| 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 | 35.9 | Very low | 40 | Very low | 243 Ų | 243 | 142.1 Ų | 142.1 | 100% | 1.197 | 85% | 0.848 | S | S | * | * | 0 | 93.3 | 0 | -77.3 | 170 | 176.8 | 0 | 0 | 107.4 | |||||
| 2 | T | 33.2 | Very low | 41.2 | Very low | 145 Ų | 145 | 135.6 Ų | 135.6 | 89% | 0.89 | 81% | 0.812 | S | S | * | * | trans | -88.1 | 111.4 | 177.2 | 18.8 | 0 | 0 | 0 | 0 | 108.2 | Q4 | T2-Q4 PolarHBondContact O-N 3.5Š| ||
| 3 | T | 36.2 | Very low | 42.9 | Very low | 134 Ų | 134 | 130 Ų | 130 | 82% | 0.822 | 78% | 0.783 | S | S | * | * | trans | -67.9 | 110.9 | 172.2 | 40.6 | 0 | 0 | 0 | 0 | 109.3 | N5 | T3-N5 PolarHBondContact O-N 3.36Š| ||
| 4 | Q | 39.1 | Very low | 44.5 | Very low | 182 Ų | 182 | 127.6 Ų | 127.6 | 85% | 0.85 | 77% | 0.772 | S | S | * | * | trans | -71.6 | 112.4 | 167 | -81.3 | 180 | -25.7 | 0 | 0 | 108.6 | T2 V6 | T2-Q4 PolarHBondContact O-N 3.5Å; Q4-V6 PolarHBondContact O-N 3.35Å; Q4-V6 VanDerWaalsContact O-N 3.14Å | ||
| 5 | N | 35.1 | Very low | 46.8 | Very low | 158 Ų | 158 | 126.5 Ų | 126.5 | 85% | 0.845 | 76% | 0.76 | S | S | * | * | trans | -66.1 | 104.3 | 164 | -98.9 | -0 | 0 | 0 | 0 | 108.1 | T3 T7 | T3-N5 PolarHBondContact O-N 3.36Å; N5-T7 PolarHBondContact O-N 3Å | ||
| 6 | V | 40.4 | Very low | 49.2 | Very low | 135 Ų | 135 | 120.1 Ų | 120.1 | 82% | 0.818 | 72% | 0.719 | S | S | * | * | trans | -70.9 | 107 | 165 | 179.5 | 0 | 0 | 0 | 0 | 106.6 | Q4 | Q4-V6 PolarHBondContact O-N 3.35Å; Q4-V6 VanDerWaalsContact O-N 3.14Å | ||
| 7 | T | 33.4 | Very low | 51.5 | Low | 122 Ų | 122 | 114.1 Ų | 114.1 | 75% | 0.748 | 68% | 0.682 | S | S | * | * | trans | -58.2 | 131.1 | 168.2 | 17.4 | 0 | 0 | 0 | 0 | 109.1 | N5 T9 | N5-T7 PolarHBondContact O-N 3Å; T7-T9 PolarHBondContact O-N 3.44Å | ||
| 8 | P | 44.3 | Very low | 53.8 | Low | 119 Ų | 119 | 113.4 Ų | 113.4 | 77% | 0.773 | 67% | 0.673 | S | S | * | * | trans | -64.6 | 126.3 | 174.7 | -7.2 | 20.9 | 0 | 0 | 0 | 108.4 | A10 | P8-A10 PolarHBondContact O-N 3Å; P8-A10 VanDerWaalsContact O-N 3.08Å | ||
| 9 | T | 45.3 | Very low | 55.8 | Low | 143 Ų | 143 | 110.7 Ų | 110.7 | 88% | 0.877 | 66% | 0.658 | S | S | * | * | trans | -51.7 | 114.2 | 168.2 | 8.6 | 0 | 0 | 0 | 0 | 108.4 | T7 A11 | T7-T9 PolarHBondContact O-N 3.44Å; T9-A11 PolarHBondContact O-N 3.39Å | ||
| 10 | A | 45.8 | Very low | 57.7 | Low | 95 Ų | 95 | 105.2 Ų | 105.2 | 79% | 0.785 | 63% | 0.625 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 126.9 | 180 | 0 | 0 | 0 | 0 | 0 | 109.3 | P8 | P8-A10 PolarHBondContact O-N 3Å; P8-A10 VanDerWaalsContact O-N 3.08Å |
| 11 | A | 51.1 | Low | 59.5 | Low | 87 Ų | 87 | 101.4 Ų | 101.4 | 72% | 0.719 | 60% | 0.602 | S | S | * | * | P | Polyproline II helix | trans | -55 | 140.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | T9 S13 | T9-A11 PolarHBondContact O-N 3.39Å; A11-S13 PolarHBondContact O-N 2.95Å |
| 12 | P | 54.9 | Low | 62.3 | Low | 64 Ų | 64 | 93.8 Ų | 93.8 | 42% | 0.416 | 57% | 0.569 | S | S | . | * | P | Polyproline II helix | trans | -55.6 | 130 | 179.4 | 20.7 | -30.3 | 0 | 0 | 0 | 109.9 | F16 | P12-F16 HydrophobicContact CB-CD1 4.37Š|
| 13 | S | 62.5 | Low | 65.3 | Low | 63 Ų | 63 | 87.8 Ų | 87.8 | 44% | 0.441 | 53% | 0.532 | S | S | . | . | P | Polyproline II helix | trans | -60 | 140.4 | -176.6 | 52.6 | 0 | 0 | 0 | 0 | 111.2 | A11 D15 F16 | A11-S13 PolarHBondContact O-N 2.95Å; S13-D15 PolarHBondContact O-N 3.38Å; S13-F16 WeakPolarHBondContact O-CB 3.39Å; S13-F16 PolarHBondContact O-N 2.83Å |
| 14 | P | 66.1 | Low | 68.2 | Low | 97 Ų | 97 | 81.4 Ų | 81.4 | 63% | 0.63 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -53.5 | -27 | -179.7 | 19.1 | -31.3 | 0 | 0 | 0 | 113.8 | F16 H17 I18 | P14-F16 VanDerWaalsContact C-N 3.26Å; P14-F16 PolarHBondContact O-N 3.06Å; P14-H17 PolarHBondContact O-N 3.03Å; P14-I18 WeakPolarHBondContact O-CG1 3.39Å; P14-I18 PolarHBondContact O-N 2.84Å |
| 15 | D | 79.1 | Confident | 71 | Confident | 110 Ų | 110 | 74.6 Ų | 74.6 | 59% | 0.588 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -62.3 | -29.2 | 178.4 | -57.4 | -31 | 0 | 0 | 0 | 113.8 | S13 T19 | S13-D15 PolarHBondContact O-N 3.38Å; D15-T19 WeakPolarHBondContact O-CB 3.27Å; D15-T19 PolarHBondContact O-N 3.23Å; D15-T19 PolarHBondContact O-OG1 3.43Å |
| 16 | F | 85.1 | Confident | 73.9 | Confident | 25 Ų | 25 | 69.8 Ų | 69.8 | 11% | 0.11 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -73.1 | -44.6 | -178.4 | 166.7 | -111.8 | 0 | 0 | 0 | 112 | P12 S13 P14 I18 T19 L20 P254 E257 V258 | P12-F16 HydrophobicContact CB-CD1 4.37Å; S13-F16 WeakPolarHBondContact O-CB 3.39Å; S13-F16 PolarHBondContact O-N 2.83Å; P14-F16 VanDerWaalsContact C-N 3.26Å; P14-F16 PolarHBondContact O-N 3.06Å; F16-I18 VanDerWaalsContact C-N 3.33Å; F16-I18 PolarHBondContact O-N 3.3Å; F16-T19 WeakPolarHBondContact O-CB 3.38Å; F16-T19 PolarHBondContact O-N 2.94Å; F16-L20 HydrophobicContact CD1-CD1 4.34Å; F16-L20 HydrophobicContact CD2-CD1 4.07Å; F16-L20 HydrophobicContact CD2-CG 4.36Å; F16-L20 HydrophobicContact CE1-CD1 3.7Å; F16-L20 HydrophobicContact CE2-CD1 3.34Å; F16-L20 HydrophobicContact CE2-CG 3.9Å; F16-L20 HydrophobicContact CZ-CD1 3.16Å; F16-L20 HydrophobicContact CZ-CG 4.21Å; F16-L20 PolarHBondContact O-N 2.91Å; F16-P254 HydrophobicContact CD1-CB 4.37Å; F16-P254 HydrophobicContact CD2-CB 3.84Å; F16-P254 HydrophobicContact CE1-CB 4.39Å; F16-P254 HydrophobicContact CE2-CB 3.86Å; F16-P254 WeakPolarHBondContact CE2-O 3.14Å; F16-P254 HydrophobicContact CG-CB 4.1Å; F16-P254 HydrophobicContact CZ-CB 4.11Å; F16-E257 HydrophobicContact CE2-CB 3.96Å; F16-E257 HydrophobicContact CZ-CB 3.58Å; F16-E257 HydrophobicContact CZ-CG 4.19Å; F16-V258 HydrophobicContact CD2-CG2 3.79Å; F16-V258 HydrophobicContact CE2-CG2 3.68Å |
| 17 | H | 88.8 | Confident | 76.5 | Confident | 18 Ų | 18 | 63.4 Ų | 63.4 | 8% | 0.083 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -63.1 | -39.7 | 175.9 | -85 | -122.3 | 0 | 0 | 0 | 111.8 | P14 L20 T21 Y75 N78 | P14-H17 PolarHBondContact O-N 3.03Å; H17-L20 PolarHBondContact O-N 3.41Å; H17-T21 VanDerWaalsContact O-CB 3.29Å; H17-T21 WeakPolarHBondContact O-CB 3.4Å; H17-T21 PolarHBondContact O-N 3.38Å; H17-T21 PolarHBondContact O-OG1 2.85Å; H17-Y75 AromaticContact CE1-CD1 3.86Å; H17-Y75 AromaticContact ND1-CD1 3.72Å; H17-Y75 PolarHBondContact ND1-O 3.12Å; H17-Y75 VanDerWaalsContact ND1-O 3.14Å; H17-N78 PolarHBondContact CE1-OD1 3.48Å |
| 18 | I | 91.4 | Very high | 79.5 | Confident | 101 Ų | 101 | 59.6 Ų | 59.6 | 52% | 0.518 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61 | -48 | 174.9 | -65.1 | 168.3 | 0 | 0 | 0 | 109.9 | P14 F16 L20 T21 V22 | P14-I18 WeakPolarHBondContact O-CG1 3.39Å; P14-I18 PolarHBondContact O-N 2.84Å; F16-I18 VanDerWaalsContact C-N 3.33Å; F16-I18 PolarHBondContact O-N 3.3Å; I18-L20 PolarHBondContact O-N 2.84Å; I18-T21 WeakPolarHBondContact O-CB 3.39Å; I18-T21 PolarHBondContact O-N 3.24Å; I18-V22 WeakPolarHBondContact O-CG2 3.48Å; I18-V22 PolarHBondContact O-N 2.9Å |
| 19 | T | 93.1 | Very high | 82 | Confident | 63 Ų | 63 | 59.4 Ų | 59.4 | 39% | 0.387 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -57.4 | -49.1 | 179.3 | -60 | 0 | 0 | 0 | 0 | 111.7 | D15 F16 V22 I23 | D15-T19 WeakPolarHBondContact O-CB 3.27Å; D15-T19 PolarHBondContact O-N 3.23Å; D15-T19 PolarHBondContact O-OG1 3.43Å; F16-T19 WeakPolarHBondContact O-CB 3.38Å; F16-T19 PolarHBondContact O-N 2.94Å; T19-V22 PolarHBondContact O-N 3.49Å; T19-I23 HydrophobicContact CG2-CD1 3.93Å; T19-I23 WeakPolarHBondContact O-CG1 3.4Å; T19-I23 PolarHBondContact O-N 3.24Å |
| 20 | L | 93.3 | Very high | 84.4 | Confident | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -65.5 | -41 | 178.9 | -73.9 | 174.4 | 0 | 0 | 0 | 112.4 | F16 H17 I18 V22 I23 Y24 Y75 E257 V258 S261 | F16-L20 HydrophobicContact CD1-CD1 4.34Å; F16-L20 HydrophobicContact CD2-CD1 4.07Å; F16-L20 HydrophobicContact CD2-CG 4.36Å; F16-L20 HydrophobicContact CE1-CD1 3.7Å; F16-L20 HydrophobicContact CE2-CD1 3.34Å; F16-L20 HydrophobicContact CE2-CG 3.9Å; F16-L20 HydrophobicContact CZ-CD1 3.16Å; F16-L20 HydrophobicContact CZ-CG 4.21Å; F16-L20 PolarHBondContact O-N 2.91Å; H17-L20 PolarHBondContact O-N 3.41Å; I18-L20 PolarHBondContact O-N 2.84Å; L20-V22 VanDerWaalsContact C-N 3.29Å; L20-V22 PolarHBondContact O-N 3.17Å; L20-I23 PolarHBondContact O-N 3.45Å; L20-Y24 HydrophobicContact CB-CD2 4.34Å; L20-Y24 HydrophobicContact CB-CE2 4.33Å; L20-Y24 HydrophobicContact CD2-CE2 4.12Å; L20-Y24 WeakPolarHBondContact O-CB 3.49Å; L20-Y24 WeakPolarHBondContact O-CD2 3.35Å; L20-Y24 PolarHBondContact O-N 3.48Å; L20-Y75 HydrophobicContact CB-CD1 4.21Å; L20-Y75 HydrophobicContact CB-CD2 3.96Å; L20-Y75 HydrophobicContact CB-CE1 4.31Å; L20-Y75 HydrophobicContact CB-CE2 4.07Å; L20-Y75 HydrophobicContact CB-CG 4.06Å; L20-Y75 HydrophobicContact CD1-CD1 3.94Å; L20-Y75 HydrophobicContact CD1-CE1 3.36Å; L20-Y75 HydrophobicContact CD1-CE2 4.13Å; L20-Y75 VanDerWaalsContact CD1-CZ 3.48Å; L20-Y75 HydrophobicContact CG-CE1 4.48Å; L20-E257 HydrophobicContact CD1-CB 4.32Å; L20-V258 HydrophobicContact CD2-CG2 4.43Å; L20-S261 WeakPolarHBondContact CD2-OG 3.07Å |
| 21 | T | 95.1 | Very high | 86.7 | Confident | 25 Ų | 25 | 50.5 Ų | 50.5 | 15% | 0.153 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -56.4 | -46.1 | 174.5 | -61.6 | 0 | 0 | 0 | 0 | 111 | H17 I18 S25 I72 Y75 V76 | H17-T21 VanDerWaalsContact O-CB 3.29Å; H17-T21 WeakPolarHBondContact O-CB 3.4Å; H17-T21 PolarHBondContact O-N 3.38Å; H17-T21 PolarHBondContact O-OG1 2.85Å; I18-T21 WeakPolarHBondContact O-CB 3.39Å; I18-T21 PolarHBondContact O-N 3.24Å; T21-S25 VanDerWaalsContact O-CB 3.26Å; T21-S25 WeakPolarHBondContact O-CB 3.33Å; T21-S25 PolarHBondContact O-N 2.95Å; T21-S25 PolarHBondContact O-OG 3.35Å; T21-I72 HydrophobicContact CG2-CG2 4.35Å; T21-Y75 VanDerWaalsContact OG1-CB 3.24Å; T21-Y75 WeakPolarHBondContact OG1-CB 3.21Å; T21-V76 HydrophobicContact CG2-CG2 3.64Å |
| 22 | V | 96.1 | Very high | 88.7 | Confident | 83 Ų | 83 | 48.9 Ų | 48.9 | 50% | 0.503 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.8 | -49.8 | 177.5 | 171.2 | 0 | 0 | 0 | 0 | 110.8 | I18 T19 L20 Y24 S25 V26 | I18-V22 WeakPolarHBondContact O-CG2 3.48Å; I18-V22 PolarHBondContact O-N 2.9Å; T19-V22 PolarHBondContact O-N 3.49Å; L20-V22 VanDerWaalsContact C-N 3.29Å; L20-V22 PolarHBondContact O-N 3.17Å; V22-Y24 PolarHBondContact O-N 2.97Å; V22-S25 PolarHBondContact O-N 2.88Å; V22-V26 HydrophobicContact CG1-CG2 4.47Å; V22-V26 WeakPolarHBondContact O-CG2 3.49Å; V22-V26 PolarHBondContact O-N 3.04Å |
| 23 | I | 95.8 | Very high | 90.5 | Very high | 19 Ų | 19 | 50.2 Ų | 50.2 | 10% | 0.097 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -57.6 | -51.8 | -179.7 | -69.6 | 167.7 | 0 | 0 | 0 | 110.8 | T19 L20 S25 V26 V27 V258 S261 L262 F265 | T19-I23 HydrophobicContact CG2-CD1 3.93Å; T19-I23 WeakPolarHBondContact O-CG1 3.4Å; T19-I23 PolarHBondContact O-N 3.24Å; L20-I23 PolarHBondContact O-N 3.45Å; I23-S25 VanDerWaalsContact C-N 3.31Å; I23-S25 PolarHBondContact O-N 3.47Å; I23-V26 PolarHBondContact O-N 3.15Å; I23-V27 HydrophobicContact CG2-CG2 4.34Å; I23-V27 WeakPolarHBondContact O-CB 3.06Å; I23-V27 VanDerWaalsContact O-CG2 3.24Å; I23-V27 WeakPolarHBondContact O-CG2 3.46Å; I23-V27 PolarHBondContact O-N 3.5Å; I23-V258 HydrophobicContact CD1-CG1 4.24Å; I23-S261 WeakPolarHBondContact CD1-OG 3.38Å; I23-S261 WeakPolarHBondContact CG2-OG 3.35Å; I23-L262 HydrophobicContact CD1-CD2 4.18Å; I23-F265 HydrophobicContact CG2-CE2 3.69Å; I23-F265 HydrophobicContact CG2-CZ 4.17Å |
| 24 | Y | 96.5 | Very high | 91.9 | Very high | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -65.6 | -33.4 | -179.3 | -75.3 | -58 | 0 | 0 | 0 | 112.8 | L20 V22 V27 L28 V68 R71 Y75 I94 T264 | L20-Y24 HydrophobicContact CB-CD2 4.34Å; L20-Y24 HydrophobicContact CB-CE2 4.33Å; L20-Y24 HydrophobicContact CD2-CE2 4.12Å; L20-Y24 WeakPolarHBondContact O-CB 3.49Å; L20-Y24 WeakPolarHBondContact O-CD2 3.35Å; L20-Y24 PolarHBondContact O-N 3.48Å; V22-Y24 PolarHBondContact O-N 2.97Å; Y24-V27 PolarHBondContact O-N 3.37Å; Y24-L28 VanDerWaalsContact O-CB 3.29Å; Y24-L28 WeakPolarHBondContact O-CB 3.37Å; Y24-L28 PolarHBondContact O-N 3.37Å; Y24-V68 HydrophobicContact CD1-CG1 4.03Å; Y24-V68 HydrophobicContact CG-CG1 4.31Å; Y24-V68 WeakPolarHBondContact O-CG1 3.25Å; Y24-R71 HydrophobicContact CD2-CB 4.26Å; Y24-R71 HydrophobicContact CE2-CB 4.34Å; Y24-R71 HydrophobicContact CG-CB 4.5Å; Y24-R71 PolarHBondContact OH-NH1 3.43Å; Y24-Y75 HydrophobicContact CD2-CD2 4.01Å; Y24-Y75 AromaticContact CD2-CE2 3.82Å; Y24-Y75 HydrophobicContact CD2-CE2 3.82Å; Y24-Y75 HydrophobicContact CE2-CD2 4.13Å; Y24-Y75 AromaticContact CE2-CE2 3.47Å; Y24-Y75 HydrophobicContact CE2-CE2 3.47Å; Y24-Y75 VanDerWaalsContact CE2-CE2 3.47Å; Y24-I94 HydrophobicContact CE1-CD1 4.27Å; Y24-I94 WeakPolarHBondContact OH-CD1 3.44Å; Y24-T264 HydrophobicContact CE1-CG2 4.16Å |
| 25 | S | 97 | Very high | 93 | Very high | 40 Ų | 40 | 43.6 Ų | 43.6 | 28% | 0.28 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -65.7 | -44.7 | 174.5 | -60.6 | 0 | 0 | 0 | 0 | 111.7 | T21 V22 I23 L28 L29 | T21-S25 VanDerWaalsContact O-CB 3.26Å; T21-S25 WeakPolarHBondContact O-CB 3.33Å; T21-S25 PolarHBondContact O-N 2.95Å; T21-S25 PolarHBondContact O-OG 3.35Å; V22-S25 PolarHBondContact O-N 2.88Å; I23-S25 VanDerWaalsContact C-N 3.31Å; I23-S25 PolarHBondContact O-N 3.47Å; S25-L28 PolarHBondContact O-N 3.42Å; S25-L29 WeakPolarHBondContact O-CG 3.3Å; S25-L29 PolarHBondContact O-N 3.35Å |
| 26 | V | 96.4 | Very high | 93.6 | Very high | 57 Ų | 57 | 42.1 Ų | 42.1 | 35% | 0.345 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.8 | -46 | 175.1 | 171.7 | 0 | 0 | 0 | 0 | 110.6 | V22 I23 L28 L29 C30 F265 | V22-V26 HydrophobicContact CG1-CG2 4.47Å; V22-V26 WeakPolarHBondContact O-CG2 3.49Å; V22-V26 PolarHBondContact O-N 3.04Å; I23-V26 PolarHBondContact O-N 3.15Å; V26-L28 VanDerWaalsContact C-N 3.32Å; V26-L28 PolarHBondContact O-N 2.93Å; V26-L29 PolarHBondContact O-N 3.4Å; V26-C30 VanDerWaalsContact O-CB 3.27Å; V26-C30 WeakPolarHBondContact O-CB 3.2Å; V26-C30 PolarHBondContact O-N 2.8Å; V26-C30 PolarHBondContact O-SG 3.22Å; V26-F265 HydrophobicContact CG1-CE1 3.91Å; V26-F265 HydrophobicContact CG1-CZ 4.38Å |
| 27 | V | 95.9 | Very high | 93.6 | Very high | 1 Ų | 1 | 43.6 Ų | 43.6 | 1% | 0.006 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.6 | -41.4 | 178.3 | 169 | 0 | 0 | 0 | 0 | 111.3 | I23 Y24 G31 F64 L65 T264 F265 | I23-V27 HydrophobicContact CG2-CG2 4.34Å; I23-V27 WeakPolarHBondContact O-CB 3.06Å; I23-V27 VanDerWaalsContact O-CG2 3.24Å; I23-V27 WeakPolarHBondContact O-CG2 3.46Å; I23-V27 PolarHBondContact O-N 3.5Å; Y24-V27 PolarHBondContact O-N 3.37Å; V27-G31 VanDerWaalsContact O-CA 3.22Å; V27-G31 WeakPolarHBondContact O-CA 3.3Å; V27-G31 PolarHBondContact O-N 3.4Å; V27-F64 HydrophobicContact CG1-CE1 4.35Å; V27-L65 HydrophobicContact CG1-CD2 4.26Å; V27-T264 VanDerWaalsContact CG2-OG1 3.3Å; V27-T264 WeakPolarHBondContact CG2-OG1 3.21Å; V27-F265 HydrophobicContact CG2-CD1 4.14Å; V27-F265 HydrophobicContact CG2-CD2 4.28Å; V27-F265 HydrophobicContact CG2-CE1 4.11Å; V27-F265 HydrophobicContact CG2-CE2 4.24Å; V27-F265 HydrophobicContact CG2-CG 4.23Å; V27-F265 HydrophobicContact CG2-CZ 4.16Å |
| 28 | L | 96.9 | Very high | 93.5 | Very high | 41 Ų | 41 | 43 Ų | 43 | 22% | 0.215 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.9 | -50.4 | 176.6 | -177.6 | 62 | 0 | 0 | 0 | 111.2 | Y24 S25 V26 T32 L65 V68 P69 I72 | Y24-L28 VanDerWaalsContact O-CB 3.29Å; Y24-L28 WeakPolarHBondContact O-CB 3.37Å; Y24-L28 PolarHBondContact O-N 3.37Å; S25-L28 PolarHBondContact O-N 3.42Å; V26-L28 VanDerWaalsContact C-N 3.32Å; V26-L28 PolarHBondContact O-N 2.93Å; L28-T32 HydrophobicContact CD1-CG2 4.05Å; L28-T32 VanDerWaalsContact O-CB 3.27Å; L28-T32 WeakPolarHBondContact O-CB 3.3Å; L28-T32 WeakPolarHBondContact O-CG2 3.48Å; L28-T32 PolarHBondContact O-N 3.32Å; L28-T32 PolarHBondContact O-OG1 2.76Å; L28-L65 HydrophobicContact CD1-CD2 4.5Å; L28-V68 HydrophobicContact CB-CG1 4.05Å; L28-V68 HydrophobicContact CD1-CB 4.45Å; L28-P69 HydrophobicContact CD1-CG 4.35Å; L28-P69 HydrophobicContact CD2-CG 4.05Å; L28-I72 HydrophobicContact CD2-CD1 4.01Å |
