| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 50 | Low | 50.3 | Low | 217 Ų | 217 | 129 Ų | 129 | 100% | 1.069 | 59% | 0.591 | S | S | * | * | 0 | -6.5 | 0 | -75.9 | -168.7 | -97.8 | 0 | 0 | 113.1 | |||||
| 2 | E | 43.3 | Very low | 51.5 | Low | 165 Ų | 165 | 124.8 Ų | 124.8 | 77% | 0.771 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -73 | -33.2 | -175 | -65.9 | 161.3 | 101.7 | 0 | 0 | 114 | F4 F5 H6 | E2-F4 VanDerWaalsContact C-N 3.32Å; E2-F4 PolarHBondContact O-N 2.83Å; E2-F5 WeakPolarHBondContact O-CB 3.22Å; E2-F5 PolarHBondContact O-N 3.24Å; E2-H6 PolarHBondContact O-N 3.17Å |
| 3 | Y | 40.5 | Very low | 52.6 | Low | 214 Ų | 214 | 121.3 Ų | 121.3 | 84% | 0.839 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -63.9 | -35.3 | 176.8 | -73.4 | -84.5 | 0 | 0 | 0 | 113.4 | F5 L7 | Y3-F5 VanDerWaalsContact C-N 3.34Å; Y3-L7 WeakPolarHBondContact O-CB 2.97Å; Y3-L7 PolarHBondContact O-N 3.4Å |
| 4 | F | 44.1 | Very low | 53.7 | Low | 162 Ų | 162 | 120.5 Ų | 120.5 | 71% | 0.711 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -70.1 | -36.1 | 177.4 | -168 | -95.8 | 0 | 0 | 0 | 111.3 | E2 S8 | E2-F4 VanDerWaalsContact C-N 3.32Å; E2-F4 PolarHBondContact O-N 2.83Å; F4-S8 WeakPolarHBondContact O-CB 3.29Å; F4-S8 PolarHBondContact O-N 2.83Å; F4-S8 PolarHBondContact O-OG 3.4Å |
| 5 | F | 46.4 | Very low | 54.7 | Low | 110 Ų | 110 | 116.3 Ų | 116.3 | 48% | 0.482 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -67.1 | -45.4 | 175.1 | -166.5 | -100.2 | 0 | 0 | 0 | 111.2 | E2 Y3 L7 S8 M9 | E2-F5 WeakPolarHBondContact O-CB 3.22Å; E2-F5 PolarHBondContact O-N 3.24Å; Y3-F5 VanDerWaalsContact C-N 3.34Å; F5-L7 PolarHBondContact O-N 2.94Å; F5-S8 WeakPolarHBondContact CA-OG 3.26Å; F5-S8 PolarHBondContact O-N 3.43Å; F5-S8 PolarHBondContact O-OG 3.24Å; F5-M9 HydrophobicContact CD1-CE 4.15Å; F5-M9 HydrophobicContact CD1-CG 4.22Å; F5-M9 HydrophobicContact CD2-CE 4.21Å; F5-M9 HydrophobicContact CE1-CE 3.46Å; F5-M9 VanDerWaalsContact CE1-CE 3.46Å; F5-M9 HydrophobicContact CE1-CG 4.17Å; F5-M9 HydrophobicContact CE2-CE 3.52Å; F5-M9 HydrophobicContact CZ-CE 3.11Å; F5-M9 VanDerWaalsContact O-CG 3.24Å; F5-M9 WeakPolarHBondContact O-CG 3.4Å; F5-M9 PolarHBondContact O-N 2.88Å |
| 6 | H | 48.6 | Very low | 55.4 | Low | 121 Ų | 121 | 110.8 Ų | 110.8 | 56% | 0.56 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.7 | -42.7 | 178.7 | -152.4 | -88.9 | 0 | 0 | 0 | 112.4 | E2 S8 M9 E10 | E2-H6 PolarHBondContact O-N 3.17Å; H6-S8 PolarHBondContact O-N 3.49Å; H6-M9 WeakPolarHBondContact O-CB 3.03Å; H6-M9 PolarHBondContact O-N 3.26Å; H6-E10 IonicContact CE1-OE2 3.77Å; H6-E10 IonicContact ND1-OE2 3.13Å; H6-E10 PolarHBondContact ND1-OE2 2.84Å; H6-E10 VanDerWaalsContact ND1-OE2 3.13Å; H6-E10 PolarHBondContact O-N 3.47Å |
| 7 | L | 51.2 | Low | 56.3 | Low | 88 Ų | 88 | 109.4 Ų | 109.4 | 46% | 0.461 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.5 | -43.3 | 178.3 | -163.1 | 76.7 | 0 | 0 | 0 | 111.5 | Y3 F5 M9 E10 Y11 | Y3-L7 WeakPolarHBondContact O-CB 2.97Å; Y3-L7 PolarHBondContact O-N 3.4Å; F5-L7 PolarHBondContact O-N 2.94Å; L7-M9 VanDerWaalsContact C-N 3.28Å; L7-M9 PolarHBondContact O-N 3.38Å; L7-E10 PolarHBondContact O-N 2.9Å; L7-Y11 HydrophobicContact CD1-CE2 4.12Å; L7-Y11 HydrophobicContact CD2-CD2 4.49Å; L7-Y11 HydrophobicContact CD2-CE2 3.86Å; L7-Y11 HydrophobicContact CG-CD2 3.93Å; L7-Y11 HydrophobicContact CG-CE2 3.59Å; L7-Y11 WeakPolarHBondContact O-CD2 3.47Å; L7-Y11 PolarHBondContact O-N 3.3Å |
| 8 | S | 54 | Low | 57.1 | Low | 51 Ų | 51 | 108.4 Ų | 108.4 | 36% | 0.357 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.3 | -29.2 | 175.9 | 44.6 | 0 | 0 | 0 | 0 | 112.9 | F4 F5 H6 L12 | F4-S8 WeakPolarHBondContact O-CB 3.29Å; F4-S8 PolarHBondContact O-N 2.83Å; F4-S8 PolarHBondContact O-OG 3.4Å; F5-S8 WeakPolarHBondContact CA-OG 3.26Å; F5-S8 PolarHBondContact O-N 3.43Å; F5-S8 PolarHBondContact O-OG 3.24Å; H6-S8 PolarHBondContact O-N 3.49Å; S8-L12 VanDerWaalsContact O-CB 3.3Å; S8-L12 WeakPolarHBondContact O-CB 3.29Å; S8-L12 PolarHBondContact O-N 3.28Å |
