| 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 | 32.1 | Very low | 51.9 | Low | 251 Ų | 251 | 115.7 Ų | 115.7 | 100% | 1.236 | 69% | 0.689 | S | S | * | * | 0 | 104.8 | 0 | -67.6 | -173.9 | 169.9 | 0 | 0 | 107.3 | |||||
| 2 | A | 38.1 | Very low | 54 | Low | 108 Ų | 108 | 111.5 Ų | 111.5 | 89% | 0.893 | 67% | 0.666 | S | S | * | * | trans | -104.6 | 108.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 106.8 | A4 | A2-A4 PolarHBondContact O-N 2.82Š| ||
| 3 | V | 42.2 | Very low | 56 | Low | 121 Ų | 121 | 104.4 Ų | 104.4 | 73% | 0.733 | 63% | 0.625 | S | S | * | * | trans | -76.8 | 118.6 | 177.5 | 64.7 | 0 | 0 | 0 | 0 | 108.2 | G5 | V3-G5 PolarHBondContact O-N 2.98Š| ||
| 4 | A | 46.2 | Very low | 57.9 | Low | 105 Ų | 105 | 106.7 Ų | 106.7 | 87% | 0.868 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.1 | 110.3 | 169.4 | 0 | 0 | 0 | 0 | 0 | 108 | A2 | A2-A4 PolarHBondContact O-N 2.82Š|
| 5 | G | 47.3 | Very low | 59.7 | Low | 79 Ų | 79 | 102.5 Ų | 102.5 | 81% | 0.814 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 166.2 | -25.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | V3 | V3-G5 PolarHBondContact O-N 2.98Š|
| 6 | S | 52.1 | Low | 61.1 | Low | 82 Ų | 82 | 98.2 Ų | 98.2 | 57% | 0.573 | 57% | 0.572 | S | S | * | * | trans | -153.3 | 101.7 | 163.9 | 45.3 | 0 | 0 | 0 | 0 | 106.2 | Q8 | S6-Q8 PolarHBondContact O-N 3.17Š| ||
| 7 | W | 55.9 | Low | 62.4 | Low | 120 Ų | 120 | 98.9 Ų | 98.9 | 46% | 0.455 | 56% | 0.563 | S | S | . | * | trans | -72.4 | 86 | 174.9 | -173.7 | 73.2 | 0 | 0 | 0 | 107.6 | P9 N51 C52 W55 | W7-P9 HydrophobicContact CH2-CB 4.47Å; W7-P9 HydrophobicContact CH2-CG 4.45Å; W7-P9 HydrophobicContact CZ3-CG 4.45Å; W7-N51 HydrophobicContact CH2-CB 3.28Å; W7-N51 WeakPolarHBondContact CH2-O 3.31Å; W7-N51 HydrophobicContact CZ2-CB 3.6Å; W7-N51 HydrophobicContact CZ3-CB 3.82Å; W7-N51 WeakPolarHBondContact CZ3-O 3.31Å; W7-C52 HydrophobicContact CH2-CB 3.87Å; W7-C52 HydrophobicContact CZ3-CB 4.48Å; W7-W55 HydrophobicContact CE3-CB 3.74Å; W7-W55 HydrophobicContact CE3-CG 4Å; W7-W55 HydrophobicContact CZ3-CB 3.46Å; W7-W55 VanDerWaalsContact CZ3-CB 3.46Å; W7-W55 HydrophobicContact CZ3-CG 4.09Å; W7-W55 PolarHBondContact O-NE1 2.97Å | ||
| 8 | Q | 56.8 | Low | 63.8 | Low | 128 Ų | 128 | 96.3 Ų | 96.3 | 60% | 0.598 | 56% | 0.556 | S | S | * | * | trans | -101.7 | 113 | 173.7 | -167.8 | 168.9 | 9.4 | 0 | 0 | 106.9 | S6 P10 W55 | S6-Q8 PolarHBondContact O-N 3.17Å; Q8-P10 WeakPolarHBondContact O-CD 3.39Å; Q8-W55 HydrophobicContact CB-CZ2 4.37Å; Q8-W55 HydrophobicContact CG-CH2 4.03Å; Q8-W55 HydrophobicContact CG-CZ2 3.84Å | ||
| 9 | P | 62.5 | Low | 65.1 | Low | 16 Ų | 16 | 95.5 Ų | 95.5 | 10% | 0.104 | 55% | 0.546 | C | S | . | . | trans | -59.4 | 125.2 | 178.5 | 16.8 | -23.8 | 0 | 0 | 0 | 108.8 | W7 R11 Y16 C52 W55 | W7-P9 HydrophobicContact CH2-CB 4.47Å; W7-P9 HydrophobicContact CH2-CG 4.45Å; W7-P9 HydrophobicContact CZ3-CG 4.45Å; P9-R11 PolarHBondContact O-N 3.35Å; P9-Y16 HydrophobicContact CB-CE2 4.09Å; P9-C52 HydrophobicContact CG-CB 4.46Å; P9-W55 HydrophobicContact CG-CD2 4.41Å; P9-W55 HydrophobicContact CG-CE3 4.01Å; P9-W55 HydrophobicContact CG-CZ3 4.25Å | ||
| 10 | P | 67.1 | Low | 66.2 | Low | 113 Ų | 113 | 93 Ų | 93 | 73% | 0.734 | 53% | 0.527 | S | S | * | . | S | Bend | trans | -67.7 | -8 | -177.1 | 26.2 | -34.2 | 0 | 0 | 0 | 112.9 | Q8 | Q8-P10 WeakPolarHBondContact O-CD 3.39Š|
| 11 | R | 70.6 | Confident | 67.1 | Low | 150 Ų | 150 | 93.4 Ų | 93.4 | 57% | 0.566 | 53% | 0.525 | S | S | * | . | S | Bend | trans | -135.5 | 148.6 | -177.5 | -54.1 | -67 | -81.8 | -155 | -6.7 | 108.5 | P9 V15 Y16 | P9-R11 PolarHBondContact O-N 3.35Å; R11-V15 HydrophobicContact CB-CB 4.32Å; R11-V15 HydrophobicContact CB-CG1 4.39Å; R11-Y16 HydrophobicContact CB-CE2 3.95Å |
| 12 | P | 76.8 | Confident | 69.7 | Low | 65 Ų | 65 | 86.3 Ų | 86.3 | 42% | 0.422 | 49% | 0.492 | S | S | . | . | trans | -66 | 152.3 | 176.6 | 27.8 | -33.3 | 0 | 0 | 0 | 111.1 | E14 V15 | P12-E14 HydrophobicContact CB-CG 3.91Å; P12-E14 WeakPolarHBondContact CB-OE1 3.46Å; P12-E14 HydrophobicContact CG-CG 3.84Å; P12-E14 VanDerWaalsContact CG-OE1 3.25Å; P12-E14 WeakPolarHBondContact CG-OE1 3.49Å; P12-E14 PolarHBondContact O-N 3.29Å; P12-E14 VanDerWaalsContact O-N 3.11Å; P12-V15 HydrophobicContact CG-CG2 3.86Å; P12-V15 WeakPolarHBondContact O-CB 3.18Å; P12-V15 PolarHBondContact O-N 2.82Å | ||