| 29 | L | 96.2 | Very high | 93.1 | Very high | 116 Ų | 116 | 42.8 Ų | 42.8 | 61% | 0.607 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -65.6 | -56.3 | -178.8 | -68.6 | 175.1 | 0 | 0 | 0 | 111.7 | S25 V26 G31 T32 V33 | S25-L29 WeakPolarHBondContact O-CG 3.3Å; S25-L29 PolarHBondContact O-N 3.35Å; V26-L29 PolarHBondContact O-N 3.4Å; L29-G31 PolarHBondContact O-N 3.44Å; L29-T32 PolarHBondContact O-N 3.3Å; L29-T32 PolarHBondContact O-OG1 3.44Å; L29-V33 VanDerWaalsContact O-CG2 3.28Å; L29-V33 WeakPolarHBondContact O-CG2 3.49Å; L29-V33 PolarHBondContact O-N 2.92Å |
| 30 | C | 94.5 | Very high | 92.6 | Very high | 50 Ų | 50 | 45.7 Ų | 45.7 | 34% | 0.338 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -67.4 | -39 | -177.2 | -63.1 | 0 | 0 | 0 | 0 | 111.3 | V26 V33 S34 L268 | V26-C30 VanDerWaalsContact O-CB 3.27Å; V26-C30 WeakPolarHBondContact O-CB 3.2Å; V26-C30 PolarHBondContact O-N 2.8Å; V26-C30 PolarHBondContact O-SG 3.22Å; C30-V33 PolarHBondContact O-N 3.43Å; C30-S34 WeakPolarHBondContact O-CB 3.39Å; C30-S34 PolarHBondContact O-N 2.94Å; C30-S34 PolarHBondContact O-OG 2.92Å; C30-L268 HydrophobicContact CB-CD2 3.35Å |
| 31 | G | 93.9 | Very high | 92 | Very high | 1 Ų | 1 | 47.4 Ų | 47.4 | 1% | 0.01 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.7 | -43 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | V27 L29 S34 L35 | V27-G31 VanDerWaalsContact O-CA 3.22Å; V27-G31 WeakPolarHBondContact O-CA 3.3Å; V27-G31 PolarHBondContact O-N 3.4Å; L29-G31 PolarHBondContact O-N 3.44Å; G31-S34 PolarHBondContact O-N 3.47Å; G31-L35 VanDerWaalsContact O-CB 3.29Å; G31-L35 WeakPolarHBondContact O-CB 3.22Å; G31-L35 PolarHBondContact O-N 2.7Å |
| 32 | T | 94.1 | Very high | 91.1 | Very high | 53 Ų | 53 | 48.4 Ų | 48.4 | 33% | 0.325 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -67.8 | -37.8 | 176.7 | 53.1 | 0 | 0 | 0 | 0 | 112.8 | L28 L29 L35 S36 L65 | L28-T32 HydrophobicContact CD1-CG2 4.05Å; L28-T32 VanDerWaalsContact O-CB 3.27Å; L28-T32 WeakPolarHBondContact O-CB 3.3Å; L28-T32 WeakPolarHBondContact O-CG2 3.48Å; L28-T32 PolarHBondContact O-N 3.32Å; L28-T32 PolarHBondContact O-OG1 2.76Å; L29-T32 PolarHBondContact O-N 3.3Å; L29-T32 PolarHBondContact O-OG1 3.44Å; T32-L35 PolarHBondContact O-N 3.45Å; T32-S36 WeakPolarHBondContact O-CB 3.49Å; T32-S36 PolarHBondContact O-N 3.36Å; T32-S36 PolarHBondContact O-OG 2.97Å; T32-L65 HydrophobicContact CG2-CD1 4.34Å |
| 33 | V | 93.3 | Very high | 90.2 | Very high | 91 Ų | 91 | 53.2 Ų | 53.2 | 55% | 0.552 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -61.5 | -47.8 | 172.1 | 170.1 | 0 | 0 | 0 | 0 | 110.4 | L29 C30 L35 S36 L37 | L29-V33 VanDerWaalsContact O-CG2 3.28Å; L29-V33 WeakPolarHBondContact O-CG2 3.49Å; L29-V33 PolarHBondContact O-N 2.92Å; C30-V33 PolarHBondContact O-N 3.43Å; V33-L35 VanDerWaalsContact C-N 3.34Å; V33-L35 PolarHBondContact O-N 3.41Å; V33-S36 PolarHBondContact O-N 3.46Å; V33-L37 WeakPolarHBondContact O-CB 3.45Å; V33-L37 PolarHBondContact O-N 3.26Å |
| 34 | S | 90.5 | Very high | 89 | Confident | 1 Ų | 1 | 56 Ų | 56 | 1% | 0.007 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60.6 | -44.4 | 179.3 | -53 | 0 | 0 | 0 | 0 | 111.5 | C30 G31 L37 M38 L271 | C30-S34 WeakPolarHBondContact O-CB 3.39Å; C30-S34 PolarHBondContact O-N 2.94Å; C30-S34 PolarHBondContact O-OG 2.92Å; G31-S34 PolarHBondContact O-N 3.47Å; S34-L37 PolarHBondContact O-N 2.86Å; S34-M38 WeakPolarHBondContact O-CB 3.45Å; S34-M38 PolarHBondContact O-N 3.37Å; S34-L271 VanDerWaalsContact OG-CD2 3.28Å; S34-L271 WeakPolarHBondContact OG-CD2 3.48Å; S34-L271 WeakPolarHBondContact OG-CG 3.4Å |
| 35 | L | 91 | Very high | 87.4 | Confident | 20 Ų | 20 | 57.6 Ų | 57.6 | 11% | 0.105 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -63.8 | -47.7 | 177.5 | -176.2 | 69.3 | 0 | 0 | 0 | 111.9 | G31 T32 V33 L37 M38 M39 I58 F62 L65 | G31-L35 VanDerWaalsContact O-CB 3.29Å; G31-L35 WeakPolarHBondContact O-CB 3.22Å; G31-L35 PolarHBondContact O-N 2.7Å; T32-L35 PolarHBondContact O-N 3.45Å; V33-L35 VanDerWaalsContact C-N 3.34Å; V33-L35 PolarHBondContact O-N 3.41Å; L35-L37 VanDerWaalsContact C-N 3.3Å; L35-L37 PolarHBondContact O-N 2.96Å; L35-M38 PolarHBondContact O-N 2.99Å; L35-M39 VanDerWaalsContact O-CG 3.3Å; L35-M39 WeakPolarHBondContact O-CG 3.24Å; L35-M39 PolarHBondContact O-N 2.95Å; L35-I58 HydrophobicContact CD1-CB 4.46Å; L35-I58 HydrophobicContact CD1-CG2 3.5Å; L35-F62 HydrophobicContact CD1-CB 4.5Å; L35-F62 HydrophobicContact CD2-CB 3.79Å; L35-F62 HydrophobicContact CD2-CD2 3.63Å; L35-F62 HydrophobicContact CD2-CG 4.17Å; L35-L65 HydrophobicContact CD2-CD1 4.45Å |
| 36 | S | 89.8 | Confident | 85 | Confident | 79 Ų | 79 | 60.1 Ų | 60.1 | 55% | 0.552 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -60.4 | -42.8 | 179.6 | -61.3 | 0 | 0 | 0 | 0 | 111.5 | T32 V33 M39 H40 | T32-S36 WeakPolarHBondContact O-CB 3.49Å; T32-S36 PolarHBondContact O-N 3.36Å; T32-S36 PolarHBondContact O-OG 2.97Å; V33-S36 PolarHBondContact O-N 3.46Å; S36-M39 PolarHBondContact O-N 2.71Å; S36-H40 PolarHBondContact O-N 3.16Å |
| 37 | L | 87.2 | Confident | 82.7 | Confident | 57 Ų | 57 | 62.6 Ų | 62.6 | 30% | 0.298 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -68 | -41.9 | 178.6 | -174.8 | 46.8 | 0 | 0 | 0 | 112 | V33 S34 L35 M39 H40 I41 L274 | V33-L37 WeakPolarHBondContact O-CB 3.45Å; V33-L37 PolarHBondContact O-N 3.26Å; S34-L37 PolarHBondContact O-N 2.86Å; L35-L37 VanDerWaalsContact C-N 3.3Å; L35-L37 PolarHBondContact O-N 2.96Å; L37-M39 VanDerWaalsContact C-N 3.33Å; L37-M39 PolarHBondContact O-N 3.11Å; L37-H40 WeakPolarHBondContact O-CB 3.44Å; L37-H40 PolarHBondContact O-N 3.01Å; L37-I41 HydrophobicContact CD1-CD1 4.2Å; L37-I41 HydrophobicContact CD1-CG1 4.27Å; L37-I41 HydrophobicContact CG-CD1 4.12Å; L37-I41 VanDerWaalsContact O-CG1 3.32Å; L37-I41 WeakPolarHBondContact O-CG1 3.25Å; L37-I41 PolarHBondContact O-N 2.91Å; L37-L274 HydrophobicContact CD2-CD1 3.51Å; L37-L274 HydrophobicContact CD2-CD2 3.2Å; L37-L274 HydrophobicContact CD2-CG 3.48Å; L37-L274 VanDerWaalsContact CD2-CG 3.48Å; L37-L274 HydrophobicContact CG-CD1 3.77Å; L37-L274 HydrophobicContact CG-CD2 4.23Å; L37-L274 HydrophobicContact CG-CG 3.97Å |
| 38 | M | 84.7 | Confident | 80.3 | Confident | 6 Ų | 6 | 66.6 Ų | 66.6 | 3% | 0.03 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -59.9 | -44.9 | 174.2 | -173.6 | 58.1 | 170 | 0 | 0 | 111.2 | S34 L35 H40 I41 L42 V54 I58 M270 F273 | S34-M38 WeakPolarHBondContact O-CB 3.45Å; S34-M38 PolarHBondContact O-N 3.37Å; L35-M38 PolarHBondContact O-N 2.99Å; M38-H40 VanDerWaalsContact C-N 3.31Å; M38-H40 PolarHBondContact O-N 2.85Å; M38-I41 PolarHBondContact O-N 3.41Å; M38-L42 HydrophobicContact CE-CD1 4.43Å; M38-L42 HydrophobicContact CE-CD2 4.27Å; M38-L42 HydrophobicContact CE-CG 4.34Å; M38-L42 HydrophobicContact CG-CD1 4.27Å; M38-L42 HydrophobicContact CG-CG 4.46Å; M38-L42 WeakPolarHBondContact O-CB 3.33Å; M38-L42 VanDerWaalsContact O-CG 3.26Å; M38-L42 WeakPolarHBondContact O-CG 3.42Å; M38-L42 PolarHBondContact O-N 3.11Å; M38-L42 HydrophobicContact SD-CG 4.45Å; M38-V54 HydrophobicContact CE-CG1 3.87Å; M38-I58 HydrophobicContact CE-CD1 3.88Å; M38-I58 HydrophobicContact CG-CD1 3.55Å; M38-I58 HydrophobicContact CG-CG1 4.14Å; M38-M270 HydrophobicContact CB-CB 4.35Å; M38-M270 HydrophobicContact CE-SD 4.44Å; M38-M270 HydrophobicContact CG-SD 3.99Å; M38-F273 HydrophobicContact CE-CB 4.3Å; M38-F273 HydrophobicContact CE-CD1 3.86Å; M38-F273 HydrophobicContact CE-CD2 3.88Å; M38-F273 HydrophobicContact CE-CE1 4.11Å; M38-F273 HydrophobicContact CE-CE2 4.12Å; M38-F273 HydrophobicContact CE-CG 3.74Å; M38-F273 HydrophobicContact CE-CZ 4.23Å; M38-F273 HydrophobicContact SD-CB 3.82Å; M38-F273 HydrophobicContact SD-CD1 4.48Å; M38-F273 HydrophobicContact SD-CD2 4.15Å; M38-F273 HydrophobicContact SD-CG 3.91Å |
| 39 | M | 83.9 | Confident | 78 | Confident | 95 Ų | 95 | 69 Ų | 69 | 47% | 0.468 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -60.8 | -38.6 | 175.5 | -70.1 | -60 | -66.9 | 0 | 0 | 112.5 | L35 S36 L37 L42 K43 I58 | L35-M39 VanDerWaalsContact O-CG 3.3Å; L35-M39 WeakPolarHBondContact O-CG 3.24Å; L35-M39 PolarHBondContact O-N 2.95Å; S36-M39 PolarHBondContact O-N 2.71Å; L37-M39 VanDerWaalsContact C-N 3.33Å; L37-M39 PolarHBondContact O-N 3.11Å; M39-L42 PolarHBondContact O-N 3.29Å; M39-L42 HydrophobicContact SD-CD1 4.44Å; M39-K43 WeakPolarHBondContact O-CB 3.27Å; M39-K43 PolarHBondContact O-N 2.86Å; M39-I58 HydrophobicContact SD-CG2 4.04Å |
| 40 | H | 83.6 | Confident | 75.9 | Confident | 125 Ų | 125 | 66.2 Ų | 66.2 | 58% | 0.579 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -66.7 | -42.7 | 175.5 | -173.6 | -88.1 | 0 | 0 | 0 | 112.6 | S36 L37 M38 K43 S44 | S36-H40 PolarHBondContact O-N 3.16Å; L37-H40 WeakPolarHBondContact O-CB 3.44Å; L37-H40 PolarHBondContact O-N 3.01Å; M38-H40 VanDerWaalsContact C-N 3.31Å; M38-H40 PolarHBondContact O-N 2.85Å; H40-K43 PolarHBondContact O-N 3.5Å; H40-S44 PolarHBondContact O-N 3.42Å; H40-S44 PolarHBondContact O-OG 3.27Å |
| 41 | I | 79.5 | Confident | 74.7 | Confident | 36 Ų | 36 | 66.8 Ų | 66.8 | 19% | 0.185 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -62.4 | -45 | 175.3 | -68.1 | 167.3 | 0 | 0 | 0 | 110.1 | L37 M38 K43 S44 S45 L274 | L37-I41 HydrophobicContact CD1-CD1 4.2Å; L37-I41 HydrophobicContact CD1-CG1 4.27Å; L37-I41 HydrophobicContact CG-CD1 4.12Å; L37-I41 VanDerWaalsContact O-CG1 3.32Å; L37-I41 WeakPolarHBondContact O-CG1 3.25Å; L37-I41 PolarHBondContact O-N 2.91Å; M38-I41 PolarHBondContact O-N 3.41Å; I41-K43 VanDerWaalsContact C-N 3.33Å; I41-K43 PolarHBondContact O-N 2.91Å; I41-S44 PolarHBondContact O-N 3.39Å; I41-S44 PolarHBondContact O-OG 3.05Å; I41-S44 VanDerWaalsContact O-OG 3.12Å; I41-S45 WeakPolarHBondContact O-CB 3.49Å; I41-S45 PolarHBondContact O-N 3.25Å; I41-L274 HydrophobicContact CD1-CD1 4.24Å; I41-L274 HydrophobicContact CD1-CG 4.24Å |
| 42 | L | 77.5 | Confident | 74 | Confident | 45 Ų | 45 | 68.4 Ų | 68.4 | 24% | 0.236 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -62.3 | -38 | 177.1 | -72 | 179.2 | 0 | 0 | 0 | 112.6 | M38 M39 T50 I58 | M38-L42 HydrophobicContact CE-CD1 4.43Å; M38-L42 HydrophobicContact CE-CD2 4.27Å; M38-L42 HydrophobicContact CE-CG 4.34Å; M38-L42 HydrophobicContact CG-CD1 4.27Å; M38-L42 HydrophobicContact CG-CG 4.46Å; M38-L42 WeakPolarHBondContact O-CB 3.33Å; M38-L42 VanDerWaalsContact O-CG 3.26Å; M38-L42 WeakPolarHBondContact O-CG 3.42Å; M38-L42 PolarHBondContact O-N 3.11Å; M38-L42 HydrophobicContact SD-CG 4.45Å; M39-L42 PolarHBondContact O-N 3.29Å; M39-L42 HydrophobicContact SD-CD1 4.44Å; L42-T50 HydrophobicContact CD2-CG2 4.11Å; L42-T50 WeakPolarHBondContact CD2-OG1 3.26Å; L42-I58 HydrophobicContact CD1-CD1 3.51Å |
| 43 | K | 77 | Confident | 73.3 | Confident | 185 Ų | 185 | 66.6 Ų | 66.6 | 80% | 0.804 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -70.6 | -39.5 | 178.2 | -174.5 | 178.5 | 177.2 | -179 | 0 | 113 | M39 H40 I41 | M39-K43 WeakPolarHBondContact O-CB 3.27Å; M39-K43 PolarHBondContact O-N 2.86Å; H40-K43 PolarHBondContact O-N 3.5Å; I41-K43 VanDerWaalsContact C-N 3.33Å; I41-K43 PolarHBondContact O-N 2.91Å |
| 44 | S | 70 | Confident | 72.8 | Confident | 77 Ų | 77 | 63.1 Ų | 63.1 | 54% | 0.538 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -79.5 | -24.9 | -178.7 | 56.7 | 0 | 0 | 0 | 0 | 113.3 | H40 I41 A46 | H40-S44 PolarHBondContact O-N 3.42Å; H40-S44 PolarHBondContact O-OG 3.27Å; I41-S44 PolarHBondContact O-N 3.39Å; I41-S44 PolarHBondContact O-OG 3.05Å; I41-S44 VanDerWaalsContact O-OG 3.12Å; S44-A46 VanDerWaalsContact C-N 3.35Å; S44-A46 PolarHBondContact O-N 2.67Å; S44-A46 VanDerWaalsContact O-N 3.1Å |
| 45 | S | 62.9 | Low | 72.5 | Confident | 33 Ų | 33 | 68.3 Ų | 68.3 | 23% | 0.231 | 41% | 0.414 | C | S | . | . | S | Bend | trans | -80.3 | 76.8 | 172.1 | 170.2 | 0 | 0 | 0 | 0 | 110.3 | I41 A47 S48 | I41-S45 WeakPolarHBondContact O-CB 3.49Å; I41-S45 PolarHBondContact O-N 3.25Å; S45-A47 PolarHBondContact O-N 2.9Å; S45-S48 PolarHBondContact O-N 3.33Å; S45-S48 WeakPolarHBondContact OG-CB 3.46Å |
| 46 | A | 45.3 | Very low | 72.4 | Confident | 93 Ų | 93 | 68.3 Ų | 68.3 | 77% | 0.769 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -38.9 | 105.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | S44 S48 | S44-A46 VanDerWaalsContact C-N 3.35Å; S44-A46 PolarHBondContact O-N 2.67Å; S44-A46 VanDerWaalsContact O-N 3.1Å; A46-S48 VanDerWaalsContact C-N 3.28Å; A46-S48 PolarHBondContact O-N 3.08Å |
| 47 | A | 49.4 | Very low | 72.3 | Confident | 110 Ų | 110 | 64.5 Ų | 64.5 | 91% | 0.909 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.7 | 23.6 | 169.2 | 0 | 0 | 0 | 0 | 0 | 118.3 | S45 A49 | S45-A47 PolarHBondContact O-N 2.9Å; A47-A49 PolarHBondContact O-N 3.26Å |
| 48 | S | 44.7 | Very low | 72.5 | Confident | 84 Ų | 84 | 62 Ų | 62 | 59% | 0.587 | 38% | 0.375 | S | S | * | . | trans | -80.4 | 85.1 | 177.2 | -173.7 | 0 | 0 | 0 | 0 | 111 | S45 A46 T50 | S45-S48 PolarHBondContact O-N 3.33Å; S45-S48 WeakPolarHBondContact OG-CB 3.46Å; A46-S48 VanDerWaalsContact C-N 3.28Å; A46-S48 PolarHBondContact O-N 3.08Å; S48-T50 VanDerWaalsContact C-N 3.35Å; S48-T50 PolarHBondContact O-N 3.01Å | ||
| 49 | A | 48.1 | Very low | 72.8 | Confident | 93 Ų | 93 | 66.1 Ų | 66.1 | 77% | 0.769 | 39% | 0.393 | S | S | * | . | trans | 27.6 | 59.8 | 154.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | A47 S51 | A47-A49 PolarHBondContact O-N 3.26Å; A49-S51 PolarHBondContact O-N 2.98Å | ||
| 50 | T | 53.8 | Low | 73.2 | Confident | 56 Ų | 56 | 62 Ų | 62 | 34% | 0.344 | 37% | 0.373 | S | S | . | . | trans | -58.7 | 111.2 | 163.3 | -45 | 0 | 0 | 0 | 0 | 106 | L42 S48 I52 V54 F55 | L42-T50 HydrophobicContact CD2-CG2 4.11Å; L42-T50 WeakPolarHBondContact CD2-OG1 3.26Å; S48-T50 VanDerWaalsContact C-N 3.35Å; S48-T50 PolarHBondContact O-N 3.01Å; T50-I52 PolarHBondContact O-N 3.44Å; T50-V54 HydrophobicContact CG2-CB 3.92Å; T50-V54 HydrophobicContact CG2-CG1 3.99Å; T50-F55 HydrophobicContact CG2-CB 4.26Å | ||
| 51 | S | 68.7 | Low | 73.7 | Confident | 62 Ų | 62 | 56.1 Ų | 56.1 | 43% | 0.434 | 35% | 0.346 | S | S | . | . | trans | -52.6 | 129.6 | 170.6 | 176.9 | 0 | 0 | 0 | 0 | 106.7 | A49 T53 V54 F55 | A49-S51 PolarHBondContact O-N 2.98Å; S51-T53 PolarHBondContact O-N 3.25Å; S51-V54 WeakPolarHBondContact O-CB 3.38Å; S51-V54 PolarHBondContact O-N 3.42Å; S51-F55 PolarHBondContact O-N 3.16Å | ||
| 52 | I | 78.4 | Confident | 74.5 | Confident | 36 Ų | 36 | 58.7 Ų | 58.7 | 19% | 0.185 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -45.2 | -35.7 | 179.8 | -73.6 | 147.1 | 0 | 0 | 0 | 110.9 | T50 V54 F55 N56 R128 L132 | T50-I52 PolarHBondContact O-N 3.44Å; I52-V54 PolarHBondContact O-N 3.39Å; I52-F55 PolarHBondContact O-N 3.22Å; I52-N56 PolarHBondContact O-N 3.01Å; I52-N56 PolarHBondContact O-ND2 3.46Å; I52-N56 VanDerWaalsContact O-ND2 3.08Å; I52-R128 HydrophobicContact CD1-CG 3.8Å; I52-L132 HydrophobicContact CD1-CD1 4.25Å; I52-L132 HydrophobicContact CD1-CD2 3.53Å; I52-L132 HydrophobicContact CD1-CG 3.62Å; I52-L132 HydrophobicContact CG1-CD2 3.93Å; I52-L132 HydrophobicContact CG2-CD2 3.83Å |
| 53 | T | 80.3 | Confident | 75.3 | Confident | 14 Ų | 14 | 58.6 Ų | 58.6 | 9% | 0.086 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -58.5 | -42.7 | 174.6 | -44.1 | 0 | 0 | 0 | 0 | 113.9 | S51 N56 L57 L104 I107 I108 | S51-T53 PolarHBondContact O-N 3.25Å; T53-N56 PolarHBondContact O-N 2.92Å; T53-L57 WeakPolarHBondContact O-CB 3.34Å; T53-L57 PolarHBondContact O-N 3.41Å; T53-L104 HydrophobicContact CG2-CB 4.24Å; T53-L104 HydrophobicContact CG2-CD2 3.66Å; T53-L104 WeakPolarHBondContact CG2-O 3.24Å; T53-I107 HydrophobicContact CG2-CB 3.93Å; T53-I107 HydrophobicContact CG2-CG2 3.78Å; T53-I108 HydrophobicContact CG2-CD1 4.21Å; T53-I108 HydrophobicContact CG2-CG1 3.7Å |
| 54 | V | 83 | Confident | 76.2 | Confident | 18 Ų | 18 | 49.8 Ų | 49.8 | 11% | 0.109 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -68.5 | -38.9 | 177.6 | 176 | 0 | 0 | 0 | 0 | 110.7 | M38 T50 S51 I52 L57 I58 I108 F273 | M38-V54 HydrophobicContact CE-CG1 3.87Å; T50-V54 HydrophobicContact CG2-CB 3.92Å; T50-V54 HydrophobicContact CG2-CG1 3.99Å; S51-V54 WeakPolarHBondContact O-CB 3.38Å; S51-V54 PolarHBondContact O-N 3.42Å; I52-V54 PolarHBondContact O-N 3.39Å; V54-L57 WeakPolarHBondContact O-CB 3.5Å; V54-L57 PolarHBondContact O-N 3.05Å; V54-I58 HydrophobicContact CG1-CD1 4.1Å; V54-I58 VanDerWaalsContact O-CG1 3.31Å; V54-I58 WeakPolarHBondContact O-CG1 3.46Å; V54-I58 PolarHBondContact O-N 2.76Å; V54-I108 HydrophobicContact CG2-CD1 4.27Å; V54-F273 HydrophobicContact CG1-CZ 4.28Å |