| 9 | M | 52.2 | Low | 57.8 | Low | 27 Ų | 27 | 108 Ų | 108 | 13% | 0.133 | 53% | 0.532 | C | S | . | . | H | α-helix | trans | -68.9 | -45.5 | 172.1 | -71.4 | -55 | 167.1 | 0 | 0 | 112.5 | F5 H6 L7 Y11 L12 V13 H46 | F5-M9 HydrophobicContact CD1-CE 4.15Å; F5-M9 HydrophobicContact CD1-CG 4.22Å; F5-M9 HydrophobicContact CD2-CE 4.21Å; F5-M9 HydrophobicContact CE1-CE 3.46Å; F5-M9 VanDerWaalsContact CE1-CE 3.46Å; F5-M9 HydrophobicContact CE1-CG 4.17Å; F5-M9 HydrophobicContact CE2-CE 3.52Å; F5-M9 HydrophobicContact CZ-CE 3.11Å; F5-M9 VanDerWaalsContact O-CG 3.24Å; F5-M9 WeakPolarHBondContact O-CG 3.4Å; F5-M9 PolarHBondContact O-N 2.88Å; H6-M9 WeakPolarHBondContact O-CB 3.03Å; H6-M9 PolarHBondContact O-N 3.26Å; L7-M9 VanDerWaalsContact C-N 3.28Å; L7-M9 PolarHBondContact O-N 3.38Å; M9-Y11 VanDerWaalsContact C-N 3.32Å; M9-Y11 PolarHBondContact O-N 2.86Å; M9-L12 PolarHBondContact O-N 2.83Å; M9-V13 WeakPolarHBondContact O-CB 3.28Å; M9-V13 VanDerWaalsContact O-CG2 3.31Å; M9-V13 WeakPolarHBondContact O-CG2 3.47Å; M9-V13 PolarHBondContact O-N 3.46Å; M9-H46 PolarHBondContact SD-NE2 2.81Å; M9-H46 VanDerWaalsContact SD-NE2 3.37Å |
| 10 | E | 60 | Low | 58.2 | Low | 113 Ų | 113 | 104.1 Ų | 104.1 | 53% | 0.528 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.2 | -42.3 | 176.2 | -69.7 | -178.6 | 88.3 | 0 | 0 | 111 | H6 L7 V13 L14 | H6-E10 IonicContact CE1-OE2 3.77Å; H6-E10 IonicContact ND1-OE2 3.13Å; H6-E10 PolarHBondContact ND1-OE2 2.84Å; H6-E10 VanDerWaalsContact ND1-OE2 3.13Å; H6-E10 PolarHBondContact O-N 3.47Å; L7-E10 PolarHBondContact O-N 2.9Å; E10-V13 PolarHBondContact O-N 3.39Å; E10-L14 VanDerWaalsContact O-CB 3.24Å; E10-L14 WeakPolarHBondContact O-CB 3.44Å; E10-L14 PolarHBondContact O-N 3.22Å |
| 11 | Y | 63.4 | Low | 58.7 | Low | 151 Ų | 151 | 103.1 Ų | 103.1 | 59% | 0.592 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.3 | -40.7 | 174.2 | -81 | -65.4 | 0 | 0 | 0 | 113.2 | L7 M9 L14 A15 | L7-Y11 HydrophobicContact CD1-CE2 4.12Å; L7-Y11 HydrophobicContact CD2-CD2 4.49Å; L7-Y11 HydrophobicContact CD2-CE2 3.86Å; L7-Y11 HydrophobicContact CG-CD2 3.93Å; L7-Y11 HydrophobicContact CG-CE2 3.59Å; L7-Y11 WeakPolarHBondContact O-CD2 3.47Å; L7-Y11 PolarHBondContact O-N 3.3Å; M9-Y11 VanDerWaalsContact C-N 3.32Å; M9-Y11 PolarHBondContact O-N 2.86Å; Y11-L14 PolarHBondContact O-N 2.82Å; Y11-A15 VanDerWaalsContact O-CB 3.24Å; Y11-A15 WeakPolarHBondContact O-CB 3.25Å; Y11-A15 PolarHBondContact O-N 3.43Å |
| 12 | L | 64.6 | Low | 59.7 | Low | 78 Ų | 78 | 98.5 Ų | 98.5 | 41% | 0.408 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -67.5 | -44.4 | 179.4 | -170.5 | 73.9 | 0 | 0 | 0 | 111 | S8 M9 L14 A15 C16 | S8-L12 VanDerWaalsContact O-CB 3.3Å; S8-L12 WeakPolarHBondContact O-CB 3.29Å; S8-L12 PolarHBondContact O-N 3.28Å; M9-L12 PolarHBondContact O-N 2.83Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L12-A15 PolarHBondContact O-N 3.45Å; L12-C16 WeakPolarHBondContact O-CB 3.31Å; L12-C16 PolarHBondContact O-N 3.43Å; L12-C16 PolarHBondContact O-SG 2.83Å; L12-C16 VanDerWaalsContact O-SG 3.4Å |
| 13 | V | 65.6 | Low | 60.7 | Low | 80 Ų | 80 | 95.5 Ų | 95.5 | 49% | 0.485 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62.3 | -43.1 | 175 | 171.7 | 0 | 0 | 0 | 0 | 110.3 | M9 E10 C16 N17 | M9-V13 WeakPolarHBondContact O-CB 3.28Å; M9-V13 VanDerWaalsContact O-CG2 3.31Å; M9-V13 WeakPolarHBondContact O-CG2 3.47Å; M9-V13 PolarHBondContact O-N 3.46Å; E10-V13 PolarHBondContact O-N 3.39Å; V13-C16 PolarHBondContact O-N 2.85Å; V13-N17 WeakPolarHBondContact CG1-ND2 3.42Å; V13-N17 WeakPolarHBondContact O-CB 3.24Å; V13-N17 PolarHBondContact O-N 3.3Å; V13-N17 PolarHBondContact O-ND2 3.49Å |
| 14 | L | 68.3 | Low | 61.9 | Low | 110 Ų | 110 | 91.4 Ų | 91.4 | 58% | 0.576 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -62.6 | -46 | 176.3 | -154 | 88.8 | 0 | 0 | 0 | 111 | E10 Y11 L12 C16 N17 V18 | E10-L14 VanDerWaalsContact O-CB 3.24Å; E10-L14 WeakPolarHBondContact O-CB 3.44Å; E10-L14 PolarHBondContact O-N 3.22Å; Y11-L14 PolarHBondContact O-N 2.82Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L14-C16 PolarHBondContact O-N 3.41Å; L14-N17 PolarHBondContact O-N 2.67Å; L14-V18 WeakPolarHBondContact O-CB 3.3Å; L14-V18 VanDerWaalsContact O-CG2 3.25Å; L14-V18 WeakPolarHBondContact O-CG2 3.24Å; L14-V18 PolarHBondContact O-N 2.86Å |