| 13 | C | 80.9 | Confident | 71.9 | Confident | 19 Ų | 19 | 81.6 Ų | 81.6 | 13% | 0.128 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -55.2 | -30.8 | -177.6 | -115.2 | 0 | 0 | 0 | 0 | 113.7 | V15 Y16 R17 L49 C52 R53 | C13-V15 VanDerWaalsContact C-N 3.28Å; C13-V15 PolarHBondContact O-N 3.46Å; C13-Y16 PolarHBondContact O-N 2.96Å; C13-R17 PolarHBondContact O-N 3.21Å; C13-L49 WeakPolarHBondContact O-CD1 3.48Å; C13-C52 WeakPolarHBondContact CA-SG 3.36Å; C13-C52 HydrophobicContact CB-CB 4.41Å; C13-C52 WeakPolarHBondContact CB-SG 3.41Å; C13-C52 WeakPolarHBondContact SG-CB 3.46Å; C13-C52 CovalentContact SG-SG 2.03Å; C13-C52 PolarHBondContact SG-SG 3.26Å; C13-R53 PolarHBondContact SG-N 3.09Å; C13-R53 VanDerWaalsContact SG-N 3.43Å |
| 14 | E | 81.8 | Confident | 73.8 | Confident | 137 Ų | 137 | 83 Ų | 83 | 64% | 0.64 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -59.7 | -34.6 | 175.3 | 65.9 | -158.7 | 166.2 | 0 | 0 | 113.4 | P12 R17 A18 | P12-E14 HydrophobicContact CB-CG 3.91Å; P12-E14 WeakPolarHBondContact CB-OE1 3.46Å; P12-E14 HydrophobicContact CG-CG 3.84Å; P12-E14 VanDerWaalsContact CG-OE1 3.25Å; P12-E14 WeakPolarHBondContact CG-OE1 3.49Å; P12-E14 PolarHBondContact O-N 3.29Å; P12-E14 VanDerWaalsContact O-N 3.11Å; E14-R17 PolarHBondContact O-N 3.27Å; E14-A18 PolarHBondContact O-N 3.47Å |
| 15 | V | 85.1 | Confident | 75.7 | Confident | 43 Ų | 43 | 80.6 Ų | 80.6 | 26% | 0.261 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -69.3 | -45.6 | 176.5 | 174.2 | 0 | 0 | 0 | 0 | 109.9 | R11 P12 C13 R17 A18 E19 | R11-V15 HydrophobicContact CB-CB 4.32Å; R11-V15 HydrophobicContact CB-CG1 4.39Å; P12-V15 HydrophobicContact CG-CG2 3.86Å; P12-V15 WeakPolarHBondContact O-CB 3.18Å; P12-V15 PolarHBondContact O-N 2.82Å; C13-V15 VanDerWaalsContact C-N 3.28Å; C13-V15 PolarHBondContact O-N 3.46Å; V15-R17 PolarHBondContact O-N 2.91Å; V15-A18 PolarHBondContact O-N 3.23Å; V15-E19 WeakPolarHBondContact O-CG 3.46Å; V15-E19 PolarHBondContact O-N 3.06Å |
| 16 | Y | 81.6 | Confident | 77.1 | Confident | 34 Ų | 34 | 82 Ų | 82 | 13% | 0.133 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -60.5 | -35.4 | 175.7 | -71.3 | -76.6 | 0 | 0 | 0 | 112.3 | P9 R11 C13 W20 W45 D48 | P9-Y16 HydrophobicContact CB-CE2 4.09Å; R11-Y16 HydrophobicContact CB-CE2 3.95Å; C13-Y16 PolarHBondContact O-N 2.96Å; Y16-W20 WeakPolarHBondContact O-CB 3.19Å; Y16-W20 PolarHBondContact O-N 3.22Å; Y16-W45 HydrophobicContact CD1-CE3 4.11Å; Y16-W45 HydrophobicContact CD1-CZ3 4.06Å; Y16-W45 HydrophobicContact CE1-CZ3 4.28Å; Y16-D48 HydrophobicContact CD1-CB 4.01Å; Y16-D48 HydrophobicContact CE1-CB 4.09Å |
| 17 | R | 84.3 | Confident | 78.6 | Confident | 111 Ų | 111 | 80.6 Ų | 80.6 | 42% | 0.419 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -65 | -48.1 | 174.4 | 178.5 | -178.5 | -67.6 | -83.7 | -0.7 | 111.7 | C13 E14 V15 E19 W20 E21 L49 | C13-R17 PolarHBondContact O-N 3.21Å; E14-R17 PolarHBondContact O-N 3.27Å; V15-R17 PolarHBondContact O-N 2.91Å; R17-E19 VanDerWaalsContact C-N 3.33Å; R17-E19 PolarHBondContact O-N 2.85Å; R17-W20 PolarHBondContact O-N 2.85Å; R17-E21 WeakPolarHBondContact O-CG 3.31Å; R17-E21 PolarHBondContact O-N 2.77Å; R17-L49 HydrophobicContact CB-CD1 4Å; R17-L49 HydrophobicContact CB-CD2 4.34Å |
| 18 | A | 87.8 | Confident | 79.6 | Confident | 51 Ų | 51 | 79 Ų | 79 | 42% | 0.421 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -60 | -43.6 | 179 | 0 | 0 | 0 | 0 | 0 | 111.6 | E14 V15 W20 E21 L22 | E14-A18 PolarHBondContact O-N 3.47Å; V15-A18 PolarHBondContact O-N 3.23Å; A18-W20 PolarHBondContact O-N 2.84Å; A18-E21 PolarHBondContact O-N 3.18Å; A18-L22 WeakPolarHBondContact O-CB 3.24Å; A18-L22 PolarHBondContact O-N 3.37Å |
| 19 | E | 87.1 | Confident | 80.9 | Confident | 81 Ų | 81 | 74.2 Ų | 74.2 | 38% | 0.379 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.4 | -39.2 | 176.6 | -66.6 | -60.1 | 127.6 | 0 | 0 | 112.2 | V15 R17 L22 C23 W45 | V15-E19 WeakPolarHBondContact O-CG 3.46Å; V15-E19 PolarHBondContact O-N 3.06Å; R17-E19 VanDerWaalsContact C-N 3.33Å; R17-E19 PolarHBondContact O-N 2.85Å; E19-L22 PolarHBondContact O-N 3.02Å; E19-C23 WeakPolarHBondContact O-CB 3.47Å; E19-C23 PolarHBondContact O-N 3.49Å; E19-W45 HydrophobicContact CB-CD2 4.27Å; E19-W45 HydrophobicContact CB-CE3 4.02Å; E19-W45 HydrophobicContact CB-CH2 4.42Å; E19-W45 HydrophobicContact CB-CZ3 4.1Å; E19-W45 HydrophobicContact CG-CH2 4.46Å; E19-W45 HydrophobicContact CG-CZ3 4.32Å |
| 20 | W | 86.9 | Confident | 82 | Confident | 45 Ų | 45 | 78.6 Ų | 78.6 | 17% | 0.17 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -66.5 | -40.7 | 175.7 | 176.7 | 75.9 | 0 | 0 | 0 | 112.5 | Y16 R17 A18 C23 R24 W45 L46 | Y16-W20 WeakPolarHBondContact O-CB 3.19Å; Y16-W20 PolarHBondContact O-N 3.22Å; R17-W20 PolarHBondContact O-N 2.85Å; A18-W20 PolarHBondContact O-N 2.84Å; W20-C23 PolarHBondContact O-N 3.11Å; W20-R24 VanDerWaalsContact CE2-CD 3.4Å; W20-R24 VanDerWaalsContact CZ2-CD 3.43Å; W20-R24 WeakPolarHBondContact O-CG 3.27Å; W20-R24 PolarHBondContact O-N 2.78Å; W20-W45 HydrophobicContact CB-CB 4.06Å; W20-L46 HydrophobicContact CZ2-CD1 4Å |