| 55 | F | 84.4 | Confident | 77.4 | Confident | 111 Ų | 111 | 46.4 Ų | 46.4 | 49% | 0.487 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -64 | -45 | 174.9 | 178.6 | -95.4 | 0 | 0 | 0 | 111.9 | T50 S51 I52 L57 I58 F59 | T50-F55 HydrophobicContact CG2-CB 4.26Å; S51-F55 PolarHBondContact O-N 3.16Å; I52-F55 PolarHBondContact O-N 3.22Å; F55-L57 PolarHBondContact O-N 3.07Å; F55-I58 PolarHBondContact O-N 3.36Å; F55-F59 WeakPolarHBondContact O-CB 3.4Å; F55-F59 PolarHBondContact O-N 2.84Å |
| 56 | N | 87.3 | Confident | 79 | Confident | 19 Ų | 19 | 49.4 Ų | 49.4 | 10% | 0.102 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -58.9 | -36.9 | 174.8 | -73.9 | -42.8 | 0 | 0 | 0 | 112.3 | I52 T53 F59 A60 L104 S135 W139 | I52-N56 PolarHBondContact O-N 3.01Å; I52-N56 PolarHBondContact O-ND2 3.46Å; I52-N56 VanDerWaalsContact O-ND2 3.08Å; T53-N56 PolarHBondContact O-N 2.92Å; N56-F59 PolarHBondContact O-N 2.87Å; N56-A60 WeakPolarHBondContact O-CB 3.49Å; N56-A60 PolarHBondContact O-N 3.47Å; N56-L104 HydrophobicContact CB-CD1 4.1Å; N56-L104 HydrophobicContact CB-CD2 3.73Å; N56-S135 PolarHBondContact ND2-OG 2.94Å; N56-W139 HydrophobicContact CB-CZ2 4.41Å; N56-W139 PolarHBondContact OD1-NE1 3.34Å |
| 57 | L | 88.9 | Confident | 81.4 | Confident | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -66.5 | -49.3 | 177.9 | -177.4 | 63.3 | 0 | 0 | 0 | 111.4 | T53 V54 F55 F59 A60 H61 L104 Y105 I108 F228 M270 | T53-L57 WeakPolarHBondContact O-CB 3.34Å; T53-L57 PolarHBondContact O-N 3.41Å; V54-L57 WeakPolarHBondContact O-CB 3.5Å; V54-L57 PolarHBondContact O-N 3.05Å; F55-L57 PolarHBondContact O-N 3.07Å; L57-F59 PolarHBondContact O-N 2.69Å; L57-A60 WeakPolarHBondContact O-CB 3.32Å; L57-A60 PolarHBondContact O-N 3.01Å; L57-A60 VanDerWaalsContact O-N 3.12Å; L57-H61 VanDerWaalsContact CD1-NE2 3.3Å; L57-H61 WeakPolarHBondContact CD1-NE2 3.48Å; L57-H61 WeakPolarHBondContact CG-NE2 3.49Å; L57-H61 PolarHBondContact O-CD2 3.21Å; L57-H61 PolarHBondContact O-N 2.81Å; L57-L104 HydrophobicContact CB-CB 4.44Å; L57-L104 HydrophobicContact CB-CD1 4.04Å; L57-L104 HydrophobicContact CD1-CB 4.16Å; L57-L104 HydrophobicContact CD1-CD1 4.08Å; L57-Y105 HydrophobicContact CD1-CD2 4.08Å; L57-Y105 HydrophobicContact CD1-CE2 3.86Å; L57-Y105 HydrophobicContact CD2-CD2 4.25Å; L57-Y105 HydrophobicContact CD2-CE2 3.94Å; L57-I108 HydrophobicContact CD2-CD1 4.06Å; L57-F228 HydrophobicContact CD2-CE2 3.95Å; L57-F228 HydrophobicContact CD2-CZ 3.53Å; L57-M270 HydrophobicContact CD2-CE 3.7Å; L57-M270 HydrophobicContact CG-CE 4.16Å |
| 58 | I | 90.6 | Very high | 83.7 | Confident | 5 Ų | 5 | 40.4 Ų | 40.4 | 3% | 0.026 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -53.8 | -44.9 | 173.4 | -70.7 | 169.2 | 0 | 0 | 0 | 110.8 | L35 M38 M39 L42 V54 F55 H61 F62 M270 | L35-I58 HydrophobicContact CD1-CB 4.46Å; L35-I58 HydrophobicContact CD1-CG2 3.5Å; M38-I58 HydrophobicContact CE-CD1 3.88Å; M38-I58 HydrophobicContact CG-CD1 3.55Å; M38-I58 HydrophobicContact CG-CG1 4.14Å; M39-I58 HydrophobicContact SD-CG2 4.04Å; L42-I58 HydrophobicContact CD1-CD1 3.51Å; V54-I58 HydrophobicContact CG1-CD1 4.1Å; V54-I58 VanDerWaalsContact O-CG1 3.31Å; V54-I58 WeakPolarHBondContact O-CG1 3.46Å; V54-I58 PolarHBondContact O-N 2.76Å; F55-I58 PolarHBondContact O-N 3.36Å; I58-H61 PolarHBondContact O-N 3.4Å; I58-F62 WeakPolarHBondContact O-CB 3.46Å; I58-F62 PolarHBondContact O-N 3.42Å; I58-M270 HydrophobicContact CD1-SD 4.36Å; I58-M270 HydrophobicContact CG1-SD 3.64Å |
| 59 | F | 91.3 | Very high | 86.1 | Confident | 92 Ų | 92 | 39.1 Ų | 39.1 | 40% | 0.404 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -65.3 | -42.4 | 178.1 | -175.9 | -108.5 | 0 | 0 | 0 | 112.3 | F55 N56 L57 H61 F62 V63 W139 | F55-F59 WeakPolarHBondContact O-CB 3.4Å; F55-F59 PolarHBondContact O-N 2.84Å; N56-F59 PolarHBondContact O-N 2.87Å; L57-F59 PolarHBondContact O-N 2.69Å; F59-H61 PolarHBondContact O-N 2.89Å; F59-F62 HydrophobicContact CD2-CD1 4.47Å; F59-F62 WeakPolarHBondContact O-CB 3.38Å; F59-F62 PolarHBondContact O-N 3.17Å; F59-V63 HydrophobicContact CD1-CG2 4.28Å; F59-V63 HydrophobicContact CD2-CG2 4.33Å; F59-V63 HydrophobicContact CE1-CG2 3.85Å; F59-V63 HydrophobicContact CE2-CG2 3.92Å; F59-V63 HydrophobicContact CZ-CG2 3.66Å; F59-V63 WeakPolarHBondContact O-CG2 3.38Å; F59-V63 PolarHBondContact O-N 2.74Å; F59-W139 AromaticContact CD1-CH2 3.49Å; F59-W139 HydrophobicContact CD1-CH2 3.49Å; F59-W139 VanDerWaalsContact CD1-CH2 3.49Å; F59-W139 AromaticContact CD1-CZ2 3.78Å; F59-W139 HydrophobicContact CD1-CZ2 3.78Å; F59-W139 HydrophobicContact CD1-CZ3 4.31Å; F59-W139 AromaticContact CE1-CH2 3.89Å; F59-W139 HydrophobicContact CE1-CH2 3.89Å; F59-W139 HydrophobicContact CE1-CZ2 4.47Å; F59-W139 HydrophobicContact CE1-CZ3 4.27Å |
| 60 | A | 92.7 | Very high | 88.4 | Confident | 7 Ų | 7 | 37.7 Ų | 37.7 | 6% | 0.058 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60.3 | -43.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | N56 L57 F64 W139 | N56-A60 WeakPolarHBondContact O-CB 3.49Å; N56-A60 PolarHBondContact O-N 3.47Å; L57-A60 WeakPolarHBondContact O-CB 3.32Å; L57-A60 PolarHBondContact O-N 3.01Å; L57-A60 VanDerWaalsContact O-N 3.12Å; A60-F64 WeakPolarHBondContact O-CB 3.26Å; A60-F64 PolarHBondContact O-N 3.42Å; A60-W139 HydrophobicContact CB-CH2 4.15Å; A60-W139 HydrophobicContact CB-CZ2 4.35Å |
| 61 | H | 94.4 | Very high | 90.3 | Very high | 3 Ų | 3 | 35 Ų | 35 | 1% | 0.014 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -62.2 | -44.8 | 173.9 | -68 | -62.2 | 0 | 0 | 0 | 112.3 | L57 I58 F59 F64 L65 H97 N266 C267 D269 | L57-H61 VanDerWaalsContact CD1-NE2 3.3Å; L57-H61 WeakPolarHBondContact CD1-NE2 3.48Å; L57-H61 WeakPolarHBondContact CG-NE2 3.49Å; L57-H61 PolarHBondContact O-CD2 3.21Å; L57-H61 PolarHBondContact O-N 2.81Å; I58-H61 PolarHBondContact O-N 3.4Å; F59-H61 PolarHBondContact O-N 2.89Å; H61-F64 PolarHBondContact O-N 2.88Å; H61-L65 WeakPolarHBondContact O-CB 2.92Å; H61-L65 VanDerWaalsContact O-CG 3.24Å; H61-L65 WeakPolarHBondContact O-CG 3.27Å; H61-L65 PolarHBondContact O-N 3.49Å; H61-H97 AromaticContact CE1-NE2 3.59Å; H61-H97 AromaticContact ND1-NE2 3.15Å; H61-H97 PolarHBondContact ND1-NE2 3.25Å; H61-H97 VanDerWaalsContact ND1-NE2 3.15Å; H61-N266 PolarHBondContact CE1-OD1 3.27Å; H61-N266 VanDerWaalsContact CE1-OD1 3.26Å; H61-C267 PolarHBondContact ND1-SG 3.42Å; H61-D269 IonicContact CE1-OD1 3.09Å; H61-D269 IonicContact CE1-OD2 3.8Å; H61-D269 IonicContact NE2-OD1 3.92Å; H61-D269 PolarHBondContact NE2-OD1 3Å; H61-D269 IonicContact NE2-OD2 3.49Å; H61-D269 PolarHBondContact NE2-OD2 3.29Å |
| 62 | F | 94.8 | Very high | 91.5 | Very high | 90 Ų | 90 | 33.4 Ų | 33.4 | 40% | 0.395 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -57.6 | -52.4 | 177.8 | 172.1 | -109.3 | 0 | 0 | 0 | 111.5 | L35 I58 F59 F64 L65 L66 | L35-F62 HydrophobicContact CD1-CB 4.5Å; L35-F62 HydrophobicContact CD2-CB 3.79Å; L35-F62 HydrophobicContact CD2-CD2 3.63Å; L35-F62 HydrophobicContact CD2-CG 4.17Å; I58-F62 WeakPolarHBondContact O-CB 3.46Å; I58-F62 PolarHBondContact O-N 3.42Å; F59-F62 HydrophobicContact CD2-CD1 4.47Å; F59-F62 WeakPolarHBondContact O-CB 3.38Å; F59-F62 PolarHBondContact O-N 3.17Å; F62-F64 VanDerWaalsContact C-N 3.3Å; F62-F64 PolarHBondContact O-N 2.93Å; F62-L65 PolarHBondContact O-N 3.47Å; F62-L66 HydrophobicContact CD1-CD1 4.29Å; F62-L66 HydrophobicContact CE1-CD1 3.7Å; F62-L66 HydrophobicContact CE1-CG 4.43Å; F62-L66 HydrophobicContact CE2-CD1 4.33Å; F62-L66 HydrophobicContact CE2-CD2 4.19Å; F62-L66 HydrophobicContact CE2-CG 4.27Å; F62-L66 HydrophobicContact CZ-CD1 3.74Å; F62-L66 HydrophobicContact CZ-CD2 4.22Å; F62-L66 HydrophobicContact CZ-CG 4.17Å; F62-L66 WeakPolarHBondContact O-CG 3.26Å; F62-L66 PolarHBondContact O-N 2.92Å; F62-L66 VanDerWaalsContact O-N 3.08Å |
| 63 | V | 94.8 | Very high | 92.3 | Very high | 42 Ų | 42 | 35.2 Ų | 35.2 | 26% | 0.255 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -61.5 | -40.4 | -179.6 | 177.4 | 0 | 0 | 0 | 0 | 111 | F59 L66 M93 | F59-V63 HydrophobicContact CD1-CG2 4.28Å; F59-V63 HydrophobicContact CD2-CG2 4.33Å; F59-V63 HydrophobicContact CE1-CG2 3.85Å; F59-V63 HydrophobicContact CE2-CG2 3.92Å; F59-V63 HydrophobicContact CZ-CG2 3.66Å; F59-V63 WeakPolarHBondContact O-CG2 3.38Å; F59-V63 PolarHBondContact O-N 2.74Å; V63-L66 PolarHBondContact O-N 3.08Å; V63-M93 HydrophobicContact CG1-CE 3.54Å |
| 64 | F | 96 | Very high | 92.8 | Very high | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.6 | -48.3 | 174.8 | 173.3 | -105.7 | 0 | 0 | 0 | 112.2 | V27 A60 H61 F62 L66 T67 V68 I94 H97 T264 | V27-F64 HydrophobicContact CG1-CE1 4.35Å; A60-F64 WeakPolarHBondContact O-CB 3.26Å; A60-F64 PolarHBondContact O-N 3.42Å; H61-F64 PolarHBondContact O-N 2.88Å; F62-F64 VanDerWaalsContact C-N 3.3Å; F62-F64 PolarHBondContact O-N 2.93Å; F64-L66 PolarHBondContact O-N 3.42Å; F64-T67 WeakPolarHBondContact O-CA 3.46Å; F64-T67 WeakPolarHBondContact O-CB 3.16Å; F64-T67 PolarHBondContact O-N 3.34Å; F64-T67 PolarHBondContact O-OG1 3.43Å; F64-V68 HydrophobicContact CD1-CG2 4.08Å; F64-V68 HydrophobicContact CE1-CG2 3.52Å; F64-V68 HydrophobicContact CE2-CG2 4.29Å; F64-V68 HydrophobicContact CZ-CG2 3.63Å; F64-V68 PolarHBondContact O-N 3.41Å; F64-I94 HydrophobicContact CE2-CB 4.01Å; F64-I94 HydrophobicContact CE2-CD1 4.48Å; F64-I94 HydrophobicContact CE2-CG1 3.94Å; F64-I94 HydrophobicContact CZ-CG1 4.36Å; F64-H97 HydrophobicContact CB-CB 3.85Å; F64-H97 AromaticContact CD1-CE1 4Å; F64-H97 AromaticContact CD1-CG 3.99Å; F64-H97 AromaticContact CD1-ND1 3.85Å; F64-H97 HydrophobicContact CD2-CB 3.62Å; F64-H97 AromaticContact CD2-CG 3.76Å; F64-H97 HydrophobicContact CE2-CB 4.44Å; F64-H97 HydrophobicContact CG-CB 3.79Å; F64-H97 AromaticContact CG-CD2 3.85Å; F64-H97 AromaticContact CG-CG 3.47Å; F64-H97 VanDerWaalsContact CG-CG 3.47Å; F64-H97 AromaticContact CG-ND1 3.76Å; F64-T264 HydrophobicContact CE1-CG2 3.93Å; F64-T264 HydrophobicContact CE2-CG2 4.32Å; F64-T264 HydrophobicContact CZ-CG2 3.42Å; F64-T264 VanDerWaalsContact CZ-CG2 3.42Å |
| 65 | L | 96.4 | Very high | 93.2 | Very high | 6 Ų | 6 | 34.4 Ų | 34.4 | 3% | 0.031 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -60 | -31.5 | -179.8 | -73.3 | 170.6 | 0 | 0 | 0 | 112.5 | V27 L28 T32 L35 H61 F62 T67 V68 P69 | V27-L65 HydrophobicContact CG1-CD2 4.26Å; L28-L65 HydrophobicContact CD1-CD2 4.5Å; T32-L65 HydrophobicContact CG2-CD1 4.34Å; L35-L65 HydrophobicContact CD2-CD1 4.45Å; H61-L65 WeakPolarHBondContact O-CB 2.92Å; H61-L65 VanDerWaalsContact O-CG 3.24Å; H61-L65 WeakPolarHBondContact O-CG 3.27Å; H61-L65 PolarHBondContact O-N 3.49Å; F62-L65 PolarHBondContact O-N 3.47Å; L65-T67 PolarHBondContact O-N 2.96Å; L65-V68 HydrophobicContact CD2-CG2 4.48Å; L65-V68 PolarHBondContact O-N 2.82Å; L65-P69 VanDerWaalsContact O-CD 3.24Å; L65-P69 WeakPolarHBondContact O-CD 3.16Å |
| 66 | L | 96.4 | Very high | 93.6 | Very high | 97 Ų | 97 | 33.8 Ų | 33.8 | 51% | 0.508 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -62.6 | -26.4 | 171.7 | -68.4 | 177.8 | 0 | 0 | 0 | 113.1 | F62 V63 F64 F70 | F62-L66 HydrophobicContact CD1-CD1 4.29Å; F62-L66 HydrophobicContact CE1-CD1 3.7Å; F62-L66 HydrophobicContact CE1-CG 4.43Å; F62-L66 HydrophobicContact CE2-CD1 4.33Å; F62-L66 HydrophobicContact CE2-CD2 4.19Å; F62-L66 HydrophobicContact CE2-CG 4.27Å; F62-L66 HydrophobicContact CZ-CD1 3.74Å; F62-L66 HydrophobicContact CZ-CD2 4.22Å; F62-L66 HydrophobicContact CZ-CG 4.17Å; F62-L66 WeakPolarHBondContact O-CG 3.26Å; F62-L66 PolarHBondContact O-N 2.92Å; F62-L66 VanDerWaalsContact O-N 3.08Å; V63-L66 PolarHBondContact O-N 3.08Å; F64-L66 PolarHBondContact O-N 3.42Å; L66-F70 WeakPolarHBondContact O-CE2 3.39Å |
| 67 | T | 95.4 | Very high | 93.7 | Very high | 13 Ų | 13 | 35.6 Ų | 35.6 | 8% | 0.08 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -88.9 | -19.9 | -179.5 | 71.4 | 0 | 0 | 0 | 0 | 113.8 | F64 L65 F70 M93 | F64-T67 WeakPolarHBondContact O-CA 3.46Å; F64-T67 WeakPolarHBondContact O-CB 3.16Å; F64-T67 PolarHBondContact O-N 3.34Å; F64-T67 PolarHBondContact O-OG1 3.43Å; L65-T67 PolarHBondContact O-N 2.96Å; T67-F70 PolarHBondContact O-N 2.97Å; T67-M93 HydrophobicContact CG2-CB 4.02Å; T67-M93 HydrophobicContact CG2-CG 3.77Å |
| 68 | V | 96.3 | Very high | 93.5 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.1 | -41.5 | -177.9 | 175.6 | 0 | 0 | 0 | 0 | 113.7 | Y24 L28 F64 L65 F70 R71 I72 | Y24-V68 HydrophobicContact CD1-CG1 4.03Å; Y24-V68 HydrophobicContact CG-CG1 4.31Å; Y24-V68 WeakPolarHBondContact O-CG1 3.25Å; L28-V68 HydrophobicContact CB-CG1 4.05Å; L28-V68 HydrophobicContact CD1-CB 4.45Å; F64-V68 HydrophobicContact CD1-CG2 4.08Å; F64-V68 HydrophobicContact CE1-CG2 3.52Å; F64-V68 HydrophobicContact CE2-CG2 4.29Å; F64-V68 HydrophobicContact CZ-CG2 3.63Å; F64-V68 PolarHBondContact O-N 3.41Å; L65-V68 HydrophobicContact CD2-CG2 4.48Å; L65-V68 PolarHBondContact O-N 2.82Å; V68-F70 PolarHBondContact O-N 3.38Å; V68-F70 VanDerWaalsContact O-N 3.15Å; V68-R71 WeakPolarHBondContact O-CB 3.4Å; V68-R71 PolarHBondContact O-N 3.27Å; V68-I72 HydrophobicContact CG1-CD1 4.04Å; V68-I72 HydrophobicContact CG1-CG1 4.35Å; V68-I72 PolarHBondContact O-N 3.43Å; V68-I72 VanDerWaalsContact O-N 3.07Å |
| 69 | P | 97 | Very high | 93.3 | Very high | 57 Ų | 57 | 42.8 Ų | 42.8 | 37% | 0.37 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -56 | -32.3 | 177.2 | -27.8 | 35.1 | 0 | 0 | 0 | 114.1 | L28 L65 I72 Y73 | L28-P69 HydrophobicContact CD1-CG 4.35Å; L28-P69 HydrophobicContact CD2-CG 4.05Å; L65-P69 VanDerWaalsContact O-CD 3.24Å; L65-P69 WeakPolarHBondContact O-CD 3.16Å; P69-I72 PolarHBondContact O-N 3.04Å; P69-Y73 WeakPolarHBondContact O-CB 3.12Å; P69-Y73 PolarHBondContact O-N 2.9Å |
| 70 | F | 95.3 | Very high | 93.2 | Very high | 64 Ų | 64 | 39.2 Ų | 39.2 | 28% | 0.281 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -71.4 | -32.1 | 178.1 | -57.3 | -74.6 | 0 | 0 | 0 | 112.2 | L66 T67 V68 Y74 W80 L82 W86 V90 | L66-F70 WeakPolarHBondContact O-CE2 3.39Å; T67-F70 PolarHBondContact O-N 2.97Å; V68-F70 PolarHBondContact O-N 3.38Å; V68-F70 VanDerWaalsContact O-N 3.15Å; F70-Y74 PolarHBondContact O-N 3.44Å; F70-Y74 VanDerWaalsContact O-N 3.1Å; F70-W80 HydrophobicContact CB-CH2 3.97Å; F70-W80 HydrophobicContact CB-CZ3 4.17Å; F70-L82 HydrophobicContact CD1-CD1 3.46Å; F70-L82 VanDerWaalsContact CD1-CD1 3.46Å; F70-L82 HydrophobicContact CE1-CD1 4Å; F70-L82 HydrophobicContact CG-CD1 4.45Å; F70-W86 AromaticContact CD1-NE1 3.67Å; F70-W86 AromaticContact CD2-NE1 3.97Å; F70-W86 AromaticContact CE1-NE1 3.6Å; F70-W86 HydrophobicContact CE2-CZ2 4.05Å; F70-W86 AromaticContact CE2-NE1 3.94Å; F70-W86 AromaticContact CG-NE1 3.85Å; F70-W86 HydrophobicContact CZ-CZ2 4.14Å; F70-W86 AromaticContact CZ-NE1 3.74Å; F70-V90 HydrophobicContact CB-CG1 4.3Å; F70-V90 HydrophobicContact CB-CG2 4.07Å; F70-V90 HydrophobicContact CD2-CG2 4.29Å; F70-V90 HydrophobicContact CG-CG2 4.37Å |
| 71 | R | 93.3 | Very high | 93 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -67.2 | -45.8 | 170.8 | -70.8 | -176.4 | 169.6 | -96.3 | -9.8 | 111 | Y24 V68 Y73 Y74 Y75 V90 F167 | Y24-R71 HydrophobicContact CD2-CB 4.26Å; Y24-R71 HydrophobicContact CE2-CB 4.34Å; Y24-R71 HydrophobicContact CG-CB 4.5Å; Y24-R71 PolarHBondContact OH-NH1 3.43Å; V68-R71 WeakPolarHBondContact O-CB 3.4Å; V68-R71 PolarHBondContact O-N 3.27Å; R71-Y73 VanDerWaalsContact C-N 3.31Å; R71-Y73 PolarHBondContact O-N 3.36Å; R71-Y74 WeakPolarHBondContact O-CB 3.39Å; R71-Y74 PolarHBondContact O-N 2.85Å; R71-Y75 HydrophobicContact CB-CD2 4.42Å; R71-Y75 HydrophobicContact CB-CE2 4.13Å; R71-Y75 WeakPolarHBondContact O-CD2 3.28Å; R71-Y75 PolarHBondContact O-N 2.92Å; R71-V90 HydrophobicContact CG-CG1 3.73Å; R71-V90 PolarHBondContact NH2-O 3.45Å; R71-F167 HydrophobicContact CG-CE1 4.42Å; R71-F167 HydrophobicContact CG-CE2 4.19Å; R71-F167 HydrophobicContact CG-CZ 3.81Å |
| 72 | I | 95.1 | Very high | 92.6 | Very high | 28 Ų | 28 | 49.3 Ų | 49.3 | 14% | 0.144 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -57.4 | -47.6 | 175.5 | -64.5 | 171.4 | 0 | 0 | 0 | 110.1 | T21 L28 V68 P69 Y74 Y75 V76 | T21-I72 HydrophobicContact CG2-CG2 4.35Å; L28-I72 HydrophobicContact CD2-CD1 4.01Å; V68-I72 HydrophobicContact CG1-CD1 4.04Å; V68-I72 HydrophobicContact CG1-CG1 4.35Å; V68-I72 PolarHBondContact O-N 3.43Å; V68-I72 VanDerWaalsContact O-N 3.07Å; P69-I72 PolarHBondContact O-N 3.04Å; I72-Y74 VanDerWaalsContact C-N 3.33Å; I72-Y74 PolarHBondContact O-N 3.44Å; I72-Y75 PolarHBondContact O-N 3.47Å; I72-V76 HydrophobicContact CG2-CG2 4.17Å; I72-V76 WeakPolarHBondContact O-CB 3.13Å; I72-V76 VanDerWaalsContact O-CG2 3.27Å; I72-V76 WeakPolarHBondContact O-CG2 2.97Å; I72-V76 PolarHBondContact O-N 2.88Å |