| 15 | A | 68.4 | Low | 63.1 | Low | 58 Ų | 58 | 90.9 Ų | 90.9 | 48% | 0.479 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.3 | -41.9 | 178 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y11 L12 V18 F19 | Y11-A15 VanDerWaalsContact O-CB 3.24Å; Y11-A15 WeakPolarHBondContact O-CB 3.25Å; Y11-A15 PolarHBondContact O-N 3.43Å; L12-A15 PolarHBondContact O-N 3.45Å; A15-V18 PolarHBondContact O-N 3.41Å; A15-F19 VanDerWaalsContact O-CB 3.3Å; A15-F19 WeakPolarHBondContact O-CB 3.38Å; A15-F19 PolarHBondContact O-N 2.83Å |
| 16 | C | 66.4 | Low | 64.1 | Low | 28 Ų | 28 | 92.9 Ų | 92.9 | 19% | 0.189 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -63.1 | -45.5 | 173.6 | -77.3 | 0 | 0 | 0 | 0 | 111.5 | L12 V13 L14 V18 F19 L20 C42 | L12-C16 WeakPolarHBondContact O-CB 3.31Å; L12-C16 PolarHBondContact O-N 3.43Å; L12-C16 PolarHBondContact O-SG 2.83Å; L12-C16 VanDerWaalsContact O-SG 3.4Å; V13-C16 PolarHBondContact O-N 2.85Å; L14-C16 PolarHBondContact O-N 3.41Å; C16-V18 PolarHBondContact O-N 3.33Å; C16-F19 PolarHBondContact O-N 2.99Å; C16-L20 WeakPolarHBondContact O-CB 3.06Å; C16-L20 VanDerWaalsContact O-CG 3.23Å; C16-L20 WeakPolarHBondContact O-CG 3.24Å; C16-L20 PolarHBondContact O-N 3.42Å; C16-C42 PolarHBondContact SG-SG 3.27Å |
| 17 | N | 69.5 | Low | 64.9 | Low | 86 Ų | 86 | 92.4 Ų | 92.4 | 46% | 0.46 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -61.4 | -44.5 | 175.8 | -81.1 | -63.7 | 0 | 0 | 0 | 112 | V13 L14 F19 L20 V21 | V13-N17 WeakPolarHBondContact CG1-ND2 3.42Å; V13-N17 WeakPolarHBondContact O-CB 3.24Å; V13-N17 PolarHBondContact O-N 3.3Å; V13-N17 PolarHBondContact O-ND2 3.49Å; L14-N17 PolarHBondContact O-N 2.67Å; N17-F19 VanDerWaalsContact C-N 3.34Å; N17-F19 PolarHBondContact O-N 3.05Å; N17-L20 PolarHBondContact O-N 2.85Å; N17-V21 WeakPolarHBondContact O-CB 3.41Å; N17-V21 VanDerWaalsContact O-CG2 3.26Å; N17-V21 WeakPolarHBondContact O-CG2 3.45Å; N17-V21 PolarHBondContact O-N 2.93Å |
| 18 | V | 71.3 | Confident | 65.5 | Low | 93 Ų | 93 | 91.2 Ų | 91.2 | 56% | 0.564 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -60.8 | -44.3 | 176.6 | 170 | 0 | 0 | 0 | 0 | 110.8 | L14 A15 C16 V21 Y22 | L14-V18 WeakPolarHBondContact O-CB 3.3Å; L14-V18 VanDerWaalsContact O-CG2 3.25Å; L14-V18 WeakPolarHBondContact O-CG2 3.24Å; L14-V18 PolarHBondContact O-N 2.86Å; A15-V18 PolarHBondContact O-N 3.41Å; C16-V18 PolarHBondContact O-N 3.33Å; V18-V21 PolarHBondContact O-N 3.24Å; V18-Y22 VanDerWaalsContact O-CB 3.28Å; V18-Y22 WeakPolarHBondContact O-CB 3.31Å; V18-Y22 PolarHBondContact O-N 3.45Å |
| 19 | F | 70.6 | Confident | 65.9 | Low | 100 Ų | 100 | 97.7 Ų | 97.7 | 44% | 0.439 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.2 | -45.4 | 176.3 | -171.2 | -92.5 | 0 | 0 | 0 | 111.3 | A15 C16 N17 V21 Y22 Y23 | A15-F19 VanDerWaalsContact O-CB 3.3Å; A15-F19 WeakPolarHBondContact O-CB 3.38Å; A15-F19 PolarHBondContact O-N 2.83Å; C16-F19 PolarHBondContact O-N 2.99Å; N17-F19 VanDerWaalsContact C-N 3.34Å; N17-F19 PolarHBondContact O-N 3.05Å; F19-V21 VanDerWaalsContact C-N 3.34Å; F19-V21 PolarHBondContact O-N 2.81Å; F19-Y22 PolarHBondContact O-N 3.48Å; F19-Y23 AromaticContact CD1-CD2 3.62Å; F19-Y23 HydrophobicContact CD1-CD2 3.62Å; F19-Y23 AromaticContact CD1-CE2 3.81Å; F19-Y23 HydrophobicContact CD1-CE2 3.81Å; F19-Y23 HydrophobicContact CD1-CG 4.38Å; F19-Y23 HydrophobicContact CD2-CD2 4.06Å; F19-Y23 AromaticContact CD2-CE2 3.68Å; F19-Y23 HydrophobicContact CD2-CE2 3.68Å; F19-Y23 AromaticContact CE1-CD2 3.48Å; F19-Y23 HydrophobicContact CE1-CD2 3.48Å; F19-Y23 VanDerWaalsContact CE1-CD2 3.48Å; F19-Y23 HydrophobicContact CE1-CE1 4.32Å; F19-Y23 AromaticContact CE1-CE2 3.28Å; F19-Y23 HydrophobicContact CE1-CE2 3.28Å; F19-Y23 HydrophobicContact CE1-CG 4.12Å; F19-Y23 AromaticContact CE1-CZ 3.69Å; F19-Y23 AromaticContact CE2-CD2 3.95Å; F19-Y23 HydrophobicContact CE2-CD2 3.95Å; F19-Y23 AromaticContact CE2-CE2 3.16Å; F19-Y23 HydrophobicContact CE2-CE2 3.16Å; F19-Y23 AromaticContact CE2-CZ 3.8Å; F19-Y23 AromaticContact CG-CD2 3.94Å; F19-Y23 HydrophobicContact CG-CD2 3.94Å; F19-Y23 HydrophobicContact CG-CE2 4Å; F19-Y23 AromaticContact CZ-CD2 3.68Å; F19-Y23 HydrophobicContact CZ-CD2 3.68Å; F19-Y23 HydrophobicContact CZ-CE1 4.22Å; F19-Y23 AromaticContact CZ-CE2 2.95Å; F19-Y23 HydrophobicContact CZ-CE2 2.95Å; F19-Y23 AromaticContact CZ-CZ 3.23Å; F19-Y23 VanDerWaalsContact CZ-OH 3.28Å; F19-Y23 WeakPolarHBondContact CZ-OH 3.41Å; F19-Y23 WeakPolarHBondContact O-CB 3.38Å; F19-Y23 VanDerWaalsContact O-CD2 3.24Å; F19-Y23 WeakPolarHBondContact O-CD2 3.23Å; F19-Y23 PolarHBondContact O-N 2.88Å |