| 21 | E | 86.7 | Confident | 82.8 | Confident | 102 Ų | 102 | 79.2 Ų | 79.2 | 48% | 0.477 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.5 | -40.6 | 174.4 | -73.2 | 177.3 | 167.4 | 0 | 0 | 111.5 | R17 A18 R24 S25 | R17-E21 WeakPolarHBondContact O-CG 3.31Å; R17-E21 PolarHBondContact O-N 2.77Å; A18-E21 PolarHBondContact O-N 3.18Å; E21-R24 CarbonylContact O-C 3.59Å; E21-R24 PolarHBondContact O-N 3.02Å; E21-S25 PolarHBondContact O-N 3.32Å; E21-S25 PolarHBondContact O-OG 3.3Å |
| 22 | L | 85.9 | Confident | 83.4 | Confident | 103 Ų | 103 | 74.2 Ų | 74.2 | 54% | 0.539 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -62.3 | -44.4 | 172.7 | -164.3 | 89.2 | 0 | 0 | 0 | 111.2 | A18 E19 R24 S25 | A18-L22 WeakPolarHBondContact O-CB 3.24Å; A18-L22 PolarHBondContact O-N 3.37Å; E19-L22 PolarHBondContact O-N 3.02Å; L22-R24 VanDerWaalsContact C-N 3.26Å; L22-R24 PolarHBondContact O-N 2.85Å; L22-S25 WeakPolarHBondContact O-CB 3.5Å; L22-S25 PolarHBondContact O-N 2.98Å |
| 23 | C | 83.8 | Confident | 83.9 | Confident | 9 Ų | 9 | 77.3 Ų | 77.3 | 6% | 0.061 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -59.7 | -38.6 | 177.7 | -172.6 | 0 | 0 | 0 | 0 | 112 | E19 W20 S25 V29 C42 | E19-C23 WeakPolarHBondContact O-CB 3.47Å; E19-C23 PolarHBondContact O-N 3.49Å; W20-C23 PolarHBondContact O-N 3.11Å; C23-S25 VanDerWaalsContact C-N 3.33Å; C23-V29 WeakPolarHBondContact O-CG2 3.44Å; C23-C42 HydrophobicContact CB-CB 3.91Å; C23-C42 WeakPolarHBondContact CB-SG 3.48Å; C23-C42 PolarHBondContact O-SG 2.97Å; C23-C42 WeakPolarHBondContact SG-CA 3.47Å; C23-C42 WeakPolarHBondContact SG-CB 3.35Å; C23-C42 CovalentContact SG-SG 2.04Å; C23-C42 PolarHBondContact SG-SG 2.03Å |
| 24 | R | 81.8 | Confident | 84.2 | Confident | 150 Ų | 150 | 86.2 Ų | 86.2 | 57% | 0.566 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -81.1 | -10.4 | 176.7 | -72.4 | -177.4 | 64.8 | -159.7 | -1 | 114.1 | W20 E21 L22 V26 C42 | W20-R24 VanDerWaalsContact CE2-CD 3.4Å; W20-R24 VanDerWaalsContact CZ2-CD 3.43Å; W20-R24 WeakPolarHBondContact O-CG 3.27Å; W20-R24 PolarHBondContact O-N 2.78Å; E21-R24 CarbonylContact O-C 3.59Å; E21-R24 PolarHBondContact O-N 3.02Å; L22-R24 VanDerWaalsContact C-N 3.26Å; L22-R24 PolarHBondContact O-N 2.85Å; R24-V26 PolarHBondContact O-N 3.02Å; R24-C42 HydrophobicContact CG-CB 4.5Å |
| 25 | S | 86.2 | Confident | 84.6 | Confident | 54 Ų | 54 | 83.5 Ų | 83.5 | 38% | 0.378 | 42% | 0.416 | S | S | . | . | trans | -62.7 | 137.1 | -176.5 | -71.1 | 0 | 0 | 0 | 0 | 111 | E21 L22 C23 G27 H28 V29 | E21-S25 PolarHBondContact O-N 3.32Å; E21-S25 PolarHBondContact O-OG 3.3Å; L22-S25 WeakPolarHBondContact O-CB 3.5Å; L22-S25 PolarHBondContact O-N 2.98Å; C23-S25 VanDerWaalsContact C-N 3.33Å; S25-G27 PolarHBondContact O-N 3.47Å; S25-H28 PolarHBondContact O-N 3.28Å; S25-H28 VanDerWaalsContact O-N 3.09Å; S25-V29 WeakPolarHBondContact O-CG2 3.25Å; S25-V29 PolarHBondContact O-N 3.23Å | ||
| 26 | V | 77.9 | Confident | 84.7 | Confident | 108 Ų | 108 | 86.7 Ų | 86.7 | 66% | 0.655 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -55.6 | -40.3 | -172.5 | 176.1 | 0 | 0 | 0 | 0 | 111.7 | R24 H28 V29 L30 | R24-V26 PolarHBondContact O-N 3.02Å; V26-H28 PolarHBondContact O-N 2.96Å; V26-V29 PolarHBondContact O-N 3.02Å; V26-L30 HydrophobicContact CG1-CD1 3.59Å; V26-L30 HydrophobicContact CG1-CG 4.01Å; V26-L30 VanDerWaalsContact O-CB 3.3Å; V26-L30 WeakPolarHBondContact O-CB 3.49Å; V26-L30 WeakPolarHBondContact O-CG 3.45Å; V26-L30 PolarHBondContact O-N 2.85Å |
| 27 | G | 83.1 | Confident | 85 | Confident | 54 Ų | 54 | 87.6 Ų | 87.6 | 56% | 0.557 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -61.2 | -46.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | S25 L30 H31 | S25-G27 PolarHBondContact O-N 3.47Å; G27-L30 PolarHBondContact O-N 3.39Å; G27-H31 WeakPolarHBondContact O-CB 3.03Å; G27-H31 PolarHBondContact O-N 2.91Å |
| 28 | H | 77.8 | Confident | 84.9 | Confident | 85 Ų | 85 | 88.9 Ų | 88.9 | 39% | 0.394 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -69.4 | -40.4 | -179.7 | -172.7 | -129.7 | 0 | 0 | 0 | 111.7 | S25 V26 H32 | S25-H28 PolarHBondContact O-N 3.28Å; S25-H28 VanDerWaalsContact O-N 3.09Å; V26-H28 PolarHBondContact O-N 2.96Å; H28-H32 VanDerWaalsContact O-CB 3.24Å; H28-H32 WeakPolarHBondContact O-CB 3.31Å; H28-H32 PolarHBondContact O-N 3.38Å |
| 29 | V | 83.6 | Confident | 84.4 | Confident | 28 Ų | 28 | 95.8 Ų | 95.8 | 17% | 0.17 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -64.2 | -45.3 | 175.8 | 176.1 | 0 | 0 | 0 | 0 | 111.3 | C23 S25 V26 H32 Y33 R39 P40 | C23-V29 WeakPolarHBondContact O-CG2 3.44Å; S25-V29 WeakPolarHBondContact O-CG2 3.25Å; S25-V29 PolarHBondContact O-N 3.23Å; V26-V29 PolarHBondContact O-N 3.02Å; V29-H32 PolarHBondContact O-N 3Å; V29-Y33 WeakPolarHBondContact O-CB 3.32Å; V29-Y33 PolarHBondContact O-N 3.45Å; V29-R39 HydrophobicContact CG1-CG 4.29Å; V29-P40 HydrophobicContact CG2-CG 4.07Å |