| 73 | Y | 94.5 | Very high | 92.2 | Very high | 74 Ų | 74 | 46.5 Ų | 46.5 | 29% | 0.29 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -50.8 | -53 | 174.8 | 165.2 | -100.4 | 0 | 0 | 0 | 111.1 | P69 R71 Y75 V76 T77 L82 | P69-Y73 WeakPolarHBondContact O-CB 3.12Å; P69-Y73 PolarHBondContact O-N 2.9Å; R71-Y73 VanDerWaalsContact C-N 3.31Å; R71-Y73 PolarHBondContact O-N 3.36Å; Y73-Y75 PolarHBondContact O-N 3.32Å; Y73-V76 PolarHBondContact O-N 3.37Å; Y73-T77 HydrophobicContact CD2-CG2 3.82Å; Y73-T77 HydrophobicContact CE2-CG2 3.59Å; Y73-T77 WeakPolarHBondContact O-CG2 3.28Å; Y73-T77 PolarHBondContact O-N 3.31Å; Y73-T77 PolarHBondContact O-OG1 2.89Å; Y73-L82 HydrophobicContact CD1-CD1 4.37Å; Y73-L82 HydrophobicContact CE1-CD1 4.42Å; Y73-L82 HydrophobicContact CE1-CG 4.44Å |
| 74 | Y | 91.3 | Very high | 91.5 | Very high | 5 Ų | 5 | 48.1 Ų | 48.1 | 2% | 0.02 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -58.7 | -48.3 | 179.2 | 175.5 | -106.3 | 0 | 0 | 0 | 113.2 | F70 R71 I72 V76 T77 N78 W80 C166 F167 | F70-Y74 PolarHBondContact O-N 3.44Å; F70-Y74 VanDerWaalsContact O-N 3.1Å; R71-Y74 WeakPolarHBondContact O-CB 3.39Å; R71-Y74 PolarHBondContact O-N 2.85Å; I72-Y74 VanDerWaalsContact C-N 3.33Å; I72-Y74 PolarHBondContact O-N 3.44Å; Y74-V76 VanDerWaalsContact C-N 3.28Å; Y74-V76 PolarHBondContact O-N 2.99Å; Y74-T77 PolarHBondContact O-N 3.34Å; Y74-N78 VanDerWaalsContact O-CA 3.26Å; Y74-N78 WeakPolarHBondContact O-CA 3.31Å; Y74-N78 PolarHBondContact O-N 3.35Å; Y74-W80 HydrophobicContact CD2-CB 4.04Å; Y74-W80 HydrophobicContact CD2-CE3 4.3Å; Y74-W80 HydrophobicContact CE2-CB 4.4Å; Y74-W80 HydrophobicContact CG-CE3 4.43Å; Y74-C166 HydrophobicContact CD2-CB 4.13Å; Y74-C166 WeakPolarHBondContact CE1-O 3.44Å; Y74-C166 HydrophobicContact CE2-CB 4.05Å; Y74-C166 PolarHBondContact OH-O 3.32Å; Y74-F167 AromaticContact CD1-CD2 3.45Å; Y74-F167 HydrophobicContact CD1-CD2 3.45Å; Y74-F167 VanDerWaalsContact CD1-CD2 3.45Å; Y74-F167 AromaticContact CD1-CE2 3.66Å; Y74-F167 HydrophobicContact CD1-CE2 3.66Å; Y74-F167 AromaticContact CE1-CD2 3.76Å; Y74-F167 HydrophobicContact CE1-CD2 3.76Å; Y74-F167 HydrophobicContact CE1-CE2 4.4Å; Y74-F167 HydrophobicContact CG-CD2 4.03Å; Y74-F167 AromaticContact CG-CE2 3.84Å; Y74-F167 HydrophobicContact CG-CE2 3.84Å |
| 75 | Y | 90.7 | Very high | 90.8 | Very high | 10 Ų | 10 | 53 Ų | 53 | 4% | 0.039 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -69.3 | -27.5 | -177 | -66.6 | -61.2 | 0 | 0 | 0 | 112.9 | H17 L20 T21 Y24 R71 I72 Y73 | H17-Y75 AromaticContact CE1-CD1 3.86Å; H17-Y75 AromaticContact ND1-CD1 3.72Å; H17-Y75 PolarHBondContact ND1-O 3.12Å; H17-Y75 VanDerWaalsContact ND1-O 3.14Å; L20-Y75 HydrophobicContact CB-CD1 4.21Å; L20-Y75 HydrophobicContact CB-CD2 3.96Å; L20-Y75 HydrophobicContact CB-CE1 4.31Å; L20-Y75 HydrophobicContact CB-CE2 4.07Å; L20-Y75 HydrophobicContact CB-CG 4.06Å; L20-Y75 HydrophobicContact CD1-CD1 3.94Å; L20-Y75 HydrophobicContact CD1-CE1 3.36Å; L20-Y75 HydrophobicContact CD1-CE2 4.13Å; L20-Y75 VanDerWaalsContact CD1-CZ 3.48Å; L20-Y75 HydrophobicContact CG-CE1 4.48Å; T21-Y75 VanDerWaalsContact OG1-CB 3.24Å; T21-Y75 WeakPolarHBondContact OG1-CB 3.21Å; Y24-Y75 HydrophobicContact CD2-CD2 4.01Å; Y24-Y75 AromaticContact CD2-CE2 3.82Å; Y24-Y75 HydrophobicContact CD2-CE2 3.82Å; Y24-Y75 HydrophobicContact CE2-CD2 4.13Å; Y24-Y75 AromaticContact CE2-CE2 3.47Å; Y24-Y75 HydrophobicContact CE2-CE2 3.47Å; Y24-Y75 VanDerWaalsContact CE2-CE2 3.47Å; R71-Y75 HydrophobicContact CB-CD2 4.42Å; R71-Y75 HydrophobicContact CB-CE2 4.13Å; R71-Y75 WeakPolarHBondContact O-CD2 3.28Å; R71-Y75 PolarHBondContact O-N 2.92Å; I72-Y75 PolarHBondContact O-N 3.47Å; Y73-Y75 PolarHBondContact O-N 3.32Å |
| 76 | V | 92.3 | Very high | 90.4 | Very high | 98 Ų | 98 | 57.8 Ų | 57.8 | 59% | 0.594 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -78.7 | -44.6 | 175.8 | 171.8 | 0 | 0 | 0 | 0 | 112.2 | T21 I72 Y73 Y74 | T21-V76 HydrophobicContact CG2-CG2 3.64Å; I72-V76 HydrophobicContact CG2-CG2 4.17Å; I72-V76 WeakPolarHBondContact O-CB 3.13Å; I72-V76 VanDerWaalsContact O-CG2 3.27Å; I72-V76 WeakPolarHBondContact O-CG2 2.97Å; I72-V76 PolarHBondContact O-N 2.88Å; Y73-V76 PolarHBondContact O-N 3.37Å; Y74-V76 VanDerWaalsContact C-N 3.28Å; Y74-V76 PolarHBondContact O-N 2.99Å |
| 77 | T | 90.3 | Very high | 89.9 | Confident | 56 Ų | 56 | 53.4 Ų | 53.4 | 34% | 0.344 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -84.7 | -18.8 | -177.1 | 59.4 | 0 | 0 | 0 | 0 | 113.3 | Y73 Y74 E79 | Y73-T77 HydrophobicContact CD2-CG2 3.82Å; Y73-T77 HydrophobicContact CE2-CG2 3.59Å; Y73-T77 WeakPolarHBondContact O-CG2 3.28Å; Y73-T77 PolarHBondContact O-N 3.31Å; Y73-T77 PolarHBondContact O-OG1 2.89Å; Y74-T77 PolarHBondContact O-N 3.34Å; T77-E79 PolarHBondContact O-N 3.22Å; T77-E79 VanDerWaalsContact O-N 3.13Å; T77-E79 PolarHBondContact OG1-N 3.19Å; T77-E79 PolarHBondContact OG1-O 3.08Å |
| 78 | N | 85.9 | Confident | 89.4 | Confident | 80 Ų | 80 | 54.3 Ų | 54.3 | 43% | 0.428 | 28% | 0.278 | S | S | . | . | S | Bend | trans | 57.4 | 18 | -170.8 | -147.5 | 6.1 | 0 | 0 | 0 | 113.6 | H17 Y74 | H17-N78 PolarHBondContact CE1-OD1 3.48Å; Y74-N78 VanDerWaalsContact O-CA 3.26Å; Y74-N78 WeakPolarHBondContact O-CA 3.31Å; Y74-N78 PolarHBondContact O-N 3.35Å |
| 79 | E | 86.4 | Confident | 88.9 | Confident | 77 Ų | 77 | 57.9 Ų | 57.9 | 36% | 0.36 | 30% | 0.296 | S | S | . | . | trans | -145.6 | 132.9 | -176.6 | -69.1 | -172.1 | 164.4 | 0 | 0 | 111 | T77 K81 | T77-E79 PolarHBondContact O-N 3.22Å; T77-E79 VanDerWaalsContact O-N 3.13Å; T77-E79 PolarHBondContact OG1-N 3.19Å; T77-E79 PolarHBondContact OG1-O 3.08Å; E79-K81 WeakPolarHBondContact OE2-CE 3.48Å; E79-K81 IonicContact OE2-NZ 2.7Å; E79-K81 PolarHBondContact OE2-NZ 2.89Å | ||
| 80 | W | 87.7 | Confident | 88.5 | Confident | 16 Ų | 16 | 55.2 Ų | 55.2 | 6% | 0.061 | 28% | 0.278 | C | S | . | . | trans | -100 | 114.4 | 174.4 | -172.9 | -91.4 | 0 | 0 | 0 | 111.9 | F70 Y74 L82 G83 W86 C87 V90 T164 C166 F167 | F70-W80 HydrophobicContact CB-CH2 3.97Å; F70-W80 HydrophobicContact CB-CZ3 4.17Å; Y74-W80 HydrophobicContact CD2-CB 4.04Å; Y74-W80 HydrophobicContact CD2-CE3 4.3Å; Y74-W80 HydrophobicContact CE2-CB 4.4Å; Y74-W80 HydrophobicContact CG-CE3 4.43Å; W80-L82 HydrophobicContact CH2-CD1 4.05Å; W80-L82 HydrophobicContact CZ2-CB 3.78Å; W80-L82 HydrophobicContact CZ2-CD1 4.07Å; W80-L82 HydrophobicContact CZ2-CG 4.44Å; W80-L82 HydrophobicContact CZ3-CD1 4.5Å; W80-G83 PolarHBondContact NE1-O 3.43Å; W80-W86 AromaticContact CH2-CD1 4Å; W80-W86 HydrophobicContact CZ2-CB 4.05Å; W80-W86 AromaticContact CZ2-CD1 3.64Å; W80-W86 HydrophobicContact CZ2-CG 4.17Å; W80-C87 HydrophobicContact CD2-CB 4.14Å; W80-C87 HydrophobicContact CG-CB 4.32Å; W80-C87 VanDerWaalsContact CZ2-CA 3.45Å; W80-C87 HydrophobicContact CZ2-CB 3.95Å; W80-C87 VanDerWaalsContact CZ2-N 3.32Å; W80-V90 HydrophobicContact CH2-CB 4.28Å; W80-V90 HydrophobicContact CH2-CG2 4.07Å; W80-T164 WeakPolarHBondContact CB-O 3.14Å; W80-T164 PolarHBondContact N-O 3.26Å; W80-C166 HydrophobicContact CB-CB 3.84Å; W80-C166 HydrophobicContact CD2-CB 4Å; W80-C166 HydrophobicContact CE3-CB 4.08Å; W80-C166 HydrophobicContact CG-CB 3.9Å; W80-F167 HydrophobicContact CZ3-CE2 4.39Å; W80-F167 HydrophobicContact CZ3-CZ 4.16Å | ||
| 81 | K | 88.2 | Confident | 88.1 | Confident | 142 Ų | 142 | 52.1 Ų | 52.1 | 62% | 0.617 | 27% | 0.265 | S | S | * | . | trans | -114.6 | 5.2 | -179.1 | -63.3 | -178.1 | 178.7 | 164 | 0 | 114.8 | E79 G83 | E79-K81 WeakPolarHBondContact OE2-CE 3.48Å; E79-K81 IonicContact OE2-NZ 2.7Å; E79-K81 PolarHBondContact OE2-NZ 2.89Å; K81-G83 VanDerWaalsContact C-N 3.29Å; K81-G83 PolarHBondContact O-N 3.1Å | ||
| 82 | L | 87.5 | Confident | 87.7 | Confident | 80 Ų | 80 | 52.1 Ų | 52.1 | 42% | 0.419 | 27% | 0.265 | S | S | . | . | S | Bend | trans | -90.9 | 10.1 | -175.2 | -58.4 | 172 | 0 | 0 | 0 | 113.5 | F70 Y73 W80 W86 | F70-L82 HydrophobicContact CD1-CD1 3.46Å; F70-L82 VanDerWaalsContact CD1-CD1 3.46Å; F70-L82 HydrophobicContact CE1-CD1 4Å; F70-L82 HydrophobicContact CG-CD1 4.45Å; Y73-L82 HydrophobicContact CD1-CD1 4.37Å; Y73-L82 HydrophobicContact CE1-CD1 4.42Å; Y73-L82 HydrophobicContact CE1-CG 4.44Å; W80-L82 HydrophobicContact CH2-CD1 4.05Å; W80-L82 HydrophobicContact CZ2-CB 3.78Å; W80-L82 HydrophobicContact CZ2-CD1 4.07Å; W80-L82 HydrophobicContact CZ2-CG 4.44Å; W80-L82 HydrophobicContact CZ3-CD1 4.5Å; L82-W86 HydrophobicContact CB-CB 4.35Å; L82-W86 HydrophobicContact CB-CG 4.44Å; L82-W86 WeakPolarHBondContact O-CB 3.24Å |
| 83 | G | 85.1 | Confident | 87.5 | Confident | 31 Ų | 31 | 51.7 Ų | 51.7 | 32% | 0.32 | 26% | 0.262 | S | S | . | . | trans | 83.9 | 158 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | W80 K81 E85 W86 C87 | W80-G83 PolarHBondContact NE1-O 3.43Å; K81-G83 VanDerWaalsContact C-N 3.29Å; K81-G83 PolarHBondContact O-N 3.1Å; G83-E85 PolarHBondContact O-N 3.16Å; G83-W86 PolarHBondContact O-N 2.97Å; G83-C87 PolarHBondContact O-N 3.32Å | ||
| 84 | P | 80.9 | Confident | 87.3 | Confident | 76 Ų | 76 | 48.2 Ų | 48.2 | 49% | 0.494 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -67.7 | -36.4 | -170.9 | 25.4 | -34.3 | 0 | 0 | 0 | 113.2 | W86 C87 K88 | P84-W86 VanDerWaalsContact C-N 3.34Å; P84-W86 PolarHBondContact O-N 2.97Å; P84-C87 WeakPolarHBondContact O-CB 3.27Å; P84-C87 PolarHBondContact O-N 3.15Å; P84-K88 WeakPolarHBondContact O-CG 3.4Å; P84-K88 PolarHBondContact O-N 3.23Å |
| 85 | E | 81.9 | Confident | 87.2 | Confident | 104 Ų | 104 | 48.8 Ų | 48.8 | 49% | 0.486 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -66.7 | -37.2 | -179.6 | -61.4 | -51.9 | 123.7 | 0 | 0 | 112.1 | G83 K88 M89 F151 | G83-E85 PolarHBondContact O-N 3.16Å; E85-K88 PolarHBondContact O-N 3.15Å; E85-K88 IonicContact OE1-NZ 3.31Å; E85-K88 PolarHBondContact OE1-NZ 3.11Å; E85-K88 IonicContact OE2-NZ 3.92Å; E85-M89 PolarHBondContact O-N 2.75Å; E85-F151 WeakPolarHBondContact OE2-CE1 3.11Å |
| 86 | W | 87.2 | Confident | 87.2 | Confident | 106 Ų | 106 | 48.6 Ų | 48.6 | 40% | 0.402 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -70.7 | -37.3 | 175.4 | -158.6 | -120.3 | 0 | 0 | 0 | 111.8 | F70 W80 L82 G83 P84 M89 V90 | F70-W86 AromaticContact CD1-NE1 3.67Å; F70-W86 AromaticContact CD2-NE1 3.97Å; F70-W86 AromaticContact CE1-NE1 3.6Å; F70-W86 HydrophobicContact CE2-CZ2 4.05Å; F70-W86 AromaticContact CE2-NE1 3.94Å; F70-W86 AromaticContact CG-NE1 3.85Å; F70-W86 HydrophobicContact CZ-CZ2 4.14Å; F70-W86 AromaticContact CZ-NE1 3.74Å; W80-W86 AromaticContact CH2-CD1 4Å; W80-W86 HydrophobicContact CZ2-CB 4.05Å; W80-W86 AromaticContact CZ2-CD1 3.64Å; W80-W86 HydrophobicContact CZ2-CG 4.17Å; L82-W86 HydrophobicContact CB-CB 4.35Å; L82-W86 HydrophobicContact CB-CG 4.44Å; L82-W86 WeakPolarHBondContact O-CB 3.24Å; G83-W86 PolarHBondContact O-N 2.97Å; P84-W86 VanDerWaalsContact C-N 3.34Å; P84-W86 PolarHBondContact O-N 2.97Å; W86-M89 HydrophobicContact CE3-CB 4.22Å; W86-M89 HydrophobicContact CE3-CG 4.36Å; W86-M89 HydrophobicContact CZ3-CG 4.15Å; W86-M89 PolarHBondContact O-N 3.28Å; W86-V90 WeakPolarHBondContact O-CG2 3.5Å; W86-V90 PolarHBondContact O-N 3.28Å |
| 87 | C | 86.6 | Confident | 87.2 | Confident | 4 Ų | 4 | 44 Ų | 44 | 3% | 0.027 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -58.4 | -49.7 | 172.7 | 171.4 | 0 | 0 | 0 | 0 | 110.6 | W80 G83 P84 M89 V90 S91 Y154 C166 | W80-C87 HydrophobicContact CD2-CB 4.14Å; W80-C87 HydrophobicContact CG-CB 4.32Å; W80-C87 VanDerWaalsContact CZ2-CA 3.45Å; W80-C87 HydrophobicContact CZ2-CB 3.95Å; W80-C87 VanDerWaalsContact CZ2-N 3.32Å; G83-C87 PolarHBondContact O-N 3.32Å; P84-C87 WeakPolarHBondContact O-CB 3.27Å; P84-C87 PolarHBondContact O-N 3.15Å; C87-M89 VanDerWaalsContact C-N 3.32Å; C87-M89 PolarHBondContact O-N 2.61Å; C87-V90 PolarHBondContact O-N 2.96Å; C87-S91 WeakPolarHBondContact O-CB 3.47Å; C87-S91 PolarHBondContact O-N 3.2Å; C87-Y154 PolarHBondContact SG-OH 3.04Å; C87-C166 HydrophobicContact CB-CB 4.12Å; C87-C166 WeakPolarHBondContact CB-SG 3.36Å; C87-C166 VanDerWaalsContact SG-CA 3.57Å; C87-C166 WeakPolarHBondContact SG-CB 3.47Å; C87-C166 CovalentContact SG-SG 2.03Å; C87-C166 PolarHBondContact SG-SG 3.27Å |
| 88 | K | 83.3 | Confident | 87.3 | Confident | 33 Ų | 33 | 41.4 Ų | 41.4 | 14% | 0.143 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -56.4 | -43.8 | 175.8 | -72 | 172.1 | -171.8 | 167.2 | 0 | 112.4 | P84 E85 S91 A92 F151 Y154 | P84-K88 WeakPolarHBondContact O-CG 3.4Å; P84-K88 PolarHBondContact O-N 3.23Å; E85-K88 PolarHBondContact O-N 3.15Å; E85-K88 IonicContact OE1-NZ 3.31Å; E85-K88 PolarHBondContact OE1-NZ 3.11Å; E85-K88 IonicContact OE2-NZ 3.92Å; K88-S91 WeakPolarHBondContact O-CB 3.43Å; K88-S91 PolarHBondContact O-N 3Å; K88-A92 WeakPolarHBondContact O-CB 3.24Å; K88-A92 PolarHBondContact O-N 2.99Å; K88-F151 HydrophobicContact CB-CD2 4.35Å; K88-F151 HydrophobicContact CB-CE1 3.99Å; K88-F151 HydrophobicContact CB-CE2 3.83Å; K88-F151 HydrophobicContact CB-CZ 3.62Å; K88-F151 HydrophobicContact CD-CD1 3.78Å; K88-F151 HydrophobicContact CD-CE1 3.75Å; K88-F151 HydrophobicContact CD-CG 4.29Å; K88-F151 HydrophobicContact CD-CZ 4.26Å; K88-Y154 HydrophobicContact CD-CD1 3.99Å; K88-Y154 HydrophobicContact CG-CD1 3.33Å; K88-Y154 HydrophobicContact CG-CE1 3.59Å; K88-Y154 HydrophobicContact CG-CG 3.98Å |
| 89 | M | 86.1 | Confident | 87.5 | Confident | 75 Ų | 75 | 38.6 Ų | 38.6 | 37% | 0.369 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -60.7 | -55.5 | 177.1 | -177.5 | 64.8 | 83.7 | 0 | 0 | 111 | E85 W86 C87 S91 A92 M93 | E85-M89 PolarHBondContact O-N 2.75Å; W86-M89 HydrophobicContact CE3-CB 4.22Å; W86-M89 HydrophobicContact CE3-CG 4.36Å; W86-M89 HydrophobicContact CZ3-CG 4.15Å; W86-M89 PolarHBondContact O-N 3.28Å; C87-M89 VanDerWaalsContact C-N 3.32Å; C87-M89 PolarHBondContact O-N 2.61Å; M89-S91 PolarHBondContact O-N 3.4Å; M89-A92 WeakPolarHBondContact O-CA 3.22Å; M89-A92 PolarHBondContact O-N 3.13Å; M89-M93 HydrophobicContact CG-CG 4.35Å; M89-M93 VanDerWaalsContact O-CG 3.28Å; M89-M93 WeakPolarHBondContact O-CG 3.29Å; M89-M93 PolarHBondContact O-N 3.2Å; M89-M93 HydrophobicContact SD-CG 4.36Å; M89-M93 HydrophobicContact SD-SD 4.19Å |
| 90 | V | 89.9 | Confident | 87.6 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62.9 | -32.5 | -179.1 | 176.6 | 0 | 0 | 0 | 0 | 112.1 | F70 R71 W80 W86 C87 F167 | F70-V90 HydrophobicContact CB-CG1 4.3Å; F70-V90 HydrophobicContact CB-CG2 4.07Å; F70-V90 HydrophobicContact CD2-CG2 4.29Å; F70-V90 HydrophobicContact CG-CG2 4.37Å; R71-V90 HydrophobicContact CG-CG1 3.73Å; R71-V90 PolarHBondContact NH2-O 3.45Å; W80-V90 HydrophobicContact CH2-CB 4.28Å; W80-V90 HydrophobicContact CH2-CG2 4.07Å; W86-V90 WeakPolarHBondContact O-CG2 3.5Å; W86-V90 PolarHBondContact O-N 3.28Å; C87-V90 PolarHBondContact O-N 2.96Å; V90-F167 HydrophobicContact CB-CE1 4.3Å; V90-F167 HydrophobicContact CB-CZ 4.32Å; V90-F167 HydrophobicContact CG1-CE1 3.9Å; V90-F167 HydrophobicContact CG1-CZ 3.69Å |
| 91 | S | 86 | Confident | 87.8 | Confident | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -61.6 | -46.1 | 170.7 | 149.3 | 0 | 0 | 0 | 0 | 111.6 | C87 K88 M89 I94 H95 F169 | C87-S91 WeakPolarHBondContact O-CB 3.47Å; C87-S91 PolarHBondContact O-N 3.2Å; K88-S91 WeakPolarHBondContact O-CB 3.43Å; K88-S91 PolarHBondContact O-N 3Å; M89-S91 PolarHBondContact O-N 3.4Å; S91-I94 WeakPolarHBondContact O-CG2 3.33Å; S91-H95 PolarHBondContact O-ND1 3.47Å; S91-F169 WeakPolarHBondContact OG-CE1 3.14Å; S91-F169 WeakPolarHBondContact OG-CZ 3.3Å |
| 92 | A | 85.9 | Confident | 87.9 | Confident | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -70.4 | -35.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | K88 M89 I94 H95 I96 I150 | K88-A92 WeakPolarHBondContact O-CB 3.24Å; K88-A92 PolarHBondContact O-N 2.99Å; M89-A92 WeakPolarHBondContact O-CA 3.22Å; M89-A92 PolarHBondContact O-N 3.13Å; A92-I94 VanDerWaalsContact C-N 3.31Å; A92-I94 PolarHBondContact O-N 3.41Å; A92-H95 PolarHBondContact O-N 2.99Å; A92-I96 HydrophobicContact CB-CD1 4.12Å; A92-I96 WeakPolarHBondContact O-CG1 3.43Å; A92-I96 PolarHBondContact O-N 3.24Å; A92-I150 HydrophobicContact CB-CB 4.44Å; A92-I150 HydrophobicContact CB-CD1 3.59Å; A92-I150 HydrophobicContact CB-CG2 4.38Å |