| 20 | L | 65.1 | Low | 66.2 | Low | 30 Ų | 30 | 103.4 Ų | 103.4 | 16% | 0.157 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -60.8 | -43.2 | 176.7 | -72.4 | 178.7 | 0 | 0 | 0 | 111.9 | C16 N17 Y23 K24 L35 T38 | C16-L20 WeakPolarHBondContact O-CB 3.06Å; C16-L20 VanDerWaalsContact O-CG 3.23Å; C16-L20 WeakPolarHBondContact O-CG 3.24Å; C16-L20 PolarHBondContact O-N 3.42Å; N17-L20 PolarHBondContact O-N 2.85Å; L20-Y23 PolarHBondContact O-N 3.32Å; L20-K24 VanDerWaalsContact O-CB 3.22Å; L20-K24 WeakPolarHBondContact O-CB 3.28Å; L20-K24 PolarHBondContact O-N 3.07Å; L20-L35 HydrophobicContact CB-CD1 4.26Å; L20-L35 HydrophobicContact CD1-CD1 3.81Å; L20-L35 HydrophobicContact CD2-CD1 3.82Å; L20-L35 HydrophobicContact CG-CD1 4.16Å; L20-T38 HydrophobicContact CD2-CG2 4.36Å |
| 21 | V | 69.8 | Low | 66 | Low | 84 Ų | 84 | 103.9 Ų | 103.9 | 51% | 0.509 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.1 | -46.5 | 175.8 | 172.1 | 0 | 0 | 0 | 0 | 110.4 | N17 V18 F19 Y23 K24 M25 | N17-V21 WeakPolarHBondContact O-CB 3.41Å; N17-V21 VanDerWaalsContact O-CG2 3.26Å; N17-V21 WeakPolarHBondContact O-CG2 3.45Å; N17-V21 PolarHBondContact O-N 2.93Å; V18-V21 PolarHBondContact O-N 3.24Å; F19-V21 VanDerWaalsContact C-N 3.34Å; F19-V21 PolarHBondContact O-N 2.81Å; V21-Y23 VanDerWaalsContact C-N 3.33Å; V21-Y23 PolarHBondContact O-N 3.31Å; V21-K24 PolarHBondContact O-N 3.45Å; V21-M25 VanDerWaalsContact O-CG 3.29Å; V21-M25 WeakPolarHBondContact O-CG 3.19Å; V21-M25 PolarHBondContact O-N 3.13Å |
| 22 | Y | 70.2 | Confident | 65.6 | Low | 120 Ų | 120 | 101.2 Ų | 101.2 | 47% | 0.471 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.3 | -44.6 | 177.1 | -178.9 | -95.3 | 0 | 0 | 0 | 111.9 | V18 F19 M25 R26 | V18-Y22 VanDerWaalsContact O-CB 3.28Å; V18-Y22 WeakPolarHBondContact O-CB 3.31Å; V18-Y22 PolarHBondContact O-N 3.45Å; F19-Y22 PolarHBondContact O-N 3.48Å; Y22-M25 PolarHBondContact O-N 2.99Å; Y22-R26 VanDerWaalsContact O-CB 3.29Å; Y22-R26 WeakPolarHBondContact O-CB 3.46Å; Y22-R26 PolarHBondContact O-N 2.85Å; Y22-R26 PolarHBondContact OH-NH1 3.42Å |
| 23 | Y | 64.5 | Low | 64.9 | Low | 102 Ų | 102 | 106.4 Ų | 106.4 | 40% | 0.4 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -69.2 | -38.8 | 176.8 | -88.2 | -104.2 | 0 | 0 | 0 | 112.3 | F19 L20 V21 M25 R26 W27 | F19-Y23 AromaticContact CD1-CD2 3.62Å; F19-Y23 HydrophobicContact CD1-CD2 3.62Å; F19-Y23 AromaticContact CD1-CE2 3.81Å; F19-Y23 HydrophobicContact CD1-CE2 3.81Å; F19-Y23 HydrophobicContact CD1-CG 4.38Å; F19-Y23 HydrophobicContact CD2-CD2 4.06Å; F19-Y23 AromaticContact CD2-CE2 3.68Å; F19-Y23 HydrophobicContact CD2-CE2 3.68Å; F19-Y23 AromaticContact CE1-CD2 3.48Å; F19-Y23 HydrophobicContact CE1-CD2 3.48Å; F19-Y23 VanDerWaalsContact CE1-CD2 3.48Å; F19-Y23 HydrophobicContact CE1-CE1 4.32Å; F19-Y23 AromaticContact CE1-CE2 3.28Å; F19-Y23 HydrophobicContact CE1-CE2 3.28Å; F19-Y23 HydrophobicContact CE1-CG 4.12Å; F19-Y23 AromaticContact CE1-CZ 3.69Å; F19-Y23 AromaticContact CE2-CD2 3.95Å; F19-Y23 HydrophobicContact CE2-CD2 3.95Å; F19-Y23 AromaticContact CE2-CE2 3.16Å; F19-Y23 HydrophobicContact CE2-CE2 3.16Å; F19-Y23 AromaticContact CE2-CZ 3.8Å; F19-Y23 AromaticContact CG-CD2 3.94Å; F19-Y23 HydrophobicContact CG-CD2 3.94Å; F19-Y23 HydrophobicContact CG-CE2 4Å; F19-Y23 AromaticContact CZ-CD2 3.68Å; F19-Y23 HydrophobicContact CZ-CD2 3.68Å; F19-Y23 HydrophobicContact CZ-CE1 4.22Å; F19-Y23 AromaticContact CZ-CE2 2.95Å; F19-Y23 HydrophobicContact CZ-CE2 2.95Å; F19-Y23 AromaticContact CZ-CZ 3.23Å; F19-Y23 VanDerWaalsContact CZ-OH 3.28Å; F19-Y23 WeakPolarHBondContact CZ-OH 3.41Å; F19-Y23 WeakPolarHBondContact O-CB 3.38Å; F19-Y23 VanDerWaalsContact O-CD2 3.24Å; F19-Y23 WeakPolarHBondContact O-CD2 3.23Å; F19-Y23 PolarHBondContact O-N 2.88Å; L20-Y23 PolarHBondContact O-N 3.32Å; V21-Y23 VanDerWaalsContact C-N 3.33Å; V21-Y23 PolarHBondContact O-N 3.31Å; Y23-M25 VanDerWaalsContact C-N 3.26Å; Y23-M25 PolarHBondContact O-N 3.2Å; Y23-R26 PolarHBondContact O-N 2.9Å; Y23-W27 PolarHBondContact O-N 3.4Å |