| 30 | L | 85.1 | Confident | 84.2 | Confident | 108 Ų | 108 | 92.8 Ų | 92.8 | 57% | 0.565 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -64.7 | -45 | 179.8 | -74.2 | 175.4 | 0 | 0 | 0 | 111.8 | V26 G27 Y33 Y34 | V26-L30 HydrophobicContact CG1-CD1 3.59Å; V26-L30 HydrophobicContact CG1-CG 4.01Å; V26-L30 VanDerWaalsContact O-CB 3.3Å; V26-L30 WeakPolarHBondContact O-CB 3.49Å; V26-L30 WeakPolarHBondContact O-CG 3.45Å; V26-L30 PolarHBondContact O-N 2.85Å; G27-L30 PolarHBondContact O-N 3.39Å; L30-Y33 PolarHBondContact O-N 3.31Å; L30-Y34 VanDerWaalsContact O-CB 3.28Å; L30-Y34 WeakPolarHBondContact O-CB 3.04Å; L30-Y34 PolarHBondContact O-N 3.13Å |
| 31 | H | 84.4 | Confident | 84 | Confident | 126 Ų | 126 | 95.1 Ų | 95.1 | 58% | 0.583 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -61.5 | -48.1 | 177.5 | -176.7 | -92.4 | 0 | 0 | 0 | 111.2 | G27 Y33 Y34 V35 | G27-H31 WeakPolarHBondContact O-CB 3.03Å; G27-H31 PolarHBondContact O-N 2.91Å; H31-Y33 VanDerWaalsContact C-N 3.31Å; H31-Y33 PolarHBondContact O-N 3.42Å; H31-Y34 PolarHBondContact O-N 3.3Å; H31-V35 WeakPolarHBondContact O-CG2 3.49Å; H31-V35 PolarHBondContact O-N 2.97Å |
| 32 | H | 82.9 | Confident | 83.9 | Confident | 46 Ų | 46 | 91.2 Ų | 91.2 | 21% | 0.213 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -66.5 | -34.7 | 179.3 | -162.2 | -73.6 | 0 | 0 | 0 | 112.2 | H28 V29 H36 K38 P40 | H28-H32 VanDerWaalsContact O-CB 3.24Å; H28-H32 WeakPolarHBondContact O-CB 3.31Å; H28-H32 PolarHBondContact O-N 3.38Å; V29-H32 PolarHBondContact O-N 3Å; H32-H36 AromaticContact CD2-CD2 3.77Å; H32-H36 AromaticContact CE1-CD2 3.42Å; H32-H36 PolarHBondContact CE1-CD2 3.26Å; H32-H36 VanDerWaalsContact CE1-CD2 3.42Å; H32-H36 AromaticContact CE1-CG 3.95Å; H32-H36 AromaticContact CG-CD2 3.87Å; H32-H36 AromaticContact ND1-CD2 3.66Å; H32-H36 AromaticContact NE2-CD2 3.5Å; H32-H36 WeakPolarHBondContact O-CB 3.48Å; H32-H36 PolarHBondContact O-N 3.01Å; H32-K38 PolarHBondContact ND1-O 3.39Å; H32-K38 VanDerWaalsContact ND1-O 3.09Å; H32-P40 HydrophobicContact CB-CB 4.44Å; H32-P40 HydrophobicContact CB-CG 4.28Å |
| 33 | Y | 86.9 | Confident | 83.7 | Confident | 130 Ų | 130 | 95.3 Ų | 95.3 | 51% | 0.51 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -69.3 | -39.3 | 174.4 | -170.2 | -100.2 | 0 | 0 | 0 | 112 | V29 L30 H31 G37 R39 | V29-Y33 WeakPolarHBondContact O-CB 3.32Å; V29-Y33 PolarHBondContact O-N 3.45Å; L30-Y33 PolarHBondContact O-N 3.31Å; H31-Y33 VanDerWaalsContact C-N 3.31Å; H31-Y33 PolarHBondContact O-N 3.42Å; Y33-G37 WeakPolarHBondContact CE2-O 3.48Å; Y33-G37 WeakPolarHBondContact O-CA 3.24Å; Y33-G37 PolarHBondContact O-N 3.31Å; Y33-R39 HydrophobicContact CD2-CG 4.27Å |
| 34 | Y | 87.3 | Confident | 83.6 | Confident | 206 Ų | 206 | 101.8 Ų | 101.8 | 81% | 0.808 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.8 | -43.1 | 176 | -179.8 | -99.1 | 0 | 0 | 0 | 111.9 | L30 H31 | L30-Y34 VanDerWaalsContact O-CB 3.28Å; L30-Y34 WeakPolarHBondContact O-CB 3.04Å; L30-Y34 PolarHBondContact O-N 3.13Å; H31-Y34 PolarHBondContact O-N 3.3Å |
| 35 | V | 91.1 | Very high | 83.7 | Confident | 79 Ų | 79 | 99 Ų | 99 | 48% | 0.479 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -78.6 | -43.5 | -177.8 | 177.4 | 0 | 0 | 0 | 0 | 112.5 | H31 | H31-V35 WeakPolarHBondContact O-CG2 3.49Å; H31-V35 PolarHBondContact O-N 2.97Å |
| 36 | H | 86.3 | Confident | 83.7 | Confident | 110 Ų | 110 | 100 Ų | 100 | 51% | 0.509 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -110 | -6.1 | -170.6 | -60.5 | -66.9 | 0 | 0 | 0 | 114.4 | H32 K38 | H32-H36 AromaticContact CD2-CD2 3.77Å; H32-H36 AromaticContact CE1-CD2 3.42Å; H32-H36 PolarHBondContact CE1-CD2 3.26Å; H32-H36 VanDerWaalsContact CE1-CD2 3.42Å; H32-H36 AromaticContact CE1-CG 3.95Å; H32-H36 AromaticContact CG-CD2 3.87Å; H32-H36 AromaticContact ND1-CD2 3.66Å; H32-H36 AromaticContact NE2-CD2 3.5Å; H32-H36 WeakPolarHBondContact O-CB 3.48Å; H32-H36 PolarHBondContact O-N 3.01Å; H36-K38 HydrophobicContact CB-CG 3.97Å; H36-K38 PolarHBondContact O-N 3.03Å; H36-K38 VanDerWaalsContact O-N 3.08Å |
| 37 | G | 87.4 | Confident | 84 | Confident | 54 Ų | 54 | 103.5 Ų | 103.5 | 56% | 0.557 | 49% | 0.488 | S | S | * | . | S | Bend | trans | 67.8 | 3.1 | -176.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y33 | Y33-G37 WeakPolarHBondContact CE2-O 3.48Å; Y33-G37 WeakPolarHBondContact O-CA 3.24Å; Y33-G37 PolarHBondContact O-N 3.31Å |