| 93 | M | 90.4 | Very high | 88 | Confident | 19 Ų | 19 | 27.3 Ų | 27.3 | 9% | 0.094 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61.1 | -33.2 | -173.2 | -73.3 | -51 | -60.1 | 0 | 0 | 114.3 | V63 T67 M89 I96 H97 | V63-M93 HydrophobicContact CG1-CE 3.54Å; T67-M93 HydrophobicContact CG2-CB 4.02Å; T67-M93 HydrophobicContact CG2-CG 3.77Å; M89-M93 HydrophobicContact CG-CG 4.35Å; M89-M93 VanDerWaalsContact O-CG 3.28Å; M89-M93 WeakPolarHBondContact O-CG 3.29Å; M89-M93 PolarHBondContact O-N 3.2Å; M89-M93 HydrophobicContact SD-CG 4.36Å; M89-M93 HydrophobicContact SD-SD 4.19Å; M93-I96 HydrophobicContact SD-CD1 3.76Å; M93-H97 WeakPolarHBondContact O-CB 3.48Å; M93-H97 PolarHBondContact O-N 2.72Å |
| 94 | I | 90.8 | Very high | 88.1 | Confident | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -67.6 | -38.1 | 176 | -164.6 | 162 | 0 | 0 | 0 | 111.9 | Y24 F64 S91 A92 M98 L260 T264 | Y24-I94 HydrophobicContact CE1-CD1 4.27Å; Y24-I94 WeakPolarHBondContact OH-CD1 3.44Å; F64-I94 HydrophobicContact CE2-CB 4.01Å; F64-I94 HydrophobicContact CE2-CD1 4.48Å; F64-I94 HydrophobicContact CE2-CG1 3.94Å; F64-I94 HydrophobicContact CZ-CG1 4.36Å; S91-I94 WeakPolarHBondContact O-CG2 3.33Å; A92-I94 VanDerWaalsContact C-N 3.31Å; A92-I94 PolarHBondContact O-N 3.41Å; I94-M98 WeakPolarHBondContact O-CB 3.31Å; I94-M98 PolarHBondContact O-N 3.46Å; I94-L260 HydrophobicContact CD1-CD1 4.21Å; I94-L260 HydrophobicContact CD1-CD2 4.28Å; I94-L260 HydrophobicContact CD1-CG 3.8Å; I94-L260 HydrophobicContact CG1-CD1 4.19Å; I94-L260 HydrophobicContact CG1-CG 4.31Å; I94-L260 HydrophobicContact CG2-CD1 4.43Å; I94-L260 HydrophobicContact CG2-CD2 4.06Å; I94-L260 HydrophobicContact CG2-CG 4.47Å; I94-T264 HydrophobicContact CD1-CG2 3.56Å; I94-T264 HydrophobicContact CG1-CG2 3.91Å |
| 95 | H | 88.8 | Confident | 88.4 | Confident | 17 Ų | 17 | 22.3 Ų | 22.3 | 8% | 0.079 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -72 | -45.3 | 177.4 | -67.1 | 92.6 | 0 | 0 | 0 | 110.6 | S91 A92 H97 M98 Y99 I146 I150 | S91-H95 PolarHBondContact O-ND1 3.47Å; A92-H95 PolarHBondContact O-N 2.99Å; H95-H97 VanDerWaalsContact C-N 3.31Å; H95-H97 PolarHBondContact O-N 2.9Å; H95-M98 PolarHBondContact O-N 3.02Å; H95-Y99 HydrophobicContact CB-CE2 4.48Å; H95-Y99 WeakPolarHBondContact O-CD2 3.47Å; H95-Y99 PolarHBondContact O-N 2.99Å; H95-I146 HydrophobicContact CB-CG2 3.87Å; H95-I150 HydrophobicContact CB-CD1 4.3Å |
| 96 | I | 89.4 | Confident | 88.6 | Confident | 7 Ų | 7 | 19.3 Ų | 19.3 | 4% | 0.036 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -54 | -51.7 | 172.7 | -67.8 | 167 | 0 | 0 | 0 | 109.8 | A92 M93 Y99 M100 V142 L143 I146 P147 | A92-I96 HydrophobicContact CB-CD1 4.12Å; A92-I96 WeakPolarHBondContact O-CG1 3.43Å; A92-I96 PolarHBondContact O-N 3.24Å; M93-I96 HydrophobicContact SD-CD1 3.76Å; I96-Y99 PolarHBondContact O-N 2.94Å; I96-M100 HydrophobicContact CG2-CE 4.35Å; I96-M100 HydrophobicContact CG2-CG 3.91Å; I96-M100 WeakPolarHBondContact O-CB 3.25Å; I96-M100 WeakPolarHBondContact O-CG 3.28Å; I96-M100 PolarHBondContact O-N 3.11Å; I96-V142 HydrophobicContact CG2-CG1 4.42Å; I96-L143 HydrophobicContact CD1-CD2 4.33Å; I96-L143 HydrophobicContact CG2-CD2 3.83Å; I96-I146 HydrophobicContact CG1-CB 3.83Å; I96-I146 HydrophobicContact CG1-CD1 4.45Å; I96-I146 HydrophobicContact CG1-CG2 3.64Å; I96-P147 HydrophobicContact CD1-CG 3.74Å |
| 97 | H | 93.1 | Very high | 88.5 | Confident | 2 Ų | 2 | 17.4 Ų | 17.4 | 1% | 0.009 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -56.2 | -53.2 | 178.4 | 171.9 | -108.7 | 0 | 0 | 0 | 111.7 | H61 F64 M93 H95 Y99 M100 S101 | H61-H97 AromaticContact CE1-NE2 3.59Å; H61-H97 AromaticContact ND1-NE2 3.15Å; H61-H97 PolarHBondContact ND1-NE2 3.25Å; H61-H97 VanDerWaalsContact ND1-NE2 3.15Å; F64-H97 HydrophobicContact CB-CB 3.85Å; F64-H97 AromaticContact CD1-CE1 4Å; F64-H97 AromaticContact CD1-CG 3.99Å; F64-H97 AromaticContact CD1-ND1 3.85Å; F64-H97 HydrophobicContact CD2-CB 3.62Å; F64-H97 AromaticContact CD2-CG 3.76Å; F64-H97 HydrophobicContact CE2-CB 4.44Å; F64-H97 HydrophobicContact CG-CB 3.79Å; F64-H97 AromaticContact CG-CD2 3.85Å; F64-H97 AromaticContact CG-CG 3.47Å; F64-H97 VanDerWaalsContact CG-CG 3.47Å; F64-H97 AromaticContact CG-ND1 3.76Å; M93-H97 WeakPolarHBondContact O-CB 3.48Å; M93-H97 PolarHBondContact O-N 2.72Å; H95-H97 VanDerWaalsContact C-N 3.31Å; H95-H97 PolarHBondContact O-N 2.9Å; H97-Y99 PolarHBondContact O-N 3.17Å; H97-M100 PolarHBondContact O-N 3.04Å; H97-S101 PolarHBondContact NE2-OG 3.46Å; H97-S101 VanDerWaalsContact O-CB 3.25Å; H97-S101 WeakPolarHBondContact O-CB 3.27Å; H97-S101 PolarHBondContact O-N 3.13Å; H97-S101 PolarHBondContact O-OG 3.49Å |
| 98 | M | 91.3 | Very high | 88.4 | Confident | 1 Ų | 1 | 18.3 Ų | 18.3 | 1% | 0.005 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -55.3 | -51.1 | -179.3 | -177.1 | -176.4 | 67.1 | 0 | 0 | 112.2 | I94 H95 F102 Y236 Y239 T263 | I94-M98 WeakPolarHBondContact O-CB 3.31Å; I94-M98 PolarHBondContact O-N 3.46Å; H95-M98 PolarHBondContact O-N 3.02Å; M98-F102 VanDerWaalsContact O-CB 3.3Å; M98-F102 WeakPolarHBondContact O-CB 3.46Å; M98-F102 PolarHBondContact O-N 3.19Å; M98-Y236 HydrophobicContact CG-CD1 4.19Å; M98-Y236 HydrophobicContact CG-CE1 3.99Å; M98-Y239 HydrophobicContact CE-CE1 3.94Å; M98-Y239 HydrophobicContact SD-CD1 3.75Å; M98-Y239 HydrophobicContact SD-CE1 3.66Å; M98-T263 HydrophobicContact SD-CG2 4Å |
| 99 | Y | 89.9 | Confident | 88.4 | Confident | 21 Ų | 21 | 16.7 Ų | 16.7 | 8% | 0.082 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -75.8 | -36.6 | -177.5 | -66.3 | -65.4 | 0 | 0 | 0 | 113 | H95 I96 H97 F102 L103 I146 L183 V187 H240 | H95-Y99 HydrophobicContact CB-CE2 4.48Å; H95-Y99 WeakPolarHBondContact O-CD2 3.47Å; H95-Y99 PolarHBondContact O-N 2.99Å; I96-Y99 PolarHBondContact O-N 2.94Å; H97-Y99 PolarHBondContact O-N 3.17Å; Y99-F102 PolarHBondContact O-N 3.46Å; Y99-L103 WeakPolarHBondContact O-CG 3.18Å; Y99-L103 PolarHBondContact O-N 3.05Å; Y99-I146 HydrophobicContact CD2-CD1 3.37Å; Y99-I146 HydrophobicContact CE2-CD1 4.2Å; Y99-I146 HydrophobicContact CG-CD1 4.06Å; Y99-L183 HydrophobicContact CD1-CD1 4.2Å; Y99-L183 HydrophobicContact CD1-CD2 4.4Å; Y99-L183 HydrophobicContact CD1-CG 4.45Å; Y99-L183 HydrophobicContact CE1-CD1 3.71Å; Y99-L183 HydrophobicContact CE1-CD2 3.53Å; Y99-L183 HydrophobicContact CE1-CG 3.52Å; Y99-L183 HydrophobicContact CE2-CD2 3.99Å; Y99-L183 WeakPolarHBondContact OH-CD2 3.31Å; Y99-V187 HydrophobicContact CE1-CG2 4.16Å; Y99-H240 AromaticContact CE1-CE1 3.96Å |
| 100 | M | 90.2 | Very high | 88.2 | Confident | 1 Ų | 1 | 16.1 Ų | 16.1 | 1% | 0.005 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -60.2 | -51.2 | 173.1 | -77.6 | -63.2 | -162.4 | 0 | 0 | 111.1 | I96 H97 F102 L103 L104 W139 V142 L143 | I96-M100 HydrophobicContact CG2-CE 4.35Å; I96-M100 HydrophobicContact CG2-CG 3.91Å; I96-M100 WeakPolarHBondContact O-CB 3.25Å; I96-M100 WeakPolarHBondContact O-CG 3.28Å; I96-M100 PolarHBondContact O-N 3.11Å; H97-M100 PolarHBondContact O-N 3.04Å; M100-F102 VanDerWaalsContact C-N 3.34Å; M100-F102 PolarHBondContact O-N 3.35Å; M100-L103 PolarHBondContact O-N 2.8Å; M100-L104 VanDerWaalsContact O-CG 3.31Å; M100-L104 WeakPolarHBondContact O-CG 3.49Å; M100-L104 PolarHBondContact O-N 3.41Å; M100-W139 HydrophobicContact CE-CB 4.44Å; M100-W139 HydrophobicContact CE-CD2 3.98Å; M100-W139 HydrophobicContact CE-CE3 3.59Å; M100-W139 HydrophobicContact CE-CG 4.37Å; M100-W139 HydrophobicContact CE-CZ3 4.12Å; M100-W139 WeakPolarHBondContact CE-O 3.48Å; M100-W139 HydrophobicContact SD-CD2 4.47Å; M100-V142 HydrophobicContact CE-CB 3.39Å; M100-V142 HydrophobicContact CE-CG1 3.59Å; M100-V142 HydrophobicContact CE-CG2 4.4Å; M100-V142 HydrophobicContact CG-CB 4.24Å; M100-V142 HydrophobicContact CG-CG1 3.64Å; M100-V142 HydrophobicContact SD-CB 3.52Å; M100-V142 VanDerWaalsContact SD-CB 3.52Å; M100-V142 HydrophobicContact SD-CG1 3.63Å; M100-V142 HydrophobicContact SD-CG2 3.94Å; M100-L143 HydrophobicContact CE-CD2 4.11Å; M100-L143 HydrophobicContact CE-CG 3.71Å |
| 101 | S | 91.8 | Very high | 87.8 | Confident | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -58.9 | -49.3 | 177.3 | -73.5 | 0 | 0 | 0 | 0 | 109.4 | H97 L103 L104 Y105 Y236 | H97-S101 PolarHBondContact NE2-OG 3.46Å; H97-S101 VanDerWaalsContact O-CB 3.25Å; H97-S101 WeakPolarHBondContact O-CB 3.27Å; H97-S101 PolarHBondContact O-N 3.13Å; H97-S101 PolarHBondContact O-OG 3.49Å; S101-L103 VanDerWaalsContact C-N 3.34Å; S101-L103 PolarHBondContact O-N 3.4Å; S101-L104 PolarHBondContact O-N 3.28Å; S101-L104 VanDerWaalsContact O-N 3.1Å; S101-Y105 WeakPolarHBondContact O-CB 3.29Å; S101-Y105 WeakPolarHBondContact O-CD2 3.24Å; S101-Y105 PolarHBondContact O-N 3.49Å; S101-Y236 WeakPolarHBondContact CB-OH 3.47Å |
| 102 | F | 90.3 | Very high | 87.5 | Confident | 12 Ų | 12 | 26.5 Ų | 26.5 | 5% | 0.053 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -52.2 | -47.7 | 176.4 | -177.2 | -105.6 | 0 | 0 | 0 | 113.6 | M98 Y99 M100 L104 Y105 M106 V187 V190 A191 M232 Y236 | M98-F102 VanDerWaalsContact O-CB 3.3Å; M98-F102 WeakPolarHBondContact O-CB 3.46Å; M98-F102 PolarHBondContact O-N 3.19Å; Y99-F102 PolarHBondContact O-N 3.46Å; M100-F102 VanDerWaalsContact C-N 3.34Å; M100-F102 PolarHBondContact O-N 3.35Å; F102-L104 PolarHBondContact O-N 2.97Å; F102-Y105 WeakPolarHBondContact O-CB 3.44Å; F102-Y105 PolarHBondContact O-N 3.34Å; F102-M106 HydrophobicContact CD1-CG 4.31Å; F102-M106 HydrophobicContact CE1-CG 4.04Å; F102-M106 HydrophobicContact CE1-SD 4.43Å; F102-M106 HydrophobicContact CZ-CG 4.24Å; F102-M106 HydrophobicContact CZ-SD 4.16Å; F102-M106 VanDerWaalsContact O-CG 3.22Å; F102-M106 WeakPolarHBondContact O-CG 3.46Å; F102-M106 PolarHBondContact O-N 3.36Å; F102-V187 HydrophobicContact CD1-CG2 4.25Å; F102-V187 HydrophobicContact CD2-CG1 4.17Å; F102-V187 HydrophobicContact CE1-CG2 4.04Å; F102-V187 HydrophobicContact CE2-CG1 3.87Å; F102-V187 HydrophobicContact CZ-CB 4.28Å; F102-V187 HydrophobicContact CZ-CG1 4.08Å; F102-V187 HydrophobicContact CZ-CG2 4.27Å; F102-V190 HydrophobicContact CE1-CG1 4.22Å; F102-V190 HydrophobicContact CE2-CG1 4.49Å; F102-V190 HydrophobicContact CZ-CB 3.92Å; F102-V190 HydrophobicContact CZ-CG1 3.58Å; F102-A191 HydrophobicContact CE2-CB 4.32Å; F102-M232 HydrophobicContact CD2-CG 4.32Å; F102-M232 HydrophobicContact CD2-SD 3.78Å; F102-M232 HydrophobicContact CE2-SD 3.81Å; F102-Y236 HydrophobicContact CB-CD2 4.47Å; F102-Y236 HydrophobicContact CB-CE2 4.03Å; F102-Y236 AromaticContact CD2-CD2 3.94Å; F102-Y236 HydrophobicContact CD2-CD2 3.94Å; F102-Y236 HydrophobicContact CD2-CE2 4.19Å |
| 103 | L | 88.6 | Confident | 87.3 | Confident | 65 Ų | 65 | 26.9 Ų | 26.9 | 34% | 0.34 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -66.5 | -37.5 | 178.2 | -67.2 | 175.1 | 0 | 0 | 0 | 113.1 | Y99 M100 S101 Y105 M106 I107 M138 V142 | Y99-L103 WeakPolarHBondContact O-CG 3.18Å; Y99-L103 PolarHBondContact O-N 3.05Å; M100-L103 PolarHBondContact O-N 2.8Å; S101-L103 VanDerWaalsContact C-N 3.34Å; S101-L103 PolarHBondContact O-N 3.4Å; L103-Y105 VanDerWaalsContact C-N 3.35Å; L103-M106 WeakPolarHBondContact O-CB 3Å; L103-M106 PolarHBondContact O-N 2.93Å; L103-I107 VanDerWaalsContact O-CG1 3.32Å; L103-I107 WeakPolarHBondContact O-CG1 3.33Å; L103-I107 PolarHBondContact O-N 3.5Å; L103-I107 VanDerWaalsContact O-N 3.1Å; L103-M138 HydrophobicContact CB-CG 4.26Å; L103-M138 HydrophobicContact CB-SD 3.56Å; L103-M138 VanDerWaalsContact CB-SD 3.56Å; L103-M138 HydrophobicContact CD1-CG 3.77Å; L103-M138 HydrophobicContact CD1-SD 4.21Å; L103-V142 HydrophobicContact CD1-CG2 3.75Å |
| 104 | L | 88.3 | Confident | 87 | Confident | 1 Ų | 1 | 32.2 Ų | 32.2 | 1% | 0.005 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -65.9 | -40.3 | 175 | -71.3 | 166.9 | 0 | 0 | 0 | 111.4 | T53 N56 L57 M100 S101 F102 I107 I108 M138 | T53-L104 HydrophobicContact CG2-CB 4.24Å; T53-L104 HydrophobicContact CG2-CD2 3.66Å; T53-L104 WeakPolarHBondContact CG2-O 3.24Å; N56-L104 HydrophobicContact CB-CD1 4.1Å; N56-L104 HydrophobicContact CB-CD2 3.73Å; L57-L104 HydrophobicContact CB-CB 4.44Å; L57-L104 HydrophobicContact CB-CD1 4.04Å; L57-L104 HydrophobicContact CD1-CB 4.16Å; L57-L104 HydrophobicContact CD1-CD1 4.08Å; M100-L104 VanDerWaalsContact O-CG 3.31Å; M100-L104 WeakPolarHBondContact O-CG 3.49Å; M100-L104 PolarHBondContact O-N 3.41Å; S101-L104 PolarHBondContact O-N 3.28Å; S101-L104 VanDerWaalsContact O-N 3.1Å; F102-L104 PolarHBondContact O-N 2.97Å; L104-I107 PolarHBondContact O-N 3.48Å; L104-I108 VanDerWaalsContact O-CG1 3.31Å; L104-I108 WeakPolarHBondContact O-CG1 3.41Å; L104-I108 PolarHBondContact O-N 2.95Å; L104-M138 HydrophobicContact CD1-CE 4.48Å; L104-M138 HydrophobicContact CD2-CE 3.44Å; L104-M138 VanDerWaalsContact CD2-CE 3.44Å; L104-M138 HydrophobicContact CD2-SD 4.43Å; L104-M138 HydrophobicContact CG-CE 3.74Å |
| 105 | Y | 87.6 | Confident | 86.5 | Confident | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -59.3 | -48.4 | 172.9 | -88.3 | -113.9 | 0 | 0 | 0 | 111.5 | L57 S101 F102 L103 I107 I108 L109 F228 M232 N266 D269 | L57-Y105 HydrophobicContact CD1-CD2 4.08Å; L57-Y105 HydrophobicContact CD1-CE2 3.86Å; L57-Y105 HydrophobicContact CD2-CD2 4.25Å; L57-Y105 HydrophobicContact CD2-CE2 3.94Å; S101-Y105 WeakPolarHBondContact O-CB 3.29Å; S101-Y105 WeakPolarHBondContact O-CD2 3.24Å; S101-Y105 PolarHBondContact O-N 3.49Å; F102-Y105 WeakPolarHBondContact O-CB 3.44Å; F102-Y105 PolarHBondContact O-N 3.34Å; L103-Y105 VanDerWaalsContact C-N 3.35Å; Y105-I107 VanDerWaalsContact C-N 3.29Å; Y105-I107 PolarHBondContact O-N 3.32Å; Y105-I108 PolarHBondContact O-N 3.25Å; Y105-I108 VanDerWaalsContact O-N 3.12Å; Y105-L109 WeakPolarHBondContact O-CB 3.46Å; Y105-L109 VanDerWaalsContact O-CG 3.24Å; Y105-L109 WeakPolarHBondContact O-CG 3.42Å; Y105-L109 PolarHBondContact O-N 3.28Å; Y105-F228 AromaticContact CD1-CD1 3.23Å; Y105-F228 HydrophobicContact CD1-CD1 3.23Å; Y105-F228 HydrophobicContact CD1-CD2 4.37Å; Y105-F228 AromaticContact CD1-CE1 2.88Å; Y105-F228 HydrophobicContact CD1-CE1 2.88Å; Y105-F228 HydrophobicContact CD1-CE2 4.09Å; Y105-F228 AromaticContact CD1-CG 3.99Å; Y105-F228 HydrophobicContact CD1-CG 3.99Å; Y105-F228 AromaticContact CD1-CZ 3.36Å; Y105-F228 HydrophobicContact CD1-CZ 3.36Å; Y105-F228 AromaticContact CD2-CE1 3.76Å; Y105-F228 HydrophobicContact CD2-CE1 3.76Å; Y105-F228 HydrophobicContact CD2-CE2 4.42Å; Y105-F228 AromaticContact CD2-CZ 3.51Å; Y105-F228 HydrophobicContact CD2-CZ 3.51Å; Y105-F228 AromaticContact CE1-CD1 3.26Å; Y105-F228 HydrophobicContact CE1-CD1 3.26Å; Y105-F228 AromaticContact CE1-CD2 3.57Å; Y105-F228 HydrophobicContact CE1-CD2 3.57Å; Y105-F228 AromaticContact CE1-CE1 3.08Å; Y105-F228 HydrophobicContact CE1-CE1 3.08Å; Y105-F228 AromaticContact CE1-CE2 3.36Å; Y105-F228 HydrophobicContact CE1-CE2 3.36Å; Y105-F228 AromaticContact CE1-CG 3.51Å; Y105-F228 HydrophobicContact CE1-CG 3.51Å; Y105-F228 AromaticContact CE1-CZ 3.1Å; Y105-F228 HydrophobicContact CE1-CZ 3.1Å; Y105-F228 AromaticContact CE2-CE1 3.96Å; Y105-F228 HydrophobicContact CE2-CE1 3.96Å; Y105-F228 AromaticContact CE2-CE2 3.82Å; Y105-F228 HydrophobicContact CE2-CE2 3.82Å; Y105-F228 AromaticContact CE2-CZ 3.33Å; Y105-F228 HydrophobicContact CE2-CZ 3.33Å; Y105-F228 HydrophobicContact CG-CD1 4.07Å; Y105-F228 AromaticContact CG-CE1 3.27Å; Y105-F228 HydrophobicContact CG-CE1 3.27Å; Y105-F228 AromaticContact CG-CZ 3.56Å; Y105-F228 HydrophobicContact CG-CZ 3.56Å; Y105-F228 AromaticContact CZ-CD2 3.81Å; Y105-F228 AromaticContact CZ-CE1 3.63Å; Y105-F228 AromaticContact CZ-CE2 3.21Å; Y105-F228 AromaticContact CZ-CZ 3.09Å; Y105-F228 VanDerWaalsContact OH-CE2 3.31Å; Y105-F228 WeakPolarHBondContact OH-CE2 3.47Å; Y105-M232 HydrophobicContact CD1-CB 3.96Å; Y105-M232 HydrophobicContact CD1-CG 4.3Å; Y105-M232 HydrophobicContact CD1-SD 4.15Å; Y105-M232 HydrophobicContact CE1-CB 4.03Å; Y105-M232 HydrophobicContact CG-SD 4.46Å; Y105-N266 WeakPolarHBondContact CE2-OD1 3.4Å; Y105-N266 PolarHBondContact OH-ND2 3.15Å; Y105-N266 PolarHBondContact OH-OD1 2.79Å; Y105-D269 VanDerWaalsContact CZ-OD2 3.31Å; Y105-D269 WeakPolarHBondContact OH-CB 3.22Å; Y105-D269 PolarHBondContact OH-OD2 2.98Å |