| 24 | K | 65.3 | Low | 64.3 | Low | 127 Ų | 127 | 109 Ų | 109 | 55% | 0.552 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.2 | -36.2 | 175.2 | -174.4 | -179.1 | 179.6 | -179.1 | 0 | 111.8 | L20 V21 R31 | L20-K24 VanDerWaalsContact O-CB 3.22Å; L20-K24 WeakPolarHBondContact O-CB 3.28Å; L20-K24 PolarHBondContact O-N 3.07Å; V21-K24 PolarHBondContact O-N 3.45Å; K24-R31 PolarHBondContact O-NE 2.86Å; K24-R31 PolarHBondContact O-NH2 3.24Å |
| 25 | M | 69.9 | Low | 63.5 | Low | 151 Ų | 151 | 107.9 Ų | 107.9 | 74% | 0.744 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -73 | -46.5 | 174.7 | -69 | -64.8 | -144.3 | 0 | 0 | 111.8 | V21 Y22 Y23 | V21-M25 VanDerWaalsContact O-CG 3.29Å; V21-M25 WeakPolarHBondContact O-CG 3.19Å; V21-M25 PolarHBondContact O-N 3.13Å; Y22-M25 PolarHBondContact O-N 2.99Å; Y23-M25 VanDerWaalsContact C-N 3.26Å; Y23-M25 PolarHBondContact O-N 3.2Å |
| 26 | R | 68.2 | Low | 62.9 | Low | 152 Ų | 152 | 109.7 Ų | 109.7 | 57% | 0.574 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -77.2 | -30.3 | -173.1 | -166.9 | 173.9 | 179 | 173.4 | -2.7 | 113.9 | Y22 Y23 | Y22-R26 VanDerWaalsContact O-CB 3.29Å; Y22-R26 WeakPolarHBondContact O-CB 3.46Å; Y22-R26 PolarHBondContact O-N 2.85Å; Y22-R26 PolarHBondContact OH-NH1 3.42Å; Y23-R26 PolarHBondContact O-N 2.9Å |
| 27 | W | 65 | Low | 62.4 | Low | 112 Ų | 112 | 113.7 Ų | 113.7 | 42% | 0.424 | 52% | 0.521 | S | S | . | . | trans | -135.8 | 78.3 | -174.3 | -62 | 96.5 | 0 | 0 | 0 | 111.1 | Y23 E29 R30 | Y23-W27 PolarHBondContact O-N 3.4Å; W27-E29 PolarHBondContact O-N 2.67Å; W27-R30 HydrophobicContact CB-CB 4.3Å; W27-R30 PolarHBondContact O-N 3.35Å | ||
| 28 | P | 63.3 | Low | 61.7 | Low | 63 Ų | 63 | 111.3 Ų | 111.3 | 41% | 0.409 | 51% | 0.51 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.9 | -23.3 | -177.5 | 25.3 | -34.6 | 0 | 0 | 0 | 114.3 | R31 | P28-R31 VanDerWaalsContact CA-CZ 3.46Å; P28-R31 VanDerWaalsContact CA-NE 3.28Å; P28-R31 VanDerWaalsContact CB-CZ 3.42Å; P28-R31 VanDerWaalsContact CB-NH2 3.33Å; P28-R31 WeakPolarHBondContact O-CB 3.38Å; P28-R31 WeakPolarHBondContact O-CD 3.19Å; P28-R31 WeakPolarHBondContact O-CG 3.15Å; P28-R31 PolarHBondContact O-NE 3.4Å |
| 29 | E | 63.1 | Low | 60.9 | Low | 186 Ų | 186 | 110.3 Ų | 110.3 | 87% | 0.869 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.5 | -17.5 | -174 | -71.3 | 175.9 | 81.3 | 0 | 0 | 113.8 | W27 R31 | W27-E29 PolarHBondContact O-N 2.67Å; E29-R31 PolarHBondContact O-N 3.37Å |
| 30 | R | 57.7 | Low | 60.2 | Low | 148 Ų | 148 | 109.1 Ų | 109.1 | 56% | 0.558 | 51% | 0.505 | S | S | * | . | S | Bend | trans | -89.4 | 20.3 | 178.4 | -65.4 | -173 | -178.3 | -164.7 | 1.6 | 113.3 | W27 V32 Y34 | W27-R30 HydrophobicContact CB-CB 4.3Å; W27-R30 PolarHBondContact O-N 3.35Å; R30-V32 PolarHBondContact O-N 3.45Å; R30-Y34 HydrophobicContact CB-CD2 4.46Å; R30-Y34 HydrophobicContact CB-CE2 4.47Å |
| 31 | R | 55.2 | Low | 59.7 | Low | 123 Ų | 123 | 109.4 Ų | 109.4 | 46% | 0.464 | 52% | 0.515 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.1 | -11.2 | -149 | -99.5 | -174.9 | -172.1 | 157.8 | 5 | 118.8 | K24 P28 E29 | K24-R31 PolarHBondContact O-NE 2.86Å; K24-R31 PolarHBondContact O-NH2 3.24Å; P28-R31 VanDerWaalsContact CA-CZ 3.46Å; P28-R31 VanDerWaalsContact CA-NE 3.28Å; P28-R31 VanDerWaalsContact CB-CZ 3.42Å; P28-R31 VanDerWaalsContact CB-NH2 3.33Å; P28-R31 WeakPolarHBondContact O-CB 3.38Å; P28-R31 WeakPolarHBondContact O-CD 3.19Å; P28-R31 WeakPolarHBondContact O-CG 3.15Å; P28-R31 PolarHBondContact O-NE 3.4Å; E29-R31 PolarHBondContact O-N 3.37Å |
| 32 | V | 54.8 | Low | 58.9 | Low | 95 Ų | 95 | 107.5 Ų | 107.5 | 58% | 0.576 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.1 | -39.8 | -167.6 | -175.1 | 0 | 0 | 0 | 0 | 113.4 | R30 I36 | R30-V32 PolarHBondContact O-N 3.45Å; V32-I36 HydrophobicContact CG1-CD1 4.43Å |
| 33 | Y | 51.1 | Low | 58 | Low | 187 Ų | 187 | 110.4 Ų | 110.4 | 73% | 0.733 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -75.6 | -36.9 | -172.6 | -66 | -79.5 | 0 | 0 | 0 | 113.7 | I37 | Y33-I37 WeakPolarHBondContact O-CD1 3.36Å; Y33-I37 VanDerWaalsContact O-CG1 3.32Å; Y33-I37 WeakPolarHBondContact O-CG1 3.25Å; Y33-I37 PolarHBondContact O-N 2.94Å |