| 38 | K | 82.7 | Confident | 84.1 | Confident | 137 Ų | 137 | 103.7 Ų | 103.7 | 60% | 0.596 | 48% | 0.477 | S | S | * | . | S | Bend | trans | -133.1 | 145 | -176.7 | 63.1 | -176.8 | 177.1 | -179.2 | 0 | 111 | H32 H36 | H32-K38 PolarHBondContact ND1-O 3.39Å; H32-K38 VanDerWaalsContact ND1-O 3.09Å; H36-K38 HydrophobicContact CB-CG 3.97Å; H36-K38 PolarHBondContact O-N 3.03Å; H36-K38 VanDerWaalsContact O-N 3.08Å |
| 39 | R | 78.3 | Confident | 84.4 | Confident | 196 Ų | 196 | 100.5 Ų | 100.5 | 74% | 0.74 | 46% | 0.462 | S | S | * | . | trans | -66.3 | 142.6 | 175 | -67.1 | -172.1 | 178.3 | -152.2 | -0.1 | 109.8 | V29 Y33 | V29-R39 HydrophobicContact CG1-CG 4.29Å; Y33-R39 HydrophobicContact CD2-CG 4.27Å | ||
| 40 | P | 83.1 | Confident | 84.5 | Confident | 18 Ų | 18 | 102.2 Ų | 102.2 | 12% | 0.117 | 47% | 0.473 | C | S | . | . | trans | -63.4 | 142 | 174.8 | 26.6 | -31.6 | 0 | 0 | 0 | 109.9 | V29 H32 C42 | V29-P40 HydrophobicContact CG2-CG 4.07Å; H32-P40 HydrophobicContact CB-CB 4.44Å; H32-P40 HydrophobicContact CB-CG 4.28Å; P40-C42 PolarHBondContact O-N 3.43Å; P40-C42 VanDerWaalsContact O-N 3.14Å | ||
| 41 | D | 80.9 | Confident | 84.4 | Confident | 95 Ų | 95 | 99.6 Ų | 99.6 | 51% | 0.508 | 46% | 0.459 | S | S | . | . | trans | -85.6 | 87.3 | -177.7 | -153.1 | -37 | 0 | 0 | 0 | 110.8 | R43 | D41-R43 PolarHBondContact O-N 3.2Å; D41-R43 WeakPolarHBondContact OD1-CB 3.45Å; D41-R43 VanDerWaalsContact OD1-CD 3.24Å; D41-R43 WeakPolarHBondContact OD1-CD 3.39Å; D41-R43 WeakPolarHBondContact OD1-CG 3.37Å; D41-R43 PolarHBondContact OD1-N 3.32Å; D41-R43 IonicContact OD1-NE 3.43Å; D41-R43 PolarHBondContact OD1-NE 3.01Å; D41-R43 IonicContact OD2-NE 3.89Å | ||
| 42 | C | 84.9 | Confident | 84.3 | Confident | 20 Ų | 20 | 93.6 Ų | 93.6 | 14% | 0.135 | 43% | 0.432 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77 | 4.6 | 178.5 | -53.4 | 0 | 0 | 0 | 0 | 113.7 | C23 R24 P40 Q44 W45 L46 | C23-C42 HydrophobicContact CB-CB 3.91Å; C23-C42 WeakPolarHBondContact CB-SG 3.48Å; C23-C42 PolarHBondContact O-SG 2.97Å; C23-C42 WeakPolarHBondContact SG-CA 3.47Å; C23-C42 WeakPolarHBondContact SG-CB 3.35Å; C23-C42 CovalentContact SG-SG 2.04Å; C23-C42 PolarHBondContact SG-SG 2.03Å; R24-C42 HydrophobicContact CG-CB 4.5Å; P40-C42 PolarHBondContact O-N 3.43Å; P40-C42 VanDerWaalsContact O-N 3.14Å; C42-Q44 VanDerWaalsContact C-N 3.3Å; C42-Q44 PolarHBondContact O-N 2.92Å; C42-W45 PolarHBondContact O-N 3.38Å; C42-L46 PolarHBondContact O-N 2.93Å; C42-L46 VanDerWaalsContact O-N 3.15Å |
| 43 | R | 83.1 | Confident | 84.3 | Confident | 189 Ų | 189 | 99.3 Ų | 99.3 | 71% | 0.713 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -68.4 | -30.5 | -177.2 | -61.8 | 173 | -152.1 | -174.6 | 6 | 112.3 | D41 L46 R47 | D41-R43 PolarHBondContact O-N 3.2Å; D41-R43 WeakPolarHBondContact OD1-CB 3.45Å; D41-R43 VanDerWaalsContact OD1-CD 3.24Å; D41-R43 WeakPolarHBondContact OD1-CD 3.39Å; D41-R43 WeakPolarHBondContact OD1-CG 3.37Å; D41-R43 PolarHBondContact OD1-N 3.32Å; D41-R43 IonicContact OD1-NE 3.43Å; D41-R43 PolarHBondContact OD1-NE 3.01Å; D41-R43 IonicContact OD2-NE 3.89Å; R43-L46 PolarHBondContact O-N 3.07Å; R43-R47 WeakPolarHBondContact O-CB 2.93Å; R43-R47 PolarHBondContact O-N 2.96Å |
| 44 | Q | 81.2 | Confident | 84.2 | Confident | 144 Ų | 144 | 98.5 Ų | 98.5 | 67% | 0.673 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -62.3 | -51.3 | 175.5 | -72.4 | -167.2 | 84.1 | 0 | 0 | 110.9 | C42 L46 R47 D48 | C42-Q44 VanDerWaalsContact C-N 3.3Å; C42-Q44 PolarHBondContact O-N 2.92Å; Q44-L46 VanDerWaalsContact C-N 3.29Å; Q44-L46 PolarHBondContact O-N 3.04Å; Q44-R47 WeakPolarHBondContact O-CB 3.32Å; Q44-R47 PolarHBondContact O-N 3.46Å; Q44-R47 VanDerWaalsContact O-N 3.07Å; Q44-D48 PolarHBondContact O-N 3.31Å |
| 45 | W | 84.3 | Confident | 83.8 | Confident | 92 Ų | 92 | 91.8 Ų | 91.8 | 35% | 0.348 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -59.1 | -38.4 | 176 | -65 | 114.8 | 0 | 0 | 0 | 113.3 | Y16 E19 W20 C42 L49 | Y16-W45 HydrophobicContact CD1-CE3 4.11Å; Y16-W45 HydrophobicContact CD1-CZ3 4.06Å; Y16-W45 HydrophobicContact CE1-CZ3 4.28Å; E19-W45 HydrophobicContact CB-CD2 4.27Å; E19-W45 HydrophobicContact CB-CE3 4.02Å; E19-W45 HydrophobicContact CB-CH2 4.42Å; E19-W45 HydrophobicContact CB-CZ3 4.1Å; E19-W45 HydrophobicContact CG-CH2 4.46Å; E19-W45 HydrophobicContact CG-CZ3 4.32Å; W20-W45 HydrophobicContact CB-CB 4.06Å; C42-W45 PolarHBondContact O-N 3.38Å; W45-L49 WeakPolarHBondContact O-CB 3.42Å; W45-L49 PolarHBondContact O-N 3.18Å |
| 46 | L | 84.6 | Confident | 83.2 | Confident | 75 Ų | 75 | 92.7 Ų | 92.7 | 39% | 0.393 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -63.2 | -44.6 | 174.9 | -177.7 | 62.9 | 0 | 0 | 0 | 111.5 | W20 C42 R43 Q44 L49 T50 | W20-L46 HydrophobicContact CZ2-CD1 4Å; C42-L46 PolarHBondContact O-N 2.93Å; C42-L46 VanDerWaalsContact O-N 3.15Å; R43-L46 PolarHBondContact O-N 3.07Å; Q44-L46 VanDerWaalsContact C-N 3.29Å; Q44-L46 PolarHBondContact O-N 3.04Å; L46-L49 PolarHBondContact O-N 2.91Å; L46-T50 PolarHBondContact O-N 2.84Å; L46-T50 PolarHBondContact O-OG1 3.45Å; L46-T50 VanDerWaalsContact O-OG1 3.11Å |