| 106 | M | 86.1 | Confident | 86.2 | Confident | 42 Ų | 42 | 39.5 Ų | 39.5 | 21% | 0.207 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -50.6 | -50.1 | 174.6 | -73.5 | -65.9 | -66.9 | 0 | 0 | 111.8 | F102 L103 I108 L109 V110 V190 L194 | F102-M106 HydrophobicContact CD1-CG 4.31Å; F102-M106 HydrophobicContact CE1-CG 4.04Å; F102-M106 HydrophobicContact CE1-SD 4.43Å; F102-M106 HydrophobicContact CZ-CG 4.24Å; F102-M106 HydrophobicContact CZ-SD 4.16Å; F102-M106 VanDerWaalsContact O-CG 3.22Å; F102-M106 WeakPolarHBondContact O-CG 3.46Å; F102-M106 PolarHBondContact O-N 3.36Å; L103-M106 WeakPolarHBondContact O-CB 3Å; L103-M106 PolarHBondContact O-N 2.93Å; M106-I108 PolarHBondContact O-N 3.32Å; M106-L109 PolarHBondContact O-N 2.84Å; M106-V110 WeakPolarHBondContact O-CB 3.38Å; M106-V110 VanDerWaalsContact O-CG2 3.28Å; M106-V110 WeakPolarHBondContact O-CG2 3.3Å; M106-V110 PolarHBondContact O-N 3.1Å; M106-V190 HydrophobicContact CE-CG1 3.17Å; M106-V190 HydrophobicContact CG-CG1 4.31Å; M106-V190 HydrophobicContact SD-CB 4.45Å; M106-V190 HydrophobicContact SD-CG1 2.97Å; M106-V190 WeakPolarHBondContact SD-CG1 3.37Å; M106-L194 HydrophobicContact CE-CD1 3.77Å; M106-L194 HydrophobicContact CE-CG 4.41Å; M106-L194 HydrophobicContact SD-CD1 3.12Å; M106-L194 WeakPolarHBondContact SD-CD1 3.3Å; M106-L194 HydrophobicContact SD-CG 4.08Å |
| 107 | I | 84.8 | Confident | 85.8 | Confident | 66 Ų | 66 | 44.3 Ų | 44.3 | 34% | 0.338 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -62.4 | -44.5 | -180 | -66.1 | 164.2 | 0 | 0 | 0 | 110.7 | T53 L103 L104 Y105 T111 M138 | T53-I107 HydrophobicContact CG2-CB 3.93Å; T53-I107 HydrophobicContact CG2-CG2 3.78Å; L103-I107 VanDerWaalsContact O-CG1 3.32Å; L103-I107 WeakPolarHBondContact O-CG1 3.33Å; L103-I107 PolarHBondContact O-N 3.5Å; L103-I107 VanDerWaalsContact O-N 3.1Å; L104-I107 PolarHBondContact O-N 3.48Å; Y105-I107 VanDerWaalsContact C-N 3.29Å; Y105-I107 PolarHBondContact O-N 3.32Å; I107-T111 VanDerWaalsContact O-CB 3.29Å; I107-T111 WeakPolarHBondContact O-CB 3.04Å; I107-T111 PolarHBondContact O-N 3.38Å; I107-T111 PolarHBondContact O-OG1 3.41Å; I107-M138 HydrophobicContact CD1-SD 3.88Å |
| 108 | I | 83.1 | Confident | 84.9 | Confident | 22 Ų | 22 | 46.3 Ų | 46.3 | 11% | 0.113 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -58.6 | -51.1 | 177.3 | -68.6 | 164.9 | 0 | 0 | 0 | 110 | T53 V54 L57 L104 Y105 M106 T111 R112 F228 | T53-I108 HydrophobicContact CG2-CD1 4.21Å; T53-I108 HydrophobicContact CG2-CG1 3.7Å; V54-I108 HydrophobicContact CG2-CD1 4.27Å; L57-I108 HydrophobicContact CD2-CD1 4.06Å; L104-I108 VanDerWaalsContact O-CG1 3.31Å; L104-I108 WeakPolarHBondContact O-CG1 3.41Å; L104-I108 PolarHBondContact O-N 2.95Å; Y105-I108 PolarHBondContact O-N 3.25Å; Y105-I108 VanDerWaalsContact O-N 3.12Å; M106-I108 PolarHBondContact O-N 3.32Å; I108-T111 WeakPolarHBondContact O-CB 3.47Å; I108-T111 PolarHBondContact O-N 2.96Å; I108-R112 HydrophobicContact CG2-CG 4.42Å; I108-R112 VanDerWaalsContact O-CG 3.24Å; I108-R112 WeakPolarHBondContact O-CG 3.33Å; I108-R112 PolarHBondContact O-N 2.68Å; I108-F228 HydrophobicContact CB-CE1 4.41Å; I108-F228 HydrophobicContact CD1-CE1 3.9Å; I108-F228 HydrophobicContact CD1-CZ 3.85Å; I108-F228 HydrophobicContact CG2-CE1 4.29Å |
| 109 | L | 83.3 | Confident | 83.5 | Confident | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -65.7 | -46.7 | -176 | -65.9 | 169.4 | 0 | 0 | 0 | 112.2 | Y105 M106 T111 R112 L113 L194 S225 T229 M232 | Y105-L109 WeakPolarHBondContact O-CB 3.46Å; Y105-L109 VanDerWaalsContact O-CG 3.24Å; Y105-L109 WeakPolarHBondContact O-CG 3.42Å; Y105-L109 PolarHBondContact O-N 3.28Å; M106-L109 PolarHBondContact O-N 2.84Å; L109-T111 VanDerWaalsContact C-N 3.29Å; L109-T111 PolarHBondContact O-N 2.99Å; L109-R112 PolarHBondContact O-N 3.1Å; L109-R112 VanDerWaalsContact O-N 3.08Å; L109-L113 WeakPolarHBondContact O-CB 3.32Å; L109-L113 VanDerWaalsContact O-CG 3.25Å; L109-L113 WeakPolarHBondContact O-CG 3.43Å; L109-L113 PolarHBondContact O-N 2.9Å; L109-L194 HydrophobicContact CB-CD1 3.84Å; L109-L194 HydrophobicContact CD1-CB 4.14Å; L109-L194 HydrophobicContact CD1-CD1 3.63Å; L109-L194 HydrophobicContact CG-CD1 4.4Å; L109-S225 WeakPolarHBondContact CD2-OG 3.12Å; L109-T229 HydrophobicContact CD1-CG2 3.54Å; L109-T229 HydrophobicContact CD2-CG2 3.18Å; L109-T229 HydrophobicContact CG-CG2 3.96Å; L109-M232 HydrophobicContact CD1-CE 4.35Å |
| 110 | V | 83.3 | Confident | 81.8 | Confident | 63 Ų | 63 | 62.3 Ų | 62.3 | 38% | 0.382 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -58.8 | -44.1 | 175.6 | 170.9 | 0 | 0 | 0 | 0 | 110.3 | M106 R112 L113 W114 L194 | M106-V110 WeakPolarHBondContact O-CB 3.38Å; M106-V110 VanDerWaalsContact O-CG2 3.28Å; M106-V110 WeakPolarHBondContact O-CG2 3.3Å; M106-V110 PolarHBondContact O-N 3.1Å; V110-R112 VanDerWaalsContact C-N 3.28Å; V110-R112 PolarHBondContact O-N 3.3Å; V110-L113 PolarHBondContact O-N 3.18Å; V110-W114 HydrophobicContact CG1-CE3 4.46Å; V110-W114 VanDerWaalsContact O-CB 3.27Å; V110-W114 WeakPolarHBondContact O-CB 3.38Å; V110-W114 PolarHBondContact O-N 3.01Å; V110-L194 HydrophobicContact CG2-CD2 4.47Å |
| 111 | T | 80.3 | Confident | 80 | Confident | 87 Ų | 87 | 73.7 Ų | 73.7 | 53% | 0.534 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -60.9 | -37.1 | 176.7 | -55.9 | 0 | 0 | 0 | 0 | 112.1 | I107 I108 L109 P115 | I107-T111 VanDerWaalsContact O-CB 3.29Å; I107-T111 WeakPolarHBondContact O-CB 3.04Å; I107-T111 PolarHBondContact O-N 3.38Å; I107-T111 PolarHBondContact O-OG1 3.41Å; I108-T111 WeakPolarHBondContact O-CB 3.47Å; I108-T111 PolarHBondContact O-N 2.96Å; L109-T111 VanDerWaalsContact C-N 3.29Å; L109-T111 PolarHBondContact O-N 2.99Å; T111-P115 WeakPolarHBondContact O-CD 3.5Å |
| 112 | R | 80.3 | Confident | 78 | Confident | 130 Ų | 130 | 82 Ų | 82 | 49% | 0.491 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -75.4 | -33.6 | 178.7 | -68.4 | -66.7 | -177.1 | -167.2 | 0.5 | 113.4 | I108 L109 V110 H116 | I108-R112 HydrophobicContact CG2-CG 4.42Å; I108-R112 VanDerWaalsContact O-CG 3.24Å; I108-R112 WeakPolarHBondContact O-CG 3.33Å; I108-R112 PolarHBondContact O-N 2.68Å; L109-R112 PolarHBondContact O-N 3.1Å; L109-R112 VanDerWaalsContact O-N 3.08Å; V110-R112 VanDerWaalsContact C-N 3.28Å; V110-R112 PolarHBondContact O-N 3.3Å; R112-H116 PolarHBondContact O-CD2 3.11Å |
| 113 | L | 82.6 | Confident | 75.9 | Confident | 8 Ų | 8 | 87.4 Ų | 87.4 | 4% | 0.042 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -83.3 | -28.7 | -179.8 | -66.1 | 172.7 | 0 | 0 | 0 | 112.6 | L109 V110 P115 H116 Y117 L194 L197 Q198 V201 | L109-L113 WeakPolarHBondContact O-CB 3.32Å; L109-L113 VanDerWaalsContact O-CG 3.25Å; L109-L113 WeakPolarHBondContact O-CG 3.43Å; L109-L113 PolarHBondContact O-N 2.9Å; V110-L113 PolarHBondContact O-N 3.18Å; L113-P115 VanDerWaalsContact C-CD 3.49Å; L113-H116 PolarHBondContact O-N 3.36Å; L113-Y117 HydrophobicContact CB-CD2 4.22Å; L113-Y117 HydrophobicContact CB-CE2 4.43Å; L113-Y117 HydrophobicContact CD2-CE2 4.18Å; L113-Y117 PolarHBondContact O-N 3.37Å; L113-L194 HydrophobicContact CD1-CD2 4.19Å; L113-L197 HydrophobicContact CD1-CB 3.82Å; L113-L197 HydrophobicContact CD1-CD1 4.39Å; L113-L197 HydrophobicContact CD2-CB 4.44Å; L113-Q198 HydrophobicContact CD2-CB 4.42Å; L113-V201 HydrophobicContact CD2-CB 4.29Å; L113-V201 HydrophobicContact CD2-CG2 3.72Å |
| 114 | W | 82.9 | Confident | 74.2 | Confident | 132 Ų | 132 | 91.2 Ų | 91.2 | 50% | 0.5 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -49.4 | -48.8 | -174.7 | -173 | -87.3 | 0 | 0 | 0 | 114.1 | V110 H116 Y117 C118 | V110-W114 HydrophobicContact CG1-CE3 4.46Å; V110-W114 VanDerWaalsContact O-CB 3.27Å; V110-W114 WeakPolarHBondContact O-CB 3.38Å; V110-W114 PolarHBondContact O-N 3.01Å; W114-H116 PolarHBondContact O-N 2.63Å; W114-H116 VanDerWaalsContact O-N 3.16Å; W114-Y117 PolarHBondContact O-N 3.11Å; W114-C118 HydrophobicContact CD2-CB 4.11Å; W114-C118 HydrophobicContact CG-CB 4.38Å; W114-C118 HydrophobicContact CZ2-CB 4.18Å; W114-C118 WeakPolarHBondContact O-CA 3.5Å; W114-C118 WeakPolarHBondContact O-CB 3.37Å; W114-C118 PolarHBondContact O-N 3.09Å |
| 115 | P | 81.2 | Confident | 72.2 | Confident | 90 Ų | 90 | 96.2 Ų | 96.2 | 58% | 0.584 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -66 | -19.7 | -177.8 | -20 | 34.3 | 0 | 0 | 0 | 114.4 | T111 L113 | T111-P115 WeakPolarHBondContact O-CD 3.5Å; L113-P115 VanDerWaalsContact C-CD 3.49Å |
| 116 | H | 81.3 | Confident | 70.3 | Confident | 80 Ų | 80 | 101.9 Ų | 101.9 | 37% | 0.37 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -88.4 | -33.3 | -177 | -63.4 | -76.5 | 0 | 0 | 0 | 112.7 | R112 L113 W114 V201 Q222 | R112-H116 PolarHBondContact O-CD2 3.11Å; L113-H116 PolarHBondContact O-N 3.36Å; W114-H116 PolarHBondContact O-N 2.63Å; W114-H116 VanDerWaalsContact O-N 3.16Å; H116-V201 HydrophobicContact CB-CG1 4.4Å; H116-V201 HydrophobicContact CB-CG2 4Å; H116-Q222 PolarHBondContact NE2-NE2 2.85Å; H116-Q222 VanDerWaalsContact NE2-NE2 3.15Å |
| 117 | Y | 82.2 | Confident | 69 | Low | 107 Ų | 107 | 101.2 Ų | 101.2 | 42% | 0.42 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -101.2 | -30.2 | -178.7 | -68.7 | -75.1 | 0 | 0 | 0 | 113.2 | L113 W114 L197 N200 V201 | L113-Y117 HydrophobicContact CB-CD2 4.22Å; L113-Y117 HydrophobicContact CB-CE2 4.43Å; L113-Y117 HydrophobicContact CD2-CE2 4.18Å; L113-Y117 PolarHBondContact O-N 3.37Å; W114-Y117 PolarHBondContact O-N 3.11Å; Y117-L197 HydrophobicContact CE1-CD2 4.39Å; Y117-L197 HydrophobicContact CE2-CB 4.35Å; Y117-L197 HydrophobicContact CE2-CD2 4.26Å; Y117-L197 PolarHBondContact OH-O 2.98Å; Y117-N200 PolarHBondContact OH-ND2 3.4Å; Y117-V201 HydrophobicContact CD2-CG2 4.37Å; Y117-V201 HydrophobicContact CE2-CG2 3.45Å; Y117-V201 VanDerWaalsContact CE2-CG2 3.45Å |
| 118 | C | 74.4 | Confident | 67.7 | Low | 45 Ų | 45 | 106.4 Ų | 106.4 | 30% | 0.304 | 51% | 0.512 | S | S | . | . | trans | -110.6 | 109.8 | 179.1 | -66.4 | 0 | 0 | 0 | 0 | 109.8 | W114 T120 | W114-C118 HydrophobicContact CD2-CB 4.11Å; W114-C118 HydrophobicContact CG-CB 4.38Å; W114-C118 HydrophobicContact CZ2-CB 4.18Å; W114-C118 WeakPolarHBondContact O-CA 3.5Å; W114-C118 WeakPolarHBondContact O-CB 3.37Å; W114-C118 PolarHBondContact O-N 3.09Å; C118-T120 PolarHBondContact O-N 2.6Å | ||
| 119 | R | 60.8 | Low | 66.6 | Low | 257 Ų | 257 | 111.3 Ų | 111.3 | 97% | 0.97 | 54% | 0.536 | S | S | * | . | trans | -81.1 | 47.6 | 179 | -157.1 | -179.2 | -152.9 | 159 | 4.6 | 111.8 | ||||
| 120 | T | 54.9 | Low | 65.8 | Low | 100 Ų | 100 | 117.1 Ų | 117.1 | 61% | 0.613 | 56% | 0.563 | S | S | * | * | trans | -112.2 | 131.4 | -178.9 | -4.2 | 0 | 0 | 0 | 0 | 110.1 | C118 | C118-T120 PolarHBondContact O-N 2.6Š| ||
| 121 | R | 51.4 | Low | 65 | Low | 241 Ų | 241 | 116.3 Ų | 116.3 | 91% | 0.909 | 56% | 0.563 | S | S | * | * | trans | -54.2 | 136.8 | -175.4 | -159.4 | 171.1 | -176 | 175.6 | -0.4 | 110.6 | V123 | R121-V123 PolarHBondContact O-N 3.13Š| ||
| 122 | Q | 50.8 | Low | 64.5 | Low | 173 Ų | 173 | 115.9 Ų | 115.9 | 81% | 0.808 | 56% | 0.557 | S | S | * | * | trans | -34 | 117.9 | 177.5 | -87.3 | 171.9 | -30.2 | 0 | 0 | 112.8 | E124 | Q122-E124 VanDerWaalsContact C-N 3.35Å; Q122-E124 PolarHBondContact O-N 3.31Å | ||
| 123 | V | 46.5 | Very low | 64 | Low | 126 Ų | 126 | 114.5 Ų | 114.5 | 76% | 0.764 | 56% | 0.558 | S | S | * | * | trans | -81.3 | 86.9 | 163.7 | -113.9 | 0 | 0 | 0 | 0 | 107.7 | R121 | R121-V123 PolarHBondContact O-N 3.13Š| ||
| 124 | E | 51.4 | Low | 63.6 | Low | 145 Ų | 145 | 116 Ų | 116 | 68% | 0.678 | 58% | 0.575 | S | S | * | * | trans | -70.3 | -177.2 | 161.4 | -77.4 | -108.8 | 115.3 | 0 | 0 | 109.8 | Q122 L126 | Q122-E124 VanDerWaalsContact C-N 3.35Å; Q122-E124 PolarHBondContact O-N 3.31Å; E124-L126 PolarHBondContact O-N 3.21Å | ||
| 125 | P | 46.1 | Very low | 63.2 | Low | 106 Ų | 106 | 110.3 Ų | 110.3 | 69% | 0.688 | 56% | 0.555 | S | S | * | * | S | Bend | -67.4 | 0.3 | -104.1 | 27.5 | -11.8 | 0 | 0 | 0 | 117 | G127 R128 | P125-G127 PolarHBondContact O-N 3.2Å; P125-R128 PolarHBondContact O-N 2.96Å | |
| 126 | L | 47.9 | Very low | 62.9 | Low | 119 Ų | 119 | 110.3 Ų | 110.3 | 62% | 0.623 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -59.3 | -30.7 | 174.2 | -170 | 63.4 | 0 | 0 | 0 | 111.3 | E124 R128 Q130 | E124-L126 PolarHBondContact O-N 3.21Å; L126-R128 VanDerWaalsContact C-N 3.33Å; L126-R128 PolarHBondContact O-N 3.15Å; L126-Q130 WeakPolarHBondContact O-CG 3.35Å; L126-Q130 PolarHBondContact O-N 2.61Å; L126-Q130 PolarHBondContact O-OE1 3.24Å |
| 127 | G | 59.6 | Low | 62.7 | Low | 29 Ų | 29 | 110 Ų | 110 | 30% | 0.299 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.4 | -24.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 115 | P125 A131 | P125-G127 PolarHBondContact O-N 3.2Å; G127-A131 WeakPolarHBondContact O-CB 3.48Å; G127-A131 PolarHBondContact O-N 3.26Å |
| 128 | R | 58.2 | Low | 62.7 | Low | 174 Ų | 174 | 105.9 Ų | 105.9 | 66% | 0.657 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -72.7 | -42.1 | -178.6 | -169.5 | 175.6 | -177.1 | 168.2 | 0.2 | 111.7 | I52 P125 L126 A131 L132 | I52-R128 HydrophobicContact CD1-CG 3.8Å; P125-R128 PolarHBondContact O-N 2.96Å; L126-R128 VanDerWaalsContact C-N 3.33Å; L126-R128 PolarHBondContact O-N 3.15Å; R128-A131 PolarHBondContact O-N 2.56Å; R128-L132 WeakPolarHBondContact O-CG 3.47Å; R128-L132 PolarHBondContact O-N 3.3Å |
| 129 | M | 59.9 | Low | 63 | Low | 126 Ų | 126 | 105.5 Ų | 105.5 | 62% | 0.621 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -70.8 | -39 | 175.8 | -168.9 | 144.9 | 80 | 0 | 0 | 111.2 | A131 L132 I133 | M129-A131 VanDerWaalsContact C-N 3.33Å; M129-A131 PolarHBondContact O-N 2.79Å; M129-L132 PolarHBondContact O-N 2.97Å; M129-I133 HydrophobicContact CG-CD1 4.01Å; M129-I133 WeakPolarHBondContact O-CB 3.15Å; M129-I133 VanDerWaalsContact O-CG1 3.27Å; M129-I133 WeakPolarHBondContact O-CG1 3.5Å; M129-I133 PolarHBondContact O-N 3.36Å |
| 130 | Q | 65.9 | Low | 63.7 | Low | 122 Ų | 122 | 96.8 Ų | 96.8 | 57% | 0.57 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.5 | -38.6 | 172.1 | -69.3 | 173.9 | -42.6 | 0 | 0 | 112.2 | L126 I133 G134 | L126-Q130 WeakPolarHBondContact O-CG 3.35Å; L126-Q130 PolarHBondContact O-N 2.61Å; L126-Q130 PolarHBondContact O-OE1 3.24Å; Q130-I133 PolarHBondContact O-N 3.38Å; Q130-G134 PolarHBondContact O-N 3.25Å |
| 131 | A | 66.5 | Low | 64.9 | Low | 45 Ų | 45 | 96 Ų | 96 | 37% | 0.372 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.3 | -37.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | G127 R128 M129 S135 | G127-A131 WeakPolarHBondContact O-CB 3.48Å; G127-A131 PolarHBondContact O-N 3.26Å; R128-A131 PolarHBondContact O-N 2.56Å; M129-A131 VanDerWaalsContact C-N 3.33Å; M129-A131 PolarHBondContact O-N 2.79Å; A131-S135 WeakPolarHBondContact O-CB 3.39Å; A131-S135 PolarHBondContact O-N 3.06Å |
| 132 | L | 68.9 | Low | 66.1 | Low | 79 Ų | 79 | 85 Ų | 85 | 41% | 0.414 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -63.2 | -49.6 | 172.4 | -76 | 167.3 | 0 | 0 | 0 | 111.2 | I52 R128 M129 S135 V136 | I52-L132 HydrophobicContact CD1-CD1 4.25Å; I52-L132 HydrophobicContact CD1-CD2 3.53Å; I52-L132 HydrophobicContact CD1-CG 3.62Å; I52-L132 HydrophobicContact CG1-CD2 3.93Å; I52-L132 HydrophobicContact CG2-CD2 3.83Å; R128-L132 WeakPolarHBondContact O-CG 3.47Å; R128-L132 PolarHBondContact O-N 3.3Å; M129-L132 PolarHBondContact O-N 2.97Å; L132-S135 WeakPolarHBondContact O-CB 3.33Å; L132-S135 PolarHBondContact O-N 3.08Å; L132-V136 WeakPolarHBondContact O-CG2 3.34Å; L132-V136 PolarHBondContact O-N 3.08Å |
| 133 | I | 70.7 | Confident | 67.5 | Low | 101 Ų | 101 | 80.3 Ų | 80.3 | 52% | 0.518 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62.8 | -47.8 | 178.9 | -66.6 | 165.6 | 0 | 0 | 0 | 110.1 | M129 Q130 S135 V136 V137 | M129-I133 HydrophobicContact CG-CD1 4.01Å; M129-I133 WeakPolarHBondContact O-CB 3.15Å; M129-I133 VanDerWaalsContact O-CG1 3.27Å; M129-I133 WeakPolarHBondContact O-CG1 3.5Å; M129-I133 PolarHBondContact O-N 3.36Å; Q130-I133 PolarHBondContact O-N 3.38Å; I133-S135 VanDerWaalsContact C-N 3.29Å; I133-S135 PolarHBondContact O-N 3.09Å; I133-V136 PolarHBondContact O-N 3.09Å; I133-V137 HydrophobicContact CG2-CG2 4.31Å; I133-V137 WeakPolarHBondContact O-CB 3.37Å; I133-V137 VanDerWaalsContact O-CG2 3.27Å; I133-V137 WeakPolarHBondContact O-CG2 2.9Å; I133-V137 PolarHBondContact O-N 3.31Å |