| 34 | Y | 53.2 | Low | 57.4 | Low | 133 Ų | 133 | 109.2 Ų | 109.2 | 52% | 0.522 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -75.2 | -29.9 | -178.4 | -68.9 | -77.8 | 0 | 0 | 0 | 113.4 | R30 I36 I37 T38 | R30-Y34 HydrophobicContact CB-CD2 4.46Å; R30-Y34 HydrophobicContact CB-CE2 4.47Å; Y34-I36 VanDerWaalsContact C-N 3.32Å; Y34-I36 PolarHBondContact O-N 3.5Å; Y34-I37 PolarHBondContact O-N 2.76Å; Y34-T38 WeakPolarHBondContact O-CB 3.28Å; Y34-T38 PolarHBondContact O-N 2.76Å; Y34-T38 PolarHBondContact O-OG1 3.37Å |
| 35 | L | 51.5 | Low | 56.7 | Low | 87 Ų | 87 | 111 Ų | 111 | 46% | 0.455 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.2 | -42.4 | 176.6 | -162.9 | 90.9 | 0 | 0 | 0 | 110.5 | L20 T39 | L20-L35 HydrophobicContact CB-CD1 4.26Å; L20-L35 HydrophobicContact CD1-CD1 3.81Å; L20-L35 HydrophobicContact CD2-CD1 3.82Å; L20-L35 HydrophobicContact CG-CD1 4.16Å; L35-T39 VanDerWaalsContact O-CB 3.31Å; L35-T39 WeakPolarHBondContact O-CB 3.49Å; L35-T39 PolarHBondContact O-N 3.18Å; L35-T39 PolarHBondContact O-OG1 3.44Å |
| 36 | I | 55.8 | Low | 55.9 | Low | 96 Ų | 96 | 108.7 Ų | 108.7 | 49% | 0.492 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.6 | -46.6 | 178.1 | -61.4 | 170 | 0 | 0 | 0 | 110.1 | V32 Y34 T38 T39 V40 | V32-I36 HydrophobicContact CG1-CD1 4.43Å; Y34-I36 VanDerWaalsContact C-N 3.32Å; Y34-I36 PolarHBondContact O-N 3.5Å; I36-T38 VanDerWaalsContact C-N 3.33Å; I36-T38 PolarHBondContact O-N 3.31Å; I36-T39 PolarHBondContact O-N 2.96Å; I36-V40 HydrophobicContact CG2-CG2 3.85Å; I36-V40 WeakPolarHBondContact O-CB 3.48Å; I36-V40 WeakPolarHBondContact O-CG2 3.32Å; I36-V40 PolarHBondContact O-N 3.19Å |
| 37 | I | 55.7 | Low | 54.9 | Low | 112 Ų | 112 | 106.8 Ų | 106.8 | 57% | 0.574 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.6 | -38.4 | -179.2 | -65.4 | 164.8 | 0 | 0 | 0 | 111.9 | Y33 Y34 G41 | Y33-I37 WeakPolarHBondContact O-CD1 3.36Å; Y33-I37 VanDerWaalsContact O-CG1 3.32Å; Y33-I37 WeakPolarHBondContact O-CG1 3.25Å; Y33-I37 PolarHBondContact O-N 2.94Å; Y34-I37 PolarHBondContact O-N 2.76Å; I37-G41 WeakPolarHBondContact O-CA 3.34Å; I37-G41 PolarHBondContact O-N 2.74Å |
| 38 | T | 54.2 | Low | 53.8 | Low | 36 Ų | 36 | 103.8 Ų | 103.8 | 22% | 0.221 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -72.8 | -39.6 | 179.8 | -42.4 | 0 | 0 | 0 | 0 | 110.7 | L20 Y34 I36 C42 | L20-T38 HydrophobicContact CD2-CG2 4.36Å; Y34-T38 WeakPolarHBondContact O-CB 3.28Å; Y34-T38 PolarHBondContact O-N 2.76Å; Y34-T38 PolarHBondContact O-OG1 3.37Å; I36-T38 VanDerWaalsContact C-N 3.33Å; I36-T38 PolarHBondContact O-N 3.31Å; T38-C42 VanDerWaalsContact O-CB 3.28Å; T38-C42 WeakPolarHBondContact O-CB 3.24Å; T38-C42 PolarHBondContact O-N 3.14Å; T38-C42 PolarHBondContact O-SG 2.96Å |
| 39 | T | 55.3 | Low | 52.8 | Low | 73 Ų | 73 | 105.4 Ų | 105.4 | 45% | 0.448 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -69.2 | -44.6 | 176.9 | -50.9 | 0 | 0 | 0 | 0 | 111.2 | L35 I36 C42 W43 | L35-T39 VanDerWaalsContact O-CB 3.31Å; L35-T39 WeakPolarHBondContact O-CB 3.49Å; L35-T39 PolarHBondContact O-N 3.18Å; L35-T39 PolarHBondContact O-OG1 3.44Å; I36-T39 PolarHBondContact O-N 2.96Å; T39-C42 PolarHBondContact O-N 3.36Å; T39-W43 WeakPolarHBondContact O-CB 3.38Å; T39-W43 PolarHBondContact O-N 3.23Å |
| 40 | V | 54.5 | Low | 51.8 | Low | 75 Ų | 75 | 101.1 Ų | 101.1 | 46% | 0.455 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68 | -37.4 | 176.1 | 174.2 | 0 | 0 | 0 | 0 | 110.9 | I36 W43 N44 | I36-V40 HydrophobicContact CG2-CG2 3.85Å; I36-V40 WeakPolarHBondContact O-CB 3.48Å; I36-V40 WeakPolarHBondContact O-CG2 3.32Å; I36-V40 PolarHBondContact O-N 3.19Å; V40-W43 PolarHBondContact O-N 2.65Å; V40-N44 VanDerWaalsContact O-CB 3.25Å; V40-N44 WeakPolarHBondContact O-CB 3.43Å; V40-N44 PolarHBondContact O-N 3Å |
| 41 | G | 55.4 | Low | 51.1 | Low | 36 Ų | 36 | 99.3 Ų | 99.3 | 37% | 0.371 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -68.8 | -38.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | I37 R45 | I37-G41 WeakPolarHBondContact O-CA 3.34Å; I37-G41 PolarHBondContact O-N 2.74Å; G41-R45 PolarHBondContact O-N 3.03Å |