| 47 | R | 86 | Confident | 82.8 | Confident | 182 Ų | 182 | 94 Ų | 94 | 69% | 0.687 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -64.3 | -43 | 179.5 | -167.9 | 177 | -173.7 | -179.8 | 1 | 111.3 | R43 Q44 T50 N51 | R43-R47 WeakPolarHBondContact O-CB 2.93Å; R43-R47 PolarHBondContact O-N 2.96Å; Q44-R47 WeakPolarHBondContact O-CB 3.32Å; Q44-R47 PolarHBondContact O-N 3.46Å; Q44-R47 VanDerWaalsContact O-N 3.07Å; R47-T50 PolarHBondContact O-N 3.41Å; R47-N51 WeakPolarHBondContact O-CB 3.43Å; R47-N51 PolarHBondContact O-N 2.9Å; R47-N51 PolarHBondContact O-ND2 3.48Å; R47-N51 PolarHBondContact O-OD1 2.93Å |
| 48 | D | 83.9 | Confident | 82.2 | Confident | 58 Ų | 58 | 94.2 Ų | 94.2 | 31% | 0.31 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -65.3 | -39.7 | 177.6 | -67 | -28.2 | 0 | 0 | 0 | 111.8 | Y16 Q44 C52 | Y16-D48 HydrophobicContact CD1-CB 4.01Å; Y16-D48 HydrophobicContact CE1-CB 4.09Å; Q44-D48 PolarHBondContact O-N 3.31Å; D48-C52 VanDerWaalsContact O-CB 3.24Å; D48-C52 WeakPolarHBondContact O-CB 3.42Å; D48-C52 PolarHBondContact O-N 3.23Å |
| 49 | L | 85.3 | Confident | 81.5 | Confident | 17 Ų | 17 | 94.3 Ų | 94.3 | 9% | 0.089 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -64 | -42.9 | 173.7 | -179.1 | 65.4 | 0 | 0 | 0 | 112.1 | C13 R17 W45 L46 C52 R53 | C13-L49 WeakPolarHBondContact O-CD1 3.48Å; R17-L49 HydrophobicContact CB-CD1 4Å; R17-L49 HydrophobicContact CB-CD2 4.34Å; W45-L49 WeakPolarHBondContact O-CB 3.42Å; W45-L49 PolarHBondContact O-N 3.18Å; L46-L49 PolarHBondContact O-N 2.91Å; L49-C52 PolarHBondContact O-N 2.04Å; L49-R53 PolarHBondContact O-N 3.11Å |
| 50 | T | 85.8 | Confident | 80.9 | Confident | 65 Ų | 65 | 88.4 Ų | 88.4 | 40% | 0.399 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -62.7 | -50.7 | 176.7 | -65.8 | 0 | 0 | 0 | 0 | 111 | L46 R47 C52 R53 E54 | L46-T50 PolarHBondContact O-N 2.84Å; L46-T50 PolarHBondContact O-OG1 3.45Å; L46-T50 VanDerWaalsContact O-OG1 3.11Å; R47-T50 PolarHBondContact O-N 3.41Å; T50-C52 PolarHBondContact O-N 3.14Å; T50-R53 PolarHBondContact O-N 3.42Å; T50-E54 WeakPolarHBondContact O-CG 3.47Å; T50-E54 PolarHBondContact O-N 3.45Å |
| 51 | N | 82.3 | Confident | 80 | Confident | 52 Ų | 52 | 90 Ų | 90 | 28% | 0.278 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -55.5 | -41.5 | 176.9 | -65.2 | -19.6 | 0 | 0 | 0 | 110.2 | W7 R47 R53 E54 W55 | W7-N51 HydrophobicContact CH2-CB 3.28Å; W7-N51 WeakPolarHBondContact CH2-O 3.31Å; W7-N51 HydrophobicContact CZ2-CB 3.6Å; W7-N51 HydrophobicContact CZ3-CB 3.82Å; W7-N51 WeakPolarHBondContact CZ3-O 3.31Å; R47-N51 WeakPolarHBondContact O-CB 3.43Å; R47-N51 PolarHBondContact O-N 2.9Å; R47-N51 PolarHBondContact O-ND2 3.48Å; R47-N51 PolarHBondContact O-OD1 2.93Å; N51-R53 VanDerWaalsContact C-N 3.34Å; N51-R53 PolarHBondContact O-N 3.34Å; N51-E54 PolarHBondContact O-N 3.24Å; N51-W55 PolarHBondContact O-N 2.78Å |
| 52 | C | 82.9 | Confident | 79 | Confident | 1 Ų | 1 | 91.2 Ų | 91.2 | 1% | 0.007 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -66.7 | -39.6 | -175.6 | 169 | 0 | 0 | 0 | 0 | 111.2 | W7 P9 C13 D48 L49 T50 W55 E56 | W7-C52 HydrophobicContact CH2-CB 3.87Å; W7-C52 HydrophobicContact CZ3-CB 4.48Å; P9-C52 HydrophobicContact CG-CB 4.46Å; C13-C52 WeakPolarHBondContact CA-SG 3.36Å; C13-C52 HydrophobicContact CB-CB 4.41Å; C13-C52 WeakPolarHBondContact CB-SG 3.41Å; C13-C52 WeakPolarHBondContact SG-CB 3.46Å; C13-C52 CovalentContact SG-SG 2.03Å; C13-C52 PolarHBondContact SG-SG 3.26Å; D48-C52 VanDerWaalsContact O-CB 3.24Å; D48-C52 WeakPolarHBondContact O-CB 3.42Å; D48-C52 PolarHBondContact O-N 3.23Å; L49-C52 PolarHBondContact O-N 2.04Å; T50-C52 PolarHBondContact O-N 3.14Å; C52-W55 PolarHBondContact O-N 3.04Å; C52-E56 PolarHBondContact O-N 3.32Å |
| 53 | R | 82.6 | Confident | 77.7 | Confident | 165 Ų | 165 | 92.6 Ų | 92.6 | 62% | 0.623 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -66.9 | -42.4 | 175 | -169.4 | 178.7 | -178.4 | 175.5 | 0.4 | 112.1 | C13 L49 T50 N51 W55 E56 E57 | C13-R53 PolarHBondContact SG-N 3.09Å; C13-R53 VanDerWaalsContact SG-N 3.43Å; L49-R53 PolarHBondContact O-N 3.11Å; T50-R53 PolarHBondContact O-N 3.42Å; N51-R53 VanDerWaalsContact C-N 3.34Å; N51-R53 PolarHBondContact O-N 3.34Å; R53-W55 VanDerWaalsContact C-N 3.3Å; R53-W55 PolarHBondContact O-N 2.96Å; R53-E56 PolarHBondContact O-N 3.49Å; R53-E57 WeakPolarHBondContact O-CB 3.04Å; R53-E57 PolarHBondContact O-N 3.15Å |