| 134 | G | 73.1 | Confident | 68.9 | Low | 38 Ų | 38 | 78.9 Ų | 78.9 | 39% | 0.392 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -60.5 | -38.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q130 V137 M138 | Q130-G134 PolarHBondContact O-N 3.25Å; G134-V137 PolarHBondContact O-N 3.49Å; G134-M138 VanDerWaalsContact O-CB 3.28Å; G134-M138 WeakPolarHBondContact O-CB 3.31Å; G134-M138 PolarHBondContact O-N 3.47Å |
| 135 | S | 74.7 | Confident | 70 | Confident | 13 Ų | 13 | 76.6 Ų | 76.6 | 9% | 0.091 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -60.9 | -52.3 | 171.7 | 170 | 0 | 0 | 0 | 0 | 111.3 | N56 A131 L132 I133 V137 M138 W139 | N56-S135 PolarHBondContact ND2-OG 2.94Å; A131-S135 WeakPolarHBondContact O-CB 3.39Å; A131-S135 PolarHBondContact O-N 3.06Å; L132-S135 WeakPolarHBondContact O-CB 3.33Å; L132-S135 PolarHBondContact O-N 3.08Å; I133-S135 VanDerWaalsContact C-N 3.29Å; I133-S135 PolarHBondContact O-N 3.09Å; S135-V137 VanDerWaalsContact C-N 3.29Å; S135-V137 PolarHBondContact O-N 2.94Å; S135-M138 PolarHBondContact O-N 3.32Å; S135-W139 WeakPolarHBondContact O-CB 3.31Å; S135-W139 PolarHBondContact O-N 3.21Å |
| 136 | V | 76.1 | Confident | 71.3 | Confident | 90 Ų | 90 | 72.5 Ų | 72.5 | 55% | 0.545 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -58.3 | -44.3 | 179 | 171.3 | 0 | 0 | 0 | 0 | 110.7 | L132 I133 W139 V140 | L132-V136 WeakPolarHBondContact O-CG2 3.34Å; L132-V136 PolarHBondContact O-N 3.08Å; I133-V136 PolarHBondContact O-N 3.09Å; V136-W139 PolarHBondContact O-N 3.09Å; V136-V140 HydrophobicContact CG1-CG2 4.33Å; V136-V140 WeakPolarHBondContact O-CB 3.44Å; V136-V140 VanDerWaalsContact O-CG2 3.24Å; V136-V140 WeakPolarHBondContact O-CG2 3.48Å; V136-V140 PolarHBondContact O-N 3.4Å |
| 137 | V | 77.4 | Confident | 72.5 | Confident | 75 Ų | 75 | 68 Ų | 68 | 46% | 0.455 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -61.2 | -47.3 | 177.3 | 170 | 0 | 0 | 0 | 0 | 111.1 | I133 G134 S135 W139 V140 I141 | I133-V137 HydrophobicContact CG2-CG2 4.31Å; I133-V137 WeakPolarHBondContact O-CB 3.37Å; I133-V137 VanDerWaalsContact O-CG2 3.27Å; I133-V137 WeakPolarHBondContact O-CG2 2.9Å; I133-V137 PolarHBondContact O-N 3.31Å; G134-V137 PolarHBondContact O-N 3.49Å; S135-V137 VanDerWaalsContact C-N 3.29Å; S135-V137 PolarHBondContact O-N 2.94Å; V137-W139 VanDerWaalsContact C-N 3.34Å; V137-W139 PolarHBondContact O-N 2.62Å; V137-V140 PolarHBondContact O-N 2.86Å; V137-I141 HydrophobicContact CG1-CD1 3.53Å; V137-I141 HydrophobicContact CG1-CG1 4.24Å; V137-I141 WeakPolarHBondContact O-CB 3.48Å; V137-I141 WeakPolarHBondContact O-CG1 3.37Å; V137-I141 PolarHBondContact O-N 2.91Å |
| 138 | M | 80.3 | Confident | 73 | Confident | 19 Ų | 19 | 69.9 Ų | 69.9 | 9% | 0.094 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -59.9 | -43.9 | 176.2 | 178.3 | -167.4 | 75.2 | 0 | 0 | 111.8 | L103 L104 I107 G134 S135 I141 V142 | L103-M138 HydrophobicContact CB-CG 4.26Å; L103-M138 HydrophobicContact CB-SD 3.56Å; L103-M138 VanDerWaalsContact CB-SD 3.56Å; L103-M138 HydrophobicContact CD1-CG 3.77Å; L103-M138 HydrophobicContact CD1-SD 4.21Å; L104-M138 HydrophobicContact CD1-CE 4.48Å; L104-M138 HydrophobicContact CD2-CE 3.44Å; L104-M138 VanDerWaalsContact CD2-CE 3.44Å; L104-M138 HydrophobicContact CD2-SD 4.43Å; L104-M138 HydrophobicContact CG-CE 3.74Å; I107-M138 HydrophobicContact CD1-SD 3.88Å; G134-M138 VanDerWaalsContact O-CB 3.28Å; G134-M138 WeakPolarHBondContact O-CB 3.31Å; G134-M138 PolarHBondContact O-N 3.47Å; S135-M138 PolarHBondContact O-N 3.32Å; M138-I141 PolarHBondContact O-N 3.3Å; M138-V142 WeakPolarHBondContact O-CG2 3.47Å; M138-V142 PolarHBondContact O-N 3.31Å |
| 139 | W | 81.1 | Confident | 73.6 | Confident | 37 Ų | 37 | 65.1 Ų | 65.1 | 14% | 0.14 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -59.2 | -49 | 176.1 | -89.4 | 95.7 | 0 | 0 | 0 | 111.5 | N56 F59 A60 M100 S135 V136 V137 V142 L143 | N56-W139 HydrophobicContact CB-CZ2 4.41Å; N56-W139 PolarHBondContact OD1-NE1 3.34Å; F59-W139 AromaticContact CD1-CH2 3.49Å; F59-W139 HydrophobicContact CD1-CH2 3.49Å; F59-W139 VanDerWaalsContact CD1-CH2 3.49Å; F59-W139 AromaticContact CD1-CZ2 3.78Å; F59-W139 HydrophobicContact CD1-CZ2 3.78Å; F59-W139 HydrophobicContact CD1-CZ3 4.31Å; F59-W139 AromaticContact CE1-CH2 3.89Å; F59-W139 HydrophobicContact CE1-CH2 3.89Å; F59-W139 HydrophobicContact CE1-CZ2 4.47Å; F59-W139 HydrophobicContact CE1-CZ3 4.27Å; A60-W139 HydrophobicContact CB-CH2 4.15Å; A60-W139 HydrophobicContact CB-CZ2 4.35Å; M100-W139 HydrophobicContact CE-CB 4.44Å; M100-W139 HydrophobicContact CE-CD2 3.98Å; M100-W139 HydrophobicContact CE-CE3 3.59Å; M100-W139 HydrophobicContact CE-CG 4.37Å; M100-W139 HydrophobicContact CE-CZ3 4.12Å; M100-W139 WeakPolarHBondContact CE-O 3.48Å; M100-W139 HydrophobicContact SD-CD2 4.47Å; S135-W139 WeakPolarHBondContact O-CB 3.31Å; S135-W139 PolarHBondContact O-N 3.21Å; V136-W139 PolarHBondContact O-N 3.09Å; V137-W139 VanDerWaalsContact C-N 3.34Å; V137-W139 PolarHBondContact O-N 2.62Å; W139-V142 PolarHBondContact O-N 3.37Å; W139-L143 HydrophobicContact CE3-CD1 3.71Å; W139-L143 HydrophobicContact CE3-CG 4.06Å; W139-L143 HydrophobicContact CZ3-CD1 4.24Å; W139-L143 WeakPolarHBondContact O-CB 3.3Å; W139-L143 VanDerWaalsContact O-CG 3.28Å; W139-L143 WeakPolarHBondContact O-CG 3.24Å; W139-L143 PolarHBondContact O-N 2.81Å |
| 140 | V | 77.2 | Confident | 74 | Confident | 75 Ų | 75 | 60 Ų | 60 | 46% | 0.455 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -62.8 | -46.2 | 179.1 | 170.2 | 0 | 0 | 0 | 0 | 111 | V136 V137 V142 I144 | V136-V140 HydrophobicContact CG1-CG2 4.33Å; V136-V140 WeakPolarHBondContact O-CB 3.44Å; V136-V140 VanDerWaalsContact O-CG2 3.24Å; V136-V140 WeakPolarHBondContact O-CG2 3.48Å; V136-V140 PolarHBondContact O-N 3.4Å; V137-V140 PolarHBondContact O-N 2.86Å; V140-V142 PolarHBondContact O-N 3.07Å; V140-I144 HydrophobicContact CG1-CD1 3.55Å; V140-I144 HydrophobicContact CG1-CG1 4.45Å; V140-I144 VanDerWaalsContact O-CB 3.25Å; V140-I144 WeakPolarHBondContact O-CB 3.17Å; V140-I144 WeakPolarHBondContact O-CG1 3.43Å; V140-I144 PolarHBondContact O-N 2.7Å |
| 141 | I | 79 | Confident | 74.2 | Confident | 82 Ų | 82 | 57.7 Ų | 57.7 | 42% | 0.421 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -56.8 | -53.1 | 178.9 | -75.3 | 172.4 | 0 | 0 | 0 | 110.1 | V137 M138 I144 L145 | V137-I141 HydrophobicContact CG1-CD1 3.53Å; V137-I141 HydrophobicContact CG1-CG1 4.24Å; V137-I141 WeakPolarHBondContact O-CB 3.48Å; V137-I141 WeakPolarHBondContact O-CG1 3.37Å; V137-I141 PolarHBondContact O-N 2.91Å; M138-I141 PolarHBondContact O-N 3.3Å; I141-I144 PolarHBondContact O-N 3.41Å; I141-L145 HydrophobicContact CB-CD1 4.41Å; I141-L145 HydrophobicContact CG2-CD1 3.44Å; I141-L145 VanDerWaalsContact CG2-CD1 3.44Å; I141-L145 WeakPolarHBondContact O-CB 3.36Å; I141-L145 WeakPolarHBondContact O-CD1 3.49Å; I141-L145 WeakPolarHBondContact O-CG 3.21Å; I141-L145 PolarHBondContact O-N 3.09Å |
| 142 | V | 77.6 | Confident | 74 | Confident | 10 Ų | 10 | 58.5 Ų | 58.5 | 6% | 0.061 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -76.1 | -37.8 | -173.7 | 175.8 | 0 | 0 | 0 | 0 | 112.2 | I96 M100 L103 M138 W139 V140 I144 I146 | I96-V142 HydrophobicContact CG2-CG1 4.42Å; M100-V142 HydrophobicContact CE-CB 3.39Å; M100-V142 HydrophobicContact CE-CG1 3.59Å; M100-V142 HydrophobicContact CE-CG2 4.4Å; M100-V142 HydrophobicContact CG-CB 4.24Å; M100-V142 HydrophobicContact CG-CG1 3.64Å; M100-V142 HydrophobicContact SD-CB 3.52Å; M100-V142 VanDerWaalsContact SD-CB 3.52Å; M100-V142 HydrophobicContact SD-CG1 3.63Å; M100-V142 HydrophobicContact SD-CG2 3.94Å; L103-V142 HydrophobicContact CD1-CG2 3.75Å; M138-V142 WeakPolarHBondContact O-CG2 3.47Å; M138-V142 PolarHBondContact O-N 3.31Å; W139-V142 PolarHBondContact O-N 3.37Å; V140-V142 PolarHBondContact O-N 3.07Å; V142-I144 PolarHBondContact O-N 3.28Å; V142-I146 HydrophobicContact CG1-CD1 3.68Å; V142-I146 HydrophobicContact CG1-CG1 4.14Å; V142-I146 WeakPolarHBondContact O-CB 3.34Å; V142-I146 PolarHBondContact O-N 3.21Å |
| 143 | L | 79.1 | Confident | 73.6 | Confident | 76 Ų | 76 | 57.9 Ų | 57.9 | 40% | 0.398 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -68.7 | -20.4 | 175.4 | -73.6 | -178.5 | 0 | 0 | 0 | 113.5 | I96 M100 W139 P147 | I96-L143 HydrophobicContact CD1-CD2 4.33Å; I96-L143 HydrophobicContact CG2-CD2 3.83Å; M100-L143 HydrophobicContact CE-CD2 4.11Å; M100-L143 HydrophobicContact CE-CG 3.71Å; W139-L143 HydrophobicContact CE3-CD1 3.71Å; W139-L143 HydrophobicContact CE3-CG 4.06Å; W139-L143 HydrophobicContact CZ3-CD1 4.24Å; W139-L143 WeakPolarHBondContact O-CB 3.3Å; W139-L143 VanDerWaalsContact O-CG 3.28Å; W139-L143 WeakPolarHBondContact O-CG 3.24Å; W139-L143 PolarHBondContact O-N 2.81Å; L143-P147 WeakPolarHBondContact O-CD 3.34Å; L143-P147 WeakPolarHBondContact O-CG 3.28Å |
| 144 | I | 75.3 | Confident | 73.1 | Confident | 96 Ų | 96 | 54.7 Ų | 54.7 | 49% | 0.492 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -94.2 | -54.2 | 175 | -65.3 | 175.4 | 0 | 0 | 0 | 109.9 | V140 I141 V142 I146 C148 | V140-I144 HydrophobicContact CG1-CD1 3.55Å; V140-I144 HydrophobicContact CG1-CG1 4.45Å; V140-I144 VanDerWaalsContact O-CB 3.25Å; V140-I144 WeakPolarHBondContact O-CB 3.17Å; V140-I144 WeakPolarHBondContact O-CG1 3.43Å; V140-I144 PolarHBondContact O-N 2.7Å; I141-I144 PolarHBondContact O-N 3.41Å; V142-I144 PolarHBondContact O-N 3.28Å; I144-I146 PolarHBondContact O-N 2.8Å; I144-C148 WeakPolarHBondContact O-CB 3.37Å; I144-C148 PolarHBondContact O-N 3.49Å; I144-C148 PolarHBondContact O-SG 3.01Å |
| 145 | L | 74.9 | Confident | 72.2 | Confident | 96 Ų | 96 | 54.7 Ų | 54.7 | 50% | 0.503 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -61 | -43.5 | -173 | -79.7 | 157.9 | 0 | 0 | 0 | 112.6 | I141 C148 I149 | I141-L145 HydrophobicContact CB-CD1 4.41Å; I141-L145 HydrophobicContact CG2-CD1 3.44Å; I141-L145 VanDerWaalsContact CG2-CD1 3.44Å; I141-L145 WeakPolarHBondContact O-CB 3.36Å; I141-L145 WeakPolarHBondContact O-CD1 3.49Å; I141-L145 WeakPolarHBondContact O-CG 3.21Å; I141-L145 PolarHBondContact O-N 3.09Å; L145-C148 PolarHBondContact O-N 3.08Å; L145-I149 WeakPolarHBondContact O-CB 3.32Å; L145-I149 WeakPolarHBondContact O-CD1 3.17Å; L145-I149 WeakPolarHBondContact O-CG1 3.38Å; L145-I149 PolarHBondContact O-N 3.01Å |
| 146 | I | 73.6 | Confident | 71.1 | Confident | 21 Ų | 21 | 62.2 Ų | 62.2 | 11% | 0.108 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -71.4 | -49.8 | -174.2 | -62.6 | -167.4 | 0 | 0 | 0 | 111.8 | H95 I96 Y99 V142 I144 C148 I149 I150 | H95-I146 HydrophobicContact CB-CG2 3.87Å; I96-I146 HydrophobicContact CG1-CB 3.83Å; I96-I146 HydrophobicContact CG1-CD1 4.45Å; I96-I146 HydrophobicContact CG1-CG2 3.64Å; Y99-I146 HydrophobicContact CD2-CD1 3.37Å; Y99-I146 HydrophobicContact CE2-CD1 4.2Å; Y99-I146 HydrophobicContact CG-CD1 4.06Å; V142-I146 HydrophobicContact CG1-CD1 3.68Å; V142-I146 HydrophobicContact CG1-CG1 4.14Å; V142-I146 WeakPolarHBondContact O-CB 3.34Å; V142-I146 PolarHBondContact O-N 3.21Å; I144-I146 PolarHBondContact O-N 2.8Å; I146-C148 VanDerWaalsContact C-N 3.33Å; I146-C148 PolarHBondContact O-N 3.35Å; I146-I149 PolarHBondContact O-N 3.48Å; I146-I150 HydrophobicContact CG2-CD1 3.76Å; I146-I150 HydrophobicContact CG2-CG1 4.47Å; I146-I150 WeakPolarHBondContact O-CB 3.14Å; I146-I150 WeakPolarHBondContact O-CG1 3.32Å; I146-I150 PolarHBondContact O-N 2.95Å |
| 147 | P | 73.4 | Confident | 69.8 | Low | 25 Ų | 25 | 60.5 Ų | 60.5 | 16% | 0.162 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -57 | -43.6 | 168.7 | -31.5 | 41.2 | 0 | 0 | 0 | 112.8 | I96 L143 I149 I150 F151 | I96-P147 HydrophobicContact CD1-CG 3.74Å; L143-P147 WeakPolarHBondContact O-CD 3.34Å; L143-P147 WeakPolarHBondContact O-CG 3.28Å; P147-I149 VanDerWaalsContact C-N 3.32Å; P147-I149 PolarHBondContact O-N 3.4Å; P147-I150 PolarHBondContact O-N 3.44Å; P147-F151 HydrophobicContact CB-CD2 4.14Å; P147-F151 HydrophobicContact CB-CE2 4.18Å; P147-F151 VanDerWaalsContact O-CB 3.25Å; P147-F151 WeakPolarHBondContact O-CB 3.37Å; P147-F151 WeakPolarHBondContact O-CD2 3.18Å; P147-F151 PolarHBondContact O-N 2.86Å |
| 148 | C | 70.6 | Confident | 68.2 | Low | 67 Ų | 67 | 63.1 Ų | 63.1 | 45% | 0.453 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -59.1 | -43.8 | 178.3 | -75.6 | 0 | 0 | 0 | 0 | 112 | I144 L145 I146 S152 | I144-C148 WeakPolarHBondContact O-CB 3.37Å; I144-C148 PolarHBondContact O-N 3.49Å; I144-C148 PolarHBondContact O-SG 3.01Å; L145-C148 PolarHBondContact O-N 3.08Å; I146-C148 VanDerWaalsContact C-N 3.33Å; I146-C148 PolarHBondContact O-N 3.35Å; C148-S152 WeakPolarHBondContact O-CB 3.34Å; C148-S152 PolarHBondContact O-N 2.83Å; C148-S152 PolarHBondContact O-OG 3.26Å |
| 149 | I | 69.5 | Low | 66.7 | Low | 75 Ų | 75 | 70 Ų | 70 | 39% | 0.385 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -61.4 | -54.2 | 175.2 | -70.9 | 165.9 | 0 | 0 | 0 | 109.3 | L145 I146 P147 F151 S152 F153 | L145-I149 WeakPolarHBondContact O-CB 3.32Å; L145-I149 WeakPolarHBondContact O-CD1 3.17Å; L145-I149 WeakPolarHBondContact O-CG1 3.38Å; L145-I149 PolarHBondContact O-N 3.01Å; I146-I149 PolarHBondContact O-N 3.48Å; P147-I149 VanDerWaalsContact C-N 3.32Å; P147-I149 PolarHBondContact O-N 3.4Å; I149-F151 PolarHBondContact O-N 3.32Å; I149-S152 PolarHBondContact O-N 3.42Å; I149-F153 HydrophobicContact CG2-CD2 3.77Å; I149-F153 HydrophobicContact CG2-CE2 4.03Å; I149-F153 WeakPolarHBondContact O-CD2 3.33Å; I149-F153 PolarHBondContact O-N 3.42Å |
| 150 | I | 68.8 | Low | 65.3 | Low | 19 Ų | 19 | 71.5 Ų | 71.5 | 10% | 0.097 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -61.8 | -50.2 | -175.7 | -69.2 | 173.7 | 0 | 0 | 0 | 110.5 | A92 H95 I146 P147 S152 F153 Y154 | A92-I150 HydrophobicContact CB-CB 4.44Å; A92-I150 HydrophobicContact CB-CD1 3.59Å; A92-I150 HydrophobicContact CB-CG2 4.38Å; H95-I150 HydrophobicContact CB-CD1 4.3Å; I146-I150 HydrophobicContact CG2-CD1 3.76Å; I146-I150 HydrophobicContact CG2-CG1 4.47Å; I146-I150 WeakPolarHBondContact O-CB 3.14Å; I146-I150 WeakPolarHBondContact O-CG1 3.32Å; I146-I150 PolarHBondContact O-N 2.95Å; P147-I150 PolarHBondContact O-N 3.44Å; I150-S152 VanDerWaalsContact C-N 3.26Å; I150-S152 PolarHBondContact O-N 2.86Å; I150-F153 PolarHBondContact O-N 2.81Å; I150-Y154 HydrophobicContact CG2-CD2 4.44Å; I150-Y154 WeakPolarHBondContact O-CA 3.31Å; I150-Y154 WeakPolarHBondContact O-CB 3.39Å; I150-Y154 PolarHBondContact O-N 3.39Å |
| 151 | F | 69.8 | Low | 64.1 | Low | 72 Ų | 72 | 75.6 Ų | 75.6 | 32% | 0.316 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -65.8 | -25.9 | 179.5 | -75.4 | -117.1 | 0 | 0 | 0 | 113.2 | E85 K88 P147 I149 | E85-F151 WeakPolarHBondContact OE2-CE1 3.11Å; K88-F151 HydrophobicContact CB-CD2 4.35Å; K88-F151 HydrophobicContact CB-CE1 3.99Å; K88-F151 HydrophobicContact CB-CE2 3.83Å; K88-F151 HydrophobicContact CB-CZ 3.62Å; K88-F151 HydrophobicContact CD-CD1 3.78Å; K88-F151 HydrophobicContact CD-CE1 3.75Å; K88-F151 HydrophobicContact CD-CG 4.29Å; K88-F151 HydrophobicContact CD-CZ 4.26Å; P147-F151 HydrophobicContact CB-CD2 4.14Å; P147-F151 HydrophobicContact CB-CE2 4.18Å; P147-F151 VanDerWaalsContact O-CB 3.25Å; P147-F151 WeakPolarHBondContact O-CB 3.37Å; P147-F151 WeakPolarHBondContact O-CD2 3.18Å; P147-F151 PolarHBondContact O-N 2.86Å; I149-F151 PolarHBondContact O-N 3.32Å |
| 152 | S | 62.7 | Low | 62.8 | Low | 63 Ų | 63 | 79.1 Ų | 79.1 | 44% | 0.441 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -80.6 | -24.9 | 176.9 | -62.4 | 0 | 0 | 0 | 0 | 113.8 | C148 I149 I150 K156 | C148-S152 WeakPolarHBondContact O-CB 3.34Å; C148-S152 PolarHBondContact O-N 2.83Å; C148-S152 PolarHBondContact O-OG 3.26Å; I149-S152 PolarHBondContact O-N 3.42Å; I150-S152 VanDerWaalsContact C-N 3.26Å; I150-S152 PolarHBondContact O-N 2.86Å; S152-K156 WeakPolarHBondContact O-CE 3.35Å; S152-K156 PolarHBondContact O-NZ 3.47Å |
| 153 | F | 61.5 | Low | 62.1 | Low | 65 Ų | 65 | 80.9 Ų | 80.9 | 29% | 0.285 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -104.5 | -21.7 | 179.5 | -67 | -68.9 | 0 | 0 | 0 | 112.9 | I149 I150 S172 A176 | I149-F153 HydrophobicContact CG2-CD2 3.77Å; I149-F153 HydrophobicContact CG2-CE2 4.03Å; I149-F153 WeakPolarHBondContact O-CD2 3.33Å; I149-F153 PolarHBondContact O-N 3.42Å; I150-F153 PolarHBondContact O-N 2.81Å; F153-S172 WeakPolarHBondContact O-CB 3.46Å; F153-A176 HydrophobicContact CE2-CB 4.24Å; F153-A176 HydrophobicContact CZ-CB 4.15Å |