| 42 | C | 52.4 | Low | 50.4 | Low | 43 Ų | 43 | 96.7 Ų | 96.7 | 29% | 0.291 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -69.1 | -39.3 | 171.6 | -73.7 | 0 | 0 | 0 | 0 | 111.9 | C16 T38 T39 R45 H46 | C16-C42 PolarHBondContact SG-SG 3.27Å; T38-C42 VanDerWaalsContact O-CB 3.28Å; T38-C42 WeakPolarHBondContact O-CB 3.24Å; T38-C42 PolarHBondContact O-N 3.14Å; T38-C42 PolarHBondContact O-SG 2.96Å; T39-C42 PolarHBondContact O-N 3.36Å; C42-R45 PolarHBondContact O-N 3.49Å; C42-H46 PolarHBondContact O-N 3.06Å |
| 43 | W | 51.8 | Low | 49.9 | Very low | 182 Ų | 182 | 100.4 Ų | 100.4 | 69% | 0.689 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -67.9 | -40.7 | 175.6 | -165.5 | -82.4 | 0 | 0 | 0 | 112.2 | T39 V40 H46 Q47 | T39-W43 WeakPolarHBondContact O-CB 3.38Å; T39-W43 PolarHBondContact O-N 3.23Å; V40-W43 PolarHBondContact O-N 2.65Å; W43-H46 WeakPolarHBondContact O-CB 3.23Å; W43-H46 PolarHBondContact O-N 3.39Å; W43-H46 VanDerWaalsContact O-N 3.14Å; W43-Q47 PolarHBondContact O-N 2.96Å |
| 44 | N | 52.1 | Low | 49.5 | Very low | 76 Ų | 76 | 99.9 Ų | 99.9 | 41% | 0.406 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.1 | -39.5 | 175 | -101.9 | 1.6 | 0 | 0 | 0 | 111.1 | V40 H46 Q47 L48 | V40-N44 VanDerWaalsContact O-CB 3.25Å; V40-N44 WeakPolarHBondContact O-CB 3.43Å; V40-N44 PolarHBondContact O-N 3Å; N44-H46 VanDerWaalsContact C-N 3.26Å; N44-H46 PolarHBondContact O-N 3.44Å; N44-Q47 PolarHBondContact O-N 3.26Å; N44-L48 HydrophobicContact CB-CD1 4.19Å; N44-L48 VanDerWaalsContact O-CB 3.23Å; N44-L48 WeakPolarHBondContact O-CB 3.3Å; N44-L48 WeakPolarHBondContact O-CD1 3.42Å; N44-L48 PolarHBondContact O-N 2.96Å |
| 45 | R | 51.4 | Low | 48.5 | Very low | 166 Ų | 166 | 97 Ų | 97 | 63% | 0.626 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.4 | -36.1 | 171.7 | -87.7 | -165.4 | -172.5 | -154.7 | 3 | 112.8 | G41 C42 Q49 | G41-R45 PolarHBondContact O-N 3.03Å; C42-R45 PolarHBondContact O-N 3.49Å; R45-Q49 WeakPolarHBondContact O-CB 3.19Å; R45-Q49 PolarHBondContact O-N 3.05Å |
| 46 | H | 52.1 | Low | 47.8 | Very low | 101 Ų | 101 | 100 Ų | 100 | 47% | 0.468 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -67.6 | -37.4 | 176.4 | -112 | -110.7 | 0 | 0 | 0 | 112.9 | M9 C42 W43 N44 | M9-H46 PolarHBondContact SD-NE2 2.81Å; M9-H46 VanDerWaalsContact SD-NE2 3.37Å; C42-H46 PolarHBondContact O-N 3.06Å; W43-H46 WeakPolarHBondContact O-CB 3.23Å; W43-H46 PolarHBondContact O-N 3.39Å; W43-H46 VanDerWaalsContact O-N 3.14Å; N44-H46 VanDerWaalsContact C-N 3.26Å; N44-H46 PolarHBondContact O-N 3.44Å |
| 47 | Q | 47.3 | Very low | 46.9 | Very low | 113 Ų | 113 | 103.2 Ų | 103.2 | 53% | 0.528 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -74.6 | -40.8 | 172.9 | -73.3 | -112.2 | -66.5 | 0 | 0 | 111.9 | W43 N44 S50 I51 | W43-Q47 PolarHBondContact O-N 2.96Å; N44-Q47 PolarHBondContact O-N 3.26Å; Q47-S50 PolarHBondContact O-N 3.4Å; Q47-I51 WeakPolarHBondContact O-CB 3.25Å; Q47-I51 VanDerWaalsContact O-CD1 3.25Å; Q47-I51 WeakPolarHBondContact O-CD1 3.5Å; Q47-I51 WeakPolarHBondContact O-CG1 3.45Å; Q47-I51 PolarHBondContact O-N 3.36Å; Q47-I51 VanDerWaalsContact O-N 3.12Å |
| 48 | L | 42.2 | Very low | 45.8 | Very low | 48 Ų | 48 | 104.4 Ų | 104.4 | 25% | 0.251 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -65.4 | -41 | 179.7 | -93.3 | 134.7 | 0 | 0 | 0 | 113.6 | N44 I51 C52 I61 | N44-L48 HydrophobicContact CB-CD1 4.19Å; N44-L48 VanDerWaalsContact O-CB 3.23Å; N44-L48 WeakPolarHBondContact O-CB 3.3Å; N44-L48 WeakPolarHBondContact O-CD1 3.42Å; N44-L48 PolarHBondContact O-N 2.96Å; L48-I51 PolarHBondContact O-N 3.12Å; L48-C52 WeakPolarHBondContact O-CB 3.13Å; L48-C52 PolarHBondContact O-N 2.96Å; L48-I61 HydrophobicContact CD1-CD1 3.74Å; L48-I61 HydrophobicContact CD2-CB 4.47Å; L48-I61 HydrophobicContact CD2-CD1 3.36Å; L48-I61 HydrophobicContact CD2-CG1 3.91Å; L48-I61 HydrophobicContact CG-CD1 3.42Å; L48-I61 VanDerWaalsContact CG-CD1 3.42Å; L48-I61 HydrophobicContact CG-CG1 4.46Å |
| 49 | Q | 42.2 | Very low | 45 | Very low | 97 Ų | 97 | 106.7 Ų | 106.7 | 45% | 0.453 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -74.5 | -29.2 | 178.9 | -78.3 | -172.6 | -19.3 | 0 | 0 | 113 | R45 I51 | R45-Q49 WeakPolarHBondContact O-CB 3.19Å; R45-Q49 PolarHBondContact O-N 3.05Å; Q49-I51 VanDerWaalsContact C-N 3.32Å |