| 54 | E | 83.6 | Confident | 76.3 | Confident | 114 Ų | 114 | 90.6 Ų | 90.6 | 53% | 0.533 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -60.9 | -41.5 | 175.1 | -72.2 | -175 | 145.4 | 0 | 0 | 111 | T50 N51 E57 S58 | T50-E54 WeakPolarHBondContact O-CG 3.47Å; T50-E54 PolarHBondContact O-N 3.45Å; N51-E54 PolarHBondContact O-N 3.24Å; E54-E57 PolarHBondContact O-N 3Å; E54-S58 WeakPolarHBondContact O-CB 3.44Å; E54-S58 PolarHBondContact O-N 3.31Å; E54-S58 PolarHBondContact O-OG 3.43Å; E54-S58 VanDerWaalsContact O-OG 3.13Å |
| 55 | W | 79.8 | Confident | 75.1 | Confident | 65 Ų | 65 | 88.1 Ų | 88.1 | 25% | 0.246 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -65.2 | -40.2 | 175.5 | 179.2 | 86.6 | 0 | 0 | 0 | 113.5 | W7 Q8 P9 N51 C52 R53 E57 R59 | W7-W55 HydrophobicContact CE3-CB 3.74Å; W7-W55 HydrophobicContact CE3-CG 4Å; W7-W55 HydrophobicContact CZ3-CB 3.46Å; W7-W55 VanDerWaalsContact CZ3-CB 3.46Å; W7-W55 HydrophobicContact CZ3-CG 4.09Å; W7-W55 PolarHBondContact O-NE1 2.97Å; Q8-W55 HydrophobicContact CB-CZ2 4.37Å; Q8-W55 HydrophobicContact CG-CH2 4.03Å; Q8-W55 HydrophobicContact CG-CZ2 3.84Å; P9-W55 HydrophobicContact CG-CD2 4.41Å; P9-W55 HydrophobicContact CG-CE3 4.01Å; P9-W55 HydrophobicContact CG-CZ3 4.25Å; N51-W55 PolarHBondContact O-N 2.78Å; C52-W55 PolarHBondContact O-N 3.04Å; R53-W55 VanDerWaalsContact C-N 3.3Å; R53-W55 PolarHBondContact O-N 2.96Å; W55-E57 VanDerWaalsContact C-N 3.31Å; W55-E57 PolarHBondContact O-N 3.32Å; W55-R59 VanDerWaalsContact CH2-NH1 3.33Å; W55-R59 WeakPolarHBondContact O-CB 3.06Å; W55-R59 PolarHBondContact O-N 3.32Å |
| 56 | E | 77.6 | Confident | 73.5 | Confident | 98 Ų | 98 | 87.4 Ų | 87.4 | 46% | 0.458 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63.8 | -38 | 174.3 | -76.4 | -162.8 | 105.2 | 0 | 0 | 112.4 | C52 R53 S60 | C52-E56 PolarHBondContact O-N 3.32Å; R53-E56 PolarHBondContact O-N 3.49Å; E56-S60 VanDerWaalsContact O-CB 3.32Å; E56-S60 WeakPolarHBondContact O-CB 3.22Å; E56-S60 PolarHBondContact O-N 3.09Å; E56-S60 PolarHBondContact O-OG 3.5Å |
| 57 | E | 77.9 | Confident | 71.8 | Confident | 138 Ų | 138 | 90.3 Ų | 90.3 | 65% | 0.645 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -69.3 | -47.6 | 178.4 | -166.8 | 170.9 | 102.8 | 0 | 0 | 111.4 | R53 E54 W55 S60 A61 | R53-E57 WeakPolarHBondContact O-CB 3.04Å; R53-E57 PolarHBondContact O-N 3.15Å; E54-E57 PolarHBondContact O-N 3Å; W55-E57 VanDerWaalsContact C-N 3.31Å; W55-E57 PolarHBondContact O-N 3.32Å; E57-S60 WeakPolarHBondContact O-CB 3.35Å; E57-S60 PolarHBondContact O-N 3.08Å; E57-A61 WeakPolarHBondContact O-CB 3.5Å; E57-A61 PolarHBondContact O-N 3.49Å |
| 58 | S | 74.7 | Confident | 69.9 | Low | 58 Ų | 58 | 88.2 Ų | 88.2 | 41% | 0.406 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -58.3 | -49.5 | 172.6 | -68.7 | 0 | 0 | 0 | 0 | 111.3 | E54 S60 A61 E62 | E54-S58 WeakPolarHBondContact O-CB 3.44Å; E54-S58 PolarHBondContact O-N 3.31Å; E54-S58 PolarHBondContact O-OG 3.43Å; E54-S58 VanDerWaalsContact O-OG 3.13Å; S58-S60 PolarHBondContact O-N 3.09Å; S58-A61 CarbonylContact O-C 3.55Å; S58-A61 WeakPolarHBondContact O-CA 3.09Å; S58-A61 WeakPolarHBondContact O-CB 3.24Å; S58-A61 PolarHBondContact O-N 3.03Å; S58-E62 WeakPolarHBondContact CA-OE2 3.47Å; S58-E62 VanDerWaalsContact CB-OE2 3.24Å; S58-E62 WeakPolarHBondContact CB-OE2 3.28Å; S58-E62 WeakPolarHBondContact O-CB 3.35Å; S58-E62 WeakPolarHBondContact O-CG 3.4Å; S58-E62 PolarHBondContact O-N 3.42Å |
| 59 | R | 69.7 | Low | 68.2 | Low | 138 Ų | 138 | 92.4 Ų | 92.4 | 52% | 0.521 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.5 | -31.5 | 178.2 | -153.7 | -170.7 | 84.2 | 172.5 | 3.8 | 112.6 | W55 A63 | W55-R59 VanDerWaalsContact CH2-NH1 3.33Å; W55-R59 WeakPolarHBondContact O-CB 3.06Å; W55-R59 PolarHBondContact O-N 3.32Å; R59-A63 WeakPolarHBondContact O-CB 3.18Å; R59-A63 PolarHBondContact O-N 2.9Å |
| 60 | S | 64.1 | Low | 66.5 | Low | 73 Ų | 73 | 102.5 Ų | 102.5 | 51% | 0.51 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -72.3 | -40.1 | 173.1 | -62.7 | 0 | 0 | 0 | 0 | 111.8 | E56 E57 S58 A63 Q64 | E56-S60 VanDerWaalsContact O-CB 3.32Å; E56-S60 WeakPolarHBondContact O-CB 3.22Å; E56-S60 PolarHBondContact O-N 3.09Å; E56-S60 PolarHBondContact O-OG 3.5Å; E57-S60 WeakPolarHBondContact O-CB 3.35Å; E57-S60 PolarHBondContact O-N 3.08Å; S58-S60 PolarHBondContact O-N 3.09Å; S60-A63 PolarHBondContact O-N 3.19Å; S60-Q64 VanDerWaalsContact O-CB 3.31Å; S60-Q64 WeakPolarHBondContact O-CB 3.24Å; S60-Q64 PolarHBondContact O-N 3.49Å |
