | 0 | 0 | 0 | 0 | 110.8 | V41 L42 V44 A62 R66 M67 L68 | V41-V64 HydrophobicContact CB-CG2 4.43Å; V41-V64 HydrophobicContact CG1-CG2 3.86Å; V41-V64 WeakPolarHBondContact O-CB 3.44Å; L42-V64 PolarHBondContact O-N 2.86Å; V44-V64 HydrophobicContact CG2-CG2 3.89Å; A62-V64 PolarHBondContact O-N 3.4Å; V64-R66 PolarHBondContact O-N 2.93Å; V64-M67 CarbonylContact O-C 3.57Å; V64-M67 PolarHBondContact O-N 3.33Å; V64-L68 HydrophobicContact CG1-CD1 4.25Å; V64-L68 PolarHBondContact O-N 3Å |
| 65 | A | 91.4 | Very high | 86.1 | Confident | 73 Ų | 73 | 70.2 Ų | 70.2 | 60% | 0.603 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -57.5 | -34.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | S63 | S63-A65 VanDerWaalsContact C-N 3.34Å |
| 66 | R | 89.2 | Confident | 87.4 | Confident | 149 Ų | 149 | 66.4 Ų | 66.4 | 56% | 0.562 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -79.2 | -26 | 177.8 | -65.1 | -176.4 | -176.6 | -103.6 | 8.2 | 113.3 | G9 N10 S63 V64 | G9-R66 WeakPolarHBondContact O-CD 3.31Å; N10-R66 VanDerWaalsContact CB-NE 3.28Å; N10-R66 VanDerWaalsContact CB-NH1 3.29Å; N10-R66 PolarHBondContact ND2-NH1 3.28Å; N10-R66 WeakPolarHBondContact O-CD 3.25Å; N10-R66 PolarHBondContact O-NE 3.03Å; S63-R66 PolarHBondContact O-N 2.94Å; V64-R66 PolarHBondContact O-N 2.93Å |
| 67 | M | 90.7 | Very high | 88.5 | Confident | 81 Ų | 81 | 67.1 Ų | 67.1 | 40% | 0.399 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -91.9 | -1.9 | 176.8 | -116.6 | 60.1 | 80.3 | 0 | 0 | 113.5 | S63 V64 G69 F70 V71 | S63-M67 PolarHBondContact O-N 3.2Å; V64-M67 CarbonylContact O-C 3.57Å; V64-M67 PolarHBondContact O-N 3.33Å; M67-G69 VanDerWaalsContact C-N 3.29Å; M67-G69 PolarHBondContact O-N 2.87Å; M67-F70 HydrophobicContact CG-CB 4.43Å; M67-F70 HydrophobicContact CG-CD1 4.38Å; M67-F70 WeakPolarHBondContact O-CB 3.5Å; M67-F70 PolarHBondContact O-N 3.05Å; M67-V71 HydrophobicContact CB-CG2 4.43Å; M67-V71 WeakPolarHBondContact O-CG2 3.29Å; M67-V71 PolarHBondContact O-N 3.5Å |
| 68 | L | 90.5 | Very high | 89.6 | Confident | 94 Ų | 94 | 70.3 Ų | 70.3 | 49% | 0.492 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -58.5 | -39.1 | -170.3 | -137.9 | 120.5 | 0 | 0 | 0 | 112.9 | V64 V71 S72 | V64-L68 HydrophobicContact CG1-CD1 4.25Å; V64-L68 PolarHBondContact O-N 3Å; L68-V71 PolarHBondContact O-N 2.7Å; L68-S72 VanDerWaalsContact O-CB 3.29Å; L68-S72 WeakPolarHBondContact O-CB 3.43Å; L68-S72 PolarHBondContact O-N 2.76Å; L68-S72 PolarHBondContact O-OG 3.41Å |
| 69 | G | 93.1 | Very high | 90.4 | Very high | 50 Ų | 50 | 73.5 Ų | 73.5 | 52% | 0.515 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -67.6 | -39.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | M67 S73 | M67-G69 VanDerWaalsContact C-N 3.29Å; M67-G69 PolarHBondContact O-N 2.87Å; G69-S73 WeakPolarHBondContact O-CB 3.44Å; G69-S73 PolarHBondContact O-N 3.39Å; G69-S73 VanDerWaalsContact O-N 3.17Å; G69-S73 PolarHBondContact O-OG 3.47Å |