| 50 | S | 41.9 | Very low | 43.8 | Very low | 96 Ų | 96 | 108.7 Ų | 108.7 | 67% | 0.671 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -73.3 | -25.4 | 173 | -176.5 | 0 | 0 | 0 | 0 | 112.6 | Q47 | Q47-S50 PolarHBondContact O-N 3.4Å |
| 51 | I | 42.7 | Very low | 42.9 | Very low | 110 Ų | 110 | 110.2 Ų | 110.2 | 56% | 0.564 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -89.6 | -39.8 | -179.2 | -65.8 | 165 | 0 | 0 | 0 | 111.1 | Q47 L48 Q49 H53 | Q47-I51 WeakPolarHBondContact O-CB 3.25Å; Q47-I51 VanDerWaalsContact O-CD1 3.25Å; Q47-I51 WeakPolarHBondContact O-CD1 3.5Å; Q47-I51 WeakPolarHBondContact O-CG1 3.45Å; Q47-I51 PolarHBondContact O-N 3.36Å; Q47-I51 VanDerWaalsContact O-N 3.12Å; L48-I51 PolarHBondContact O-N 3.12Å; Q49-I51 VanDerWaalsContact C-N 3.32Å; I51-H53 PolarHBondContact O-N 2.12Å |
| 52 | C | 41.5 | Very low | 41.9 | Very low | 69 Ų | 69 | 120.6 Ų | 120.6 | 47% | 0.466 | 63% | 0.629 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.1 | 15 | -175.6 | -66.1 | 0 | 0 | 0 | 0 | 114.2 | L48 C59 | L48-C52 WeakPolarHBondContact O-CB 3.13Å; L48-C52 PolarHBondContact O-N 2.96Å; C52-C59 WeakPolarHBondContact CB-SG 3.42Å; C52-C59 WeakPolarHBondContact SG-CB 3.38Å; C52-C59 CovalentContact SG-SG 2.12Å; C52-C59 PolarHBondContact SG-SG 3.19Å |
| 53 | H | 44.3 | Very low | 41.3 | Very low | 173 Ų | 173 | 124.5 Ų | 124.5 | 80% | 0.801 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.3 | 8.7 | 173.6 | -124.6 | -101.9 | 0 | 0 | 0 | 114.7 | I51 | I51-H53 PolarHBondContact O-N 2.12Š|
| 54 | H | 42 | Very low | 40.8 | Very low | 175 Ų | 175 | 121.4 Ų | 121.4 | 81% | 0.81 | 64% | 0.644 | S | S | * | * | S | Bend | trans | -137.8 | 64 | -176.9 | -136.1 | -90 | 0 | 0 | 0 | 112.6 | ||
| 55 | G | 32.8 | Very low | 40.1 | Very low | 72 Ų | 72 | 123.9 Ų | 123.9 | 74% | 0.742 | 66% | 0.657 | S | S | * | * | S | Bend | trans | 77.1 | 148.6 | 165 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 56 | N | 35.4 | Very low | 39.5 | Very low | 151 Ų | 151 | 121.5 Ų | 121.5 | 81% | 0.807 | 66% | 0.659 | S | S | * | * | trans | 76.6 | 91.8 | 175.3 | -84.8 | 2.3 | 0 | 0 | 0 | 118 | I58 | N56-I58 PolarHBondContact O-N 3.26Š| ||
| 57 | D | 38.5 | Very low | 38.7 | Very low | 164 Ų | 164 | 122.8 Ų | 122.8 | 88% | 0.877 | 67% | 0.671 | S | S | * | * | S | Bend | 20.6 | 7.1 | 128.2 | -74.5 | -91.4 | 0 | 0 | 0 | 124.7 | |||
| 58 | I | 32.9 | Very low | 38.1 | Very low | 136 Ų | 136 | 123.4 Ų | 123.4 | 70% | 0.697 | 68% | 0.68 | S | S | * | * | trans | -142.9 | 78.6 | -179.4 | -48.1 | 176.7 | 0 | 0 | 0 | 110.7 | N56 V60 | N56-I58 PolarHBondContact O-N 3.26Å; I58-V60 VanDerWaalsContact C-N 3.34Å; I58-V60 HydrophobicContact CG2-CB 4.36Å; I58-V60 HydrophobicContact CG2-CG2 3.63Å; I58-V60 PolarHBondContact O-N 2.74Å | ||
| 59 | C | 37.2 | Very low | 37.8 | Very low | 84 Ų | 84 | 128.8 Ų | 128.8 | 57% | 0.568 | 71% | 0.711 | S | S | * | * | trans | -89.6 | 77.2 | 169.1 | -141.9 | 0 | 0 | 0 | 0 | 105.9 | C52 | C52-C59 WeakPolarHBondContact CB-SG 3.42Å; C52-C59 WeakPolarHBondContact SG-CB 3.38Å; C52-C59 CovalentContact SG-SG 2.12Å; C52-C59 PolarHBondContact SG-SG 3.19Å | ||
| 60 | V | 30 | Very low | 37.5 | Very low | 116 Ų | 116 | 131.2 Ų | 131.2 | 70% | 0.703 | 73% | 0.731 | S | S | * | * | trans | -95.6 | 111.8 | 168.7 | 172.2 | 0 | 0 | 0 | 0 | 107.4 | I58 | I58-V60 VanDerWaalsContact C-N 3.34Å; I58-V60 HydrophobicContact CG2-CB 4.36Å; I58-V60 HydrophobicContact CG2-CG2 3.63Å; I58-V60 PolarHBondContact O-N 2.74Å | ||
| 61 | I | 34.7 | Very low | 37.1 | Very low | 107 Ų | 107 | 134.2 Ų | 134.2 | 55% | 0.549 | 74% | 0.736 | S | S | . | * | trans | -134.5 | 125.3 | 162.6 | -57.8 | -162.5 | 0 | 0 | 0 | 108.4 | L48 | L48-I61 HydrophobicContact CD1-CD1 3.74Å; L48-I61 HydrophobicContact CD2-CB 4.47Å; L48-I61 HydrophobicContact CD2-CD1 3.36Å; L48-I61 HydrophobicContact CD2-CG1 3.91Å; L48-I61 HydrophobicContact CG-CD1 3.42Å; L48-I61 VanDerWaalsContact CG-CD1 3.42Å; L48-I61 HydrophobicContact CG-CG1 4.46Å | ||
| 62 | M | 33.7 | Very low | 36.6 | Very low | 253 Ų | 253 | 136.4 Ų | 136.4 | 100% | 1.246 | 75% | 0.752 | S | S | * | * | trans | -55 | 0 | 171.1 | -70.4 | 172.6 | 141.4 | 0 | 0 | 113.2 |
Retrieved 62 of 62 residues in 57.6 ms
(Link to these results)