| 61 | A | 64.7 | Low | 64.4 | Low | 52 Ų | 52 | 109.3 Ų | 109.3 | 43% | 0.43 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -64.7 | -42.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | E57 S58 Q64 V65 | E57-A61 WeakPolarHBondContact O-CB 3.5Å; E57-A61 PolarHBondContact O-N 3.49Å; S58-A61 CarbonylContact O-C 3.55Å; S58-A61 WeakPolarHBondContact O-CA 3.09Å; S58-A61 WeakPolarHBondContact O-CB 3.24Å; S58-A61 PolarHBondContact O-N 3.03Å; A61-Q64 WeakPolarHBondContact O-CB 3.3Å; A61-Q64 PolarHBondContact O-N 3.26Å; A61-V65 VanDerWaalsContact O-CG2 3.27Å; A61-V65 WeakPolarHBondContact O-CG2 3.49Å; A61-V65 PolarHBondContact O-N 3.42Å |
| 62 | E | 60.1 | Low | 63.5 | Low | 120 Ų | 120 | 112.2 Ų | 112.2 | 56% | 0.561 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -66.2 | -37.6 | 174.1 | -74.5 | 138.7 | 61.1 | 0 | 0 | 112 | S58 Q64 S66 | S58-E62 WeakPolarHBondContact CA-OE2 3.47Å; S58-E62 VanDerWaalsContact CB-OE2 3.24Å; S58-E62 WeakPolarHBondContact CB-OE2 3.28Å; S58-E62 WeakPolarHBondContact O-CB 3.35Å; S58-E62 WeakPolarHBondContact O-CG 3.4Å; S58-E62 PolarHBondContact O-N 3.42Å; E62-Q64 VanDerWaalsContact C-N 3.31Å; E62-S66 WeakPolarHBondContact O-CB 3.1Å; E62-S66 PolarHBondContact O-N 3.02Å; E62-S66 PolarHBondContact O-OG 2.81Å |
| 63 | A | 56.7 | Low | 62.5 | Low | 48 Ų | 48 | 118.1 Ų | 118.1 | 40% | 0.397 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -65.1 | -35.4 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112 | R59 S60 S66 L67 | R59-A63 WeakPolarHBondContact O-CB 3.18Å; R59-A63 PolarHBondContact O-N 2.9Å; S60-A63 PolarHBondContact O-N 3.19Å; A63-S66 VanDerWaalsContact CA-OG 3.31Å; A63-S66 WeakPolarHBondContact CA-OG 3.19Å; A63-S66 PolarHBondContact O-OG 3.34Å; A63-L67 WeakPolarHBondContact O-CD1 3.48Å; A63-L67 VanDerWaalsContact O-CG 3.31Å; A63-L67 WeakPolarHBondContact O-CG 3.13Å; A63-L67 PolarHBondContact O-N 3.04Å |
| 64 | Q | 54.4 | Low | 61.4 | Low | 147 Ų | 147 | 115.4 Ų | 115.4 | 69% | 0.687 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -72.3 | -42.4 | 177.5 | -167.3 | 128.6 | 37.9 | 0 | 0 | 111.9 | S60 A61 E62 S66 L67 D68 | S60-Q64 VanDerWaalsContact O-CB 3.31Å; S60-Q64 WeakPolarHBondContact O-CB 3.24Å; S60-Q64 PolarHBondContact O-N 3.49Å; A61-Q64 WeakPolarHBondContact O-CB 3.3Å; A61-Q64 PolarHBondContact O-N 3.26Å; E62-Q64 VanDerWaalsContact C-N 3.31Å; Q64-S66 VanDerWaalsContact C-N 3.33Å; Q64-S66 PolarHBondContact O-N 2.98Å; Q64-L67 PolarHBondContact O-N 2.87Å; Q64-D68 PolarHBondContact O-N 2.82Å; Q64-D68 VanDerWaalsContact O-N 3.09Å |
| 65 | V | 57 | Low | 60.1 | Low | 92 Ų | 92 | 115.5 Ų | 115.5 | 56% | 0.558 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -65.5 | -35.5 | 175.2 | 172.1 | 0 | 0 | 0 | 0 | 111.6 | A61 D68 L69 | A61-V65 VanDerWaalsContact O-CG2 3.27Å; A61-V65 WeakPolarHBondContact O-CG2 3.49Å; A61-V65 PolarHBondContact O-N 3.42Å; V65-D68 PolarHBondContact O-N 3.45Å; V65-L69 PolarHBondContact O-N 2.85Å |
| 66 | S | 49.5 | Very low | 58.8 | Low | 77 Ų | 77 | 118.7 Ų | 118.7 | 54% | 0.538 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -73.6 | -24.4 | 176.1 | 52.2 | 0 | 0 | 0 | 0 | 113.8 | E62 A63 Q64 | E62-S66 WeakPolarHBondContact O-CB 3.1Å; E62-S66 PolarHBondContact O-N 3.02Å; E62-S66 PolarHBondContact O-OG 2.81Å; A63-S66 VanDerWaalsContact CA-OG 3.31Å; A63-S66 WeakPolarHBondContact CA-OG 3.19Å; A63-S66 PolarHBondContact O-OG 3.34Å; Q64-S66 VanDerWaalsContact C-N 3.33Å; Q64-S66 PolarHBondContact O-N 2.98Å |
| 67 | L | 49.8 | Very low | 57.6 | Low | 136 Ų | 136 | 120.1 Ų | 120.1 | 71% | 0.712 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -76.5 | -27.7 | 169.1 | -72.6 | 164.6 | 0 | 0 | 0 | 112.4 | A63 Q64 L69 | A63-L67 WeakPolarHBondContact O-CD1 3.48Å; A63-L67 VanDerWaalsContact O-CG 3.31Å; A63-L67 WeakPolarHBondContact O-CG 3.13Å; A63-L67 PolarHBondContact O-N 3.04Å; Q64-L67 PolarHBondContact O-N 2.87Å; L67-L69 VanDerWaalsContact C-N 3.33Å |
| 68 | D | 46.2 | Very low | 56.1 | Low | 138 Ų | 138 | 118.8 Ų | 118.8 | 74% | 0.738 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -80.4 | -8.9 | 179.1 | -162 | -114.5 | 0 | 0 | 0 | 113.9 | Q64 V65 | Q64-D68 PolarHBondContact O-N 2.82Å; Q64-D68 VanDerWaalsContact O-N 3.09Å; V65-D68 PolarHBondContact O-N 3.45Å |
| 69 | L | 48.6 | Very low | 54.7 | Low | 146 Ų | 146 | 123.5 Ų | 123.5 | 76% | 0.764 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.3 | 15.5 | 175.8 | -94.7 | 159.1 | 0 | 0 | 0 | 113.9 | V65 L67 | V65-L69 PolarHBondContact O-N 2.85Å; L67-L69 VanDerWaalsContact C-N 3.33Å |
| 70 | R | 49.5 | Very low | 53.4 | Low | 229 Ų | 229 | 122.3 Ų | 122.3 | 86% | 0.864 | 67% | 0.669 | S | S | * | * | trans | -108.6 | 24.8 | -179.1 | -146.4 | 179.4 | -175.5 | 173.6 | 1.4 | 114.6 | ||||
| 71 | V | 40.7 | Very low | 52.5 | Low | 209 Ų | 209 | 126.7 Ų | 126.7 | 100% | 1.267 | 68% | 0.683 | S | S | * | * | trans | -119.1 | 0 | 171.1 | 174.7 | 0 | 0 | 0 | 0 | 110.5 |
Retrieved 71 of 71 residues in 130.9 ms
(Link to these results)