| 70 | F | 92.3 | Very high | 91.1 | Very high | 135 Ų | 135 | 77.4 Ų | 77.4 | 59% | 0.592 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -64.5 | -48.6 | 173.9 | 170.4 | -97 | 0 | 0 | 0 | 110.6 | M67 S72 S73 N74 | M67-F70 HydrophobicContact CG-CB 4.43Å; M67-F70 HydrophobicContact CG-CD1 4.38Å; M67-F70 WeakPolarHBondContact O-CB 3.5Å; M67-F70 PolarHBondContact O-N 3.05Å; F70-S72 PolarHBondContact O-N 3.21Å; F70-S73 PolarHBondContact O-N 3.21Å; F70-N74 WeakPolarHBondContact CE2-ND2 3.45Å; F70-N74 PolarHBondContact O-N 3.17Å; F70-N74 PolarHBondContact O-ND2 3.18Å |
| 71 | V | 92.3 | Very high | 91.6 | Very high | 71 Ų | 71 | 81.5 Ų | 81.5 | 43% | 0.43 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -59.1 | -48.9 | 178.5 | 174.1 | 0 | 0 | 0 | 0 | 110.5 | M67 L68 S73 N74 I75 | M67-V71 HydrophobicContact CB-CG2 4.43Å; M67-V71 WeakPolarHBondContact O-CG2 3.29Å; M67-V71 PolarHBondContact O-N 3.5Å; L68-V71 PolarHBondContact O-N 2.7Å; V71-S73 PolarHBondContact O-N 2.87Å; V71-N74 PolarHBondContact O-N 3.01Å; V71-I75 HydrophobicContact CG1-CG2 4.49Å; V71-I75 PolarHBondContact O-N 2.81Å |
| 72 | S | 94.3 | Very high | 91.9 | Very high | 66 Ų | 66 | 86 Ų | 86 | 46% | 0.462 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.4 | -24.6 | -178.7 | -54.7 | 0 | 0 | 0 | 0 | 113.4 | L68 F70 I75 | L68-S72 VanDerWaalsContact O-CB 3.29Å; L68-S72 WeakPolarHBondContact O-CB 3.43Å; L68-S72 PolarHBondContact O-N 2.76Å; L68-S72 PolarHBondContact O-OG 3.41Å; F70-S72 PolarHBondContact O-N 3.21Å; S72-I75 WeakPolarHBondContact O-CG1 3.48Å |
| 73 | S | 96.5 | Very high | 92.1 | Very high | 97 Ų | 97 | 89.5 Ų | 89.5 | 68% | 0.678 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.3 | -6.5 | 178.1 | -54.7 | 0 | 0 | 0 | 0 | 113.8 | G69 F70 V71 | G69-S73 WeakPolarHBondContact O-CB 3.44Å; G69-S73 PolarHBondContact O-N 3.39Å; G69-S73 VanDerWaalsContact O-N 3.17Å; G69-S73 PolarHBondContact O-OG 3.47Å; F70-S73 PolarHBondContact O-N 3.21Å; V71-S73 PolarHBondContact O-N 2.87Å |
| 74 | N | 94.9 | Very high | 92.2 | Very high | 111 Ų | 111 | 95.9 Ų | 95.9 | 59% | 0.594 | 54% | 0.542 | S | S | * | . | trans | -124.6 | 17 | -175.5 | -71.3 | -89.2 | 0 | 0 | 0 | 112.8 | F70 V71 | F70-N74 WeakPolarHBondContact CE2-ND2 3.45Å; F70-N74 PolarHBondContact O-N 3.17Å; F70-N74 PolarHBondContact O-ND2 3.18Å; V71-N74 PolarHBondContact O-N 3.01Å | ||
| 75 | I | 88.6 | Confident | 92.1 | Very high | 189 Ų | 189 | 101.5 Ų | 101.5 | 97% | 0.969 | 57% | 0.572 | S | S | * | * | trans | -106.7 | 0 | 168.9 | 58.1 | 169.2 | 0 | 0 | 0 | 109.7 | V71 S72 | V71-I75 HydrophobicContact CG1-CG2 4.49Å; V71-I75 PolarHBondContact O-N 2.81Å; S72-I75 WeakPolarHBondContact O-CG1 3.48Å |
Retrieved 75 of 75 residues in 155.5 ms
(Link to these results)