| 154 | Y | 60 | Low | 61.5 | Low | 34 Ų | 34 | 79.9 Ų | 79.9 | 13% | 0.133 | 43% | 0.425 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | 130.9 | -178.2 | -165.1 | -82.3 | 0 | 0 | 0 | 112.1 | C87 K88 I150 F169 | C87-Y154 PolarHBondContact SG-OH 3.04Å; K88-Y154 HydrophobicContact CD-CD1 3.99Å; K88-Y154 HydrophobicContact CG-CD1 3.33Å; K88-Y154 HydrophobicContact CG-CE1 3.59Å; K88-Y154 HydrophobicContact CG-CG 3.98Å; I150-Y154 HydrophobicContact CG2-CD2 4.44Å; I150-Y154 WeakPolarHBondContact O-CA 3.31Å; I150-Y154 WeakPolarHBondContact O-CB 3.39Å; I150-Y154 PolarHBondContact O-N 3.39Å; Y154-F169 HydrophobicContact CD2-CD1 4.47Å; Y154-F169 HydrophobicContact CD2-CE1 4.22Å; Y154-F169 HydrophobicContact CE2-CE1 4.26Å |
| 155 | G | 53.7 | Low | 61.4 | Low | 39 Ų | 39 | 79.8 Ų | 79.8 | 40% | 0.402 | 42% | 0.422 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 75.6 | 25.8 | 167.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | S157 D160 | G155-S157 PolarHBondContact O-N 3.23Å; G155-D160 WeakPolarHBondContact CA-OD2 3.14Å |
| 156 | K | 50.8 | Low | 61.4 | Low | 171 Ų | 171 | 75.2 Ų | 75.2 | 74% | 0.743 | 40% | 0.398 | S | S | * | . | trans | -76.4 | -4.5 | 173.7 | -84 | -177.5 | 173.1 | 159.6 | 0 | 114.1 | S152 | S152-K156 WeakPolarHBondContact O-CE 3.35Å; S152-K156 PolarHBondContact O-NZ 3.47Å | ||
| 157 | S | 48.9 | Very low | 61.3 | Low | 53 Ų | 53 | 74.5 Ų | 74.5 | 37% | 0.371 | 39% | 0.394 | S | S | . | . | S | Bend | trans | -86 | 125.9 | 171.2 | -171.1 | 0 | 0 | 0 | 0 | 109.5 | G155 Q159 D160 | G155-S157 PolarHBondContact O-N 3.23Å; S157-Q159 PolarHBondContact O-N 3Å; S157-Q159 WeakPolarHBondContact OG-CB 3.12Å; S157-D160 PolarHBondContact O-N 3.31Å; S157-D160 VanDerWaalsContact O-N 3.07Å |
| 158 | D | 44.5 | Very low | 61.1 | Low | 131 Ų | 131 | 77.8 Ų | 77.8 | 70% | 0.701 | 41% | 0.407 | S | S | * | . | G | 310 helix | trans | -59.2 | -11 | 174.8 | -110.3 | -29.7 | 0 | 0 | 0 | 112.8 | D160 K161 | D158-D160 VanDerWaalsContact C-N 3.34Å; D158-K161 IonicContact OD1-NZ 2.74Å; D158-K161 PolarHBondContact OD1-NZ 2.98Å |
| 159 | Q | 48.1 | Very low | 60.6 | Low | 163 Ų | 163 | 75.2 Ų | 75.2 | 76% | 0.762 | 39% | 0.388 | S | S | * | . | G | 310 helix | trans | -74.7 | -17.2 | 176.3 | -141.8 | 170.8 | 6.4 | 0 | 0 | 113.7 | S157 | S157-Q159 PolarHBondContact O-N 3Å; S157-Q159 WeakPolarHBondContact OG-CB 3.12Å |
| 160 | D | 52.8 | Low | 59.8 | Low | 69 Ų | 69 | 72.4 Ų | 72.4 | 37% | 0.369 | 38% | 0.377 | S | S | . | . | G | 310 helix | trans | -85.5 | -10.4 | -172.3 | -79.1 | -33 | 0 | 0 | 0 | 115.2 | G155 S157 D158 N162 S163 | G155-D160 WeakPolarHBondContact CA-OD2 3.14Å; S157-D160 PolarHBondContact O-N 3.31Å; S157-D160 VanDerWaalsContact O-N 3.07Å; D158-D160 VanDerWaalsContact C-N 3.34Å; D160-N162 PolarHBondContact O-N 3.21Å; D160-S163 PolarHBondContact O-N 3.15Å |
| 161 | K | 51.2 | Low | 59.1 | Low | 160 Ų | 160 | 79.6 Ų | 79.6 | 70% | 0.696 | 41% | 0.41 | S | S | * | . | G | 310 helix | trans | -65.9 | -22.3 | -178.2 | -71.3 | 173.1 | -177.7 | 150.3 | 0 | 113.4 | D158 | D158-K161 IonicContact OD1-NZ 2.74Å; D158-K161 PolarHBondContact OD1-NZ 2.98Å |
| 162 | N | 52.6 | Low | 58.3 | Low | 157 Ų | 157 | 77.6 Ų | 77.6 | 84% | 0.84 | 41% | 0.405 | S | S | * | . | G | 310 helix | trans | -120.6 | 12.3 | 176.3 | -78.5 | -13.2 | 0 | 0 | 0 | 113 | D160 T164 | D160-N162 PolarHBondContact O-N 3.21Å; N162-T164 PolarHBondContact O-N 3.4Å |
| 163 | S | 61.5 | Low | 57.8 | Low | 47 Ų | 47 | 75.7 Ų | 75.7 | 33% | 0.329 | 39% | 0.389 | S | S | . | . | trans | -74.2 | 124.2 | 178.9 | -174.6 | 0 | 0 | 0 | 0 | 110.2 | D160 H165 | D160-S163 PolarHBondContact O-N 3.15Å; S163-H165 PolarHBondContact OG-N 3.02Å | ||
| 164 | T | 67.2 | Low | 57.6 | Low | 54 Ų | 54 | 76.8 Ų | 76.8 | 33% | 0.331 | 40% | 0.401 | S | S | . | . | trans | -80.3 | -1.5 | 170.2 | 50 | 0 | 0 | 0 | 0 | 112 | W80 N162 | W80-T164 WeakPolarHBondContact CB-O 3.14Å; W80-T164 PolarHBondContact N-O 3.26Å; N162-T164 PolarHBondContact O-N 3.4Å | ||
| 165 | H | 72.4 | Confident | 57.7 | Low | 94 Ų | 94 | 79.7 Ų | 79.7 | 44% | 0.435 | 43% | 0.426 | S | S | . | . | trans | -94.7 | 134.1 | -179.2 | -65.5 | -92.8 | 0 | 0 | 0 | 110.8 | S163 | S163-H165 PolarHBondContact OG-N 3.02Š| ||
| 166 | C | 76.6 | Confident | 58.4 | Low | 1 Ų | 1 | 78.5 Ų | 78.5 | 1% | 0.007 | 41% | 0.413 | C | S | . | . | trans | -125.9 | 154.5 | 179 | -176 | 0 | 0 | 0 | 0 | 108.3 | Y74 W80 C87 | Y74-C166 HydrophobicContact CD2-CB 4.13Å; Y74-C166 WeakPolarHBondContact CE1-O 3.44Å; Y74-C166 HydrophobicContact CE2-CB 4.05Å; Y74-C166 PolarHBondContact OH-O 3.32Å; W80-C166 HydrophobicContact CB-CB 3.84Å; W80-C166 HydrophobicContact CD2-CB 4Å; W80-C166 HydrophobicContact CE3-CB 4.08Å; W80-C166 HydrophobicContact CG-CB 3.9Å; C87-C166 HydrophobicContact CB-CB 4.12Å; C87-C166 WeakPolarHBondContact CB-SG 3.36Å; C87-C166 VanDerWaalsContact SG-CA 3.57Å; C87-C166 WeakPolarHBondContact SG-CB 3.47Å; C87-C166 CovalentContact SG-SG 2.03Å; C87-C166 PolarHBondContact SG-SG 3.27Å | ||
| 167 | F | 71.1 | Confident | 59.6 | Low | 6 Ų | 6 | 74.4 Ų | 74.4 | 3% | 0.026 | 40% | 0.395 | C | S | . | . | trans | 71.3 | 21.8 | 179.2 | -42.2 | -62.1 | 0 | 0 | 0 | 116.9 | R71 Y74 W80 V90 F169 | R71-F167 HydrophobicContact CG-CE1 4.42Å; R71-F167 HydrophobicContact CG-CE2 4.19Å; R71-F167 HydrophobicContact CG-CZ 3.81Å; Y74-F167 AromaticContact CD1-CD2 3.45Å; Y74-F167 HydrophobicContact CD1-CD2 3.45Å; Y74-F167 VanDerWaalsContact CD1-CD2 3.45Å; Y74-F167 AromaticContact CD1-CE2 3.66Å; Y74-F167 HydrophobicContact CD1-CE2 3.66Å; Y74-F167 AromaticContact CE1-CD2 3.76Å; Y74-F167 HydrophobicContact CE1-CD2 3.76Å; Y74-F167 HydrophobicContact CE1-CE2 4.4Å; Y74-F167 HydrophobicContact CG-CD2 4.03Å; Y74-F167 AromaticContact CG-CE2 3.84Å; Y74-F167 HydrophobicContact CG-CE2 3.84Å; W80-F167 HydrophobicContact CZ3-CE2 4.39Å; W80-F167 HydrophobicContact CZ3-CZ 4.16Å; V90-F167 HydrophobicContact CB-CE1 4.3Å; V90-F167 HydrophobicContact CB-CZ 4.32Å; V90-F167 HydrophobicContact CG1-CE1 3.9Å; V90-F167 HydrophobicContact CG1-CZ 3.69Å; F167-F169 HydrophobicContact CB-CE2 3.86Å; F167-F169 HydrophobicContact CD1-CE2 4.28Å; F167-F169 HydrophobicContact CD1-CZ 4.43Å; F167-F169 WeakPolarHBondContact O-CD2 3.25Å | ||
| 168 | H | 67.9 | Low | 61 | Low | 94 Ų | 94 | 78.3 Ų | 78.3 | 44% | 0.435 | 41% | 0.408 | S | S | . | . | trans | -89.9 | 112.6 | 165.7 | -75.7 | -82.9 | 0 | 0 | 0 | 109.8 | E253 | H168-E253 WeakPolarHBondContact CA-OE1 3.17Å; H168-E253 IonicContact CE1-OE2 3.76Å; H168-E253 IonicContact ND1-OE1 3.81Å; H168-E253 IonicContact ND1-OE2 2.79Å; H168-E253 PolarHBondContact ND1-OE2 3.31Å; H168-E253 VanDerWaalsContact ND1-OE2 3.09Å | ||
| 169 | F | 61.9 | Low | 62.6 | Low | 12 Ų | 12 | 77.2 Ų | 77.2 | 5% | 0.053 | 40% | 0.401 | C | S | . | . | trans | -115 | -12.8 | -171.2 | -67.1 | -86.3 | 0 | 0 | 0 | 113.6 | S91 Y154 F167 E171 S172 M173 E253 | S91-F169 WeakPolarHBondContact OG-CE1 3.14Å; S91-F169 WeakPolarHBondContact OG-CZ 3.3Å; Y154-F169 HydrophobicContact CD2-CD1 4.47Å; Y154-F169 HydrophobicContact CD2-CE1 4.22Å; Y154-F169 HydrophobicContact CE2-CE1 4.26Å; F167-F169 HydrophobicContact CB-CE2 3.86Å; F167-F169 HydrophobicContact CD1-CE2 4.28Å; F167-F169 HydrophobicContact CD1-CZ 4.43Å; F167-F169 WeakPolarHBondContact O-CD2 3.25Å; F169-E171 PolarHBondContact O-N 3.08Å; F169-S172 PolarHBondContact O-N 3.47Å; F169-S172 PolarHBondContact O-OG 3.45Å; F169-M173 HydrophobicContact CB-SD 3.99Å; F169-M173 PolarHBondContact O-N 2.94Å; F169-E253 PolarHBondContact N-OE1 2.88Å | ||
| 170 | A | 52.7 | Low | 64.2 | Low | 17 Ų | 17 | 70.2 Ų | 70.2 | 14% | 0.14 | 37% | 0.369 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -54.1 | -45.7 | -168.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | Y246 P250 E253 | A170-Y246 WeakPolarHBondContact CB-OH 3.41Å; A170-P250 HydrophobicContact CB-CB 4.18Å; A170-E253 PolarHBondContact N-OE1 3.35Å |
| 171 | E | 52.1 | Low | 65.8 | Low | 169 Ų | 169 | 70.4 Ų | 70.4 | 79% | 0.79 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -37.4 | -175.2 | -71 | -167.9 | 153.8 | 0 | 0 | 113.2 | F169 M173 T174 | F169-E171 PolarHBondContact O-N 3.08Å; E171-M173 VanDerWaalsContact C-N 3.31Å; E171-M173 PolarHBondContact O-N 3.28Å; E171-T174 PolarHBondContact O-OG1 3.29Å |
| 172 | S | 54 | Low | 67.5 | Low | 30 Ų | 30 | 68 Ų | 68 | 21% | 0.21 | 36% | 0.359 | C | S | . | . | G | 310 helix | trans | -69.8 | -25.5 | -177.3 | 71.2 | 0 | 0 | 0 | 0 | 114.1 | F153 F169 T174 | F153-S172 WeakPolarHBondContact O-CB 3.46Å; F169-S172 PolarHBondContact O-N 3.47Å; F169-S172 PolarHBondContact O-OG 3.45Å; S172-T174 PolarHBondContact O-N 3.36Å |
| 173 | M | 53.2 | Low | 69.1 | Low | 23 Ų | 23 | 63.4 Ų | 63.4 | 11% | 0.113 | 33% | 0.333 | C | S | . | . | G | 310 helix | trans | -80.9 | -12.9 | -172.5 | -99.3 | 160.9 | 56.5 | 0 | 0 | 114.5 | F169 E171 S175 A176 Y246 | F169-M173 HydrophobicContact CB-SD 3.99Å; F169-M173 PolarHBondContact O-N 2.94Å; E171-M173 VanDerWaalsContact C-N 3.31Å; E171-M173 PolarHBondContact O-N 3.28Å; M173-S175 VanDerWaalsContact C-N 3.27Å; M173-S175 PolarHBondContact O-N 2.93Å; M173-A176 PolarHBondContact O-N 3.18Å; M173-Y246 HydrophobicContact CE-CD1 4Å; M173-Y246 HydrophobicContact CE-CE1 3.64Å |
| 174 | T | 57 | Low | 70.5 | Confident | 89 Ų | 89 | 61.1 Ų | 61.1 | 55% | 0.546 | 32% | 0.318 | S | S | . | . | G | 310 helix | trans | -63 | -34 | 175.4 | 54 | 0 | 0 | 0 | 0 | 112.4 | E171 S172 A176 | E171-T174 PolarHBondContact O-OG1 3.29Å; S172-T174 PolarHBondContact O-N 3.36Å; T174-A176 VanDerWaalsContact C-N 3.29Å; T174-A176 PolarHBondContact O-N 3.47Å |
| 175 | S | 61 | Low | 71.5 | Confident | 94 Ų | 94 | 61.6 Ų | 61.6 | 66% | 0.657 | 32% | 0.321 | S | S | * | . | G | 310 helix | trans | -73.6 | -15.3 | -177.4 | -65.7 | 0 | 0 | 0 | 0 | 114.3 | M173 | M173-S175 VanDerWaalsContact C-N 3.27Å; M173-S175 PolarHBondContact O-N 2.93Å |
| 176 | A | 69.5 | Low | 72.4 | Confident | 14 Ų | 14 | 61.7 Ų | 61.7 | 12% | 0.116 | 32% | 0.324 | C | S | . | . | G | 310 helix | trans | -122.5 | 30.6 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | F153 M173 T174 E178 L179 N180 | F153-A176 HydrophobicContact CE2-CB 4.24Å; F153-A176 HydrophobicContact CZ-CB 4.15Å; M173-A176 PolarHBondContact O-N 3.18Å; T174-A176 VanDerWaalsContact C-N 3.29Å; T174-A176 PolarHBondContact O-N 3.47Å; A176-E178 PolarHBondContact O-N 2.92Å; A176-L179 PolarHBondContact O-N 3.28Å; A176-N180 PolarHBondContact O-N 3.4Å; A176-N180 VanDerWaalsContact O-N 3.09Å; A176-N180 PolarHBondContact O-ND2 3.24Å |
| 177 | K | 75.1 | Confident | 73.1 | Confident | 86 Ų | 86 | 61.7 Ų | 61.7 | 37% | 0.374 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -50.1 | -52.6 | -178.1 | 179.6 | 159.8 | -166.4 | 174.8 | 0 | 112.6 | L179 N180 Y181 I247 | K177-L179 PolarHBondContact O-N 3.45Å; K177-N180 WeakPolarHBondContact O-CB 3.41Å; K177-N180 PolarHBondContact O-N 2.73Å; K177-N180 VanDerWaalsContact O-N 3.13Å; K177-Y181 HydrophobicContact CD-CE2 4.14Å; K177-Y181 VanDerWaalsContact CE-CE2 3.42Å; K177-Y181 HydrophobicContact CG-CD2 3.75Å; K177-Y181 HydrophobicContact CG-CE2 3.58Å; K177-Y181 VanDerWaalsContact O-CD2 3.27Å; K177-Y181 WeakPolarHBondContact O-CD2 3.13Å; K177-Y181 PolarHBondContact O-N 3.43Å; K177-I247 HydrophobicContact CB-CG2 3.91Å; K177-I247 HydrophobicContact CD-CG2 3.61Å; K177-I247 HydrophobicContact CG-CB 4.48Å; K177-I247 HydrophobicContact CG-CG2 3.48Å; K177-I247 VanDerWaalsContact CG-CG2 3.48Å; K177-I247 PolarHBondContact NZ-O 3.21Å |
| 178 | E | 79.4 | Confident | 74.1 | Confident | 135 Ų | 135 | 62.9 Ų | 62.9 | 63% | 0.631 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -59.6 | -45.2 | -177.6 | -59.5 | -52.1 | 137.3 | 0 | 0 | 112.9 | A176 N180 Y181 I182 | A176-E178 PolarHBondContact O-N 2.92Å; E178-N180 VanDerWaalsContact C-N 3.3Å; E178-N180 PolarHBondContact O-N 3.49Å; E178-Y181 PolarHBondContact O-N 3.46Å; E178-I182 VanDerWaalsContact O-CG1 3.31Å; E178-I182 WeakPolarHBondContact O-CG1 3.29Å; E178-I182 PolarHBondContact O-N 3.03Å |
| 179 | L | 78.1 | Confident | 75.3 | Confident | 107 Ų | 107 | 62.2 Ų | 62.2 | 56% | 0.56 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -62.8 | -39.1 | 177.3 | -68.9 | 175.5 | 0 | 0 | 0 | 111.5 | A176 K177 L183 | A176-L179 PolarHBondContact O-N 3.28Å; K177-L179 PolarHBondContact O-N 3.45Å; L179-L183 WeakPolarHBondContact O-CB 3.41Å; L179-L183 PolarHBondContact O-N 3.12Å |
| 180 | N | 81.8 | Confident | 76.6 | Confident | 16 Ų | 16 | 62.9 Ų | 62.9 | 9% | 0.086 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -67 | -37.8 | 178.1 | -72.4 | -42 | 0 | 0 | 0 | 112.7 | A176 K177 E178 S184 R243 I247 | A176-N180 PolarHBondContact O-N 3.4Å; A176-N180 VanDerWaalsContact O-N 3.09Å; A176-N180 PolarHBondContact O-ND2 3.24Å; K177-N180 WeakPolarHBondContact O-CB 3.41Å; K177-N180 PolarHBondContact O-N 2.73Å; K177-N180 VanDerWaalsContact O-N 3.13Å; E178-N180 VanDerWaalsContact C-N 3.3Å; E178-N180 PolarHBondContact O-N 3.49Å; N180-S184 VanDerWaalsContact O-CB 3.24Å; N180-S184 WeakPolarHBondContact O-CB 3.47Å; N180-S184 PolarHBondContact O-N 3.28Å; N180-S184 PolarHBondContact O-OG 3.34Å; N180-R243 VanDerWaalsContact CG-NH2 3.35Å; N180-R243 PolarHBondContact OD1-NH1 3.34Å; N180-R243 PolarHBondContact OD1-NH2 2.91Å; N180-I247 HydrophobicContact CB-CD1 3.77Å |
| 181 | Y | 85.3 | Confident | 78.5 | Confident | 73 Ų | 73 | 62.1 Ų | 62.1 | 29% | 0.286 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -64.6 | -50.8 | 173.3 | -87.9 | -76.4 | 0 | 0 | 0 | 111.9 | K177 E178 L183 S184 T185 L244 I247 | K177-Y181 HydrophobicContact CD-CE2 4.14Å; K177-Y181 VanDerWaalsContact CE-CE2 3.42Å; K177-Y181 HydrophobicContact CG-CD2 3.75Å; K177-Y181 HydrophobicContact CG-CE2 3.58Å; K177-Y181 VanDerWaalsContact O-CD2 3.27Å; K177-Y181 WeakPolarHBondContact O-CD2 3.13Å; K177-Y181 PolarHBondContact O-N 3.43Å; E178-Y181 PolarHBondContact O-N 3.46Å; Y181-L183 PolarHBondContact O-N 3.24Å; Y181-S184 PolarHBondContact O-N 2.97Å; Y181-T185 VanDerWaalsContact O-CB 3.26Å; Y181-T185 WeakPolarHBondContact O-CB 3.27Å; Y181-T185 PolarHBondContact O-N 2.69Å; Y181-T185 PolarHBondContact O-OG1 3.35Å; Y181-L244 HydrophobicContact CD1-CD2 3.36Å; Y181-L244 HydrophobicContact CE1-CB 4.22Å; Y181-L244 HydrophobicContact CE1-CD2 3.81Å; Y181-L244 VanDerWaalsContact CE1-O 3.27Å; Y181-L244 WeakPolarHBondContact CE1-O 3.47Å; Y181-L244 HydrophobicContact CG-CD2 4.24Å; Y181-L244 VanDerWaalsContact CZ-O 3.29Å; Y181-L244 PolarHBondContact OH-O 2.95Å; Y181-I247 HydrophobicContact CD2-CD1 3.65Å; Y181-I247 HydrophobicContact CE1-CD1 4.4Å; Y181-I247 HydrophobicContact CE2-CB 4.07Å; Y181-I247 HydrophobicContact CE2-CD1 3.41Å; Y181-I247 VanDerWaalsContact CE2-CD1 3.41Å; Y181-I247 HydrophobicContact CE2-CG1 4.35Å; Y181-I247 HydrophobicContact CE2-CG2 4.37Å; Y181-I247 HydrophobicContact CG-CD1 4.22Å |
| 182 | I | 86.8 | Confident | 80.5 | Confident | 111 Ų | 111 | 57.5 Ų | 57.5 | 57% | 0.569 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -59.3 | -49.6 | -179.4 | -67.5 | 166.4 | 0 | 0 | 0 | 109.9 | E178 T185 L186 | E178-I182 VanDerWaalsContact O-CG1 3.31Å; E178-I182 WeakPolarHBondContact O-CG1 3.29Å; E178-I182 PolarHBondContact O-N 3.03Å; I182-T185 PolarHBondContact O-N 2.95Å; I182-L186 VanDerWaalsContact O-CB 3.24Å; I182-L186 WeakPolarHBondContact O-CB 3.49Å; I182-L186 PolarHBondContact O-N 3.38Å |
| 183 | L | 86.9 | Confident | 82.3 | Confident | 59 Ų | 59 | 59.7 Ų | 59.7 | 31% | 0.309 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -66 | -43.4 | -176.8 | -174.1 | 55.3 | 0 | 0 | 0 | 112.3 | Y99 L179 Y181 L186 V187 | Y99-L183 HydrophobicContact CD1-CD1 4.2Å; Y99-L183 HydrophobicContact CD1-CD2 4.4Å; Y99-L183 HydrophobicContact CD1-CG 4.45Å; Y99-L183 HydrophobicContact CE1-CD1 3.71Å; Y99-L183 HydrophobicContact CE1-CD2 3.53Å; Y99-L183 HydrophobicContact CE1-CG 3.52Å; Y99-L183 HydrophobicContact CE2-CD2 3.99Å; Y99-L183 WeakPolarHBondContact OH-CD2 3.31Å; L179-L183 WeakPolarHBondContact O-CB 3.41Å; L179-L183 PolarHBondContact O-N 3.12Å; Y181-L183 PolarHBondContact O-N 3.24Å; L183-L186 PolarHBondContact O-N 3.24Å; L183-V187 WeakPolarHBondContact O-CG2 3.47Å; L183-V187 PolarHBondContact O-N 3.31Å |
| 184 | S | 90 | Very high | 84 | Confident | 0 Ų | 0 | 59.3 Ų | 59.3 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -68.4 | -40.8 | 179.3 | -53.1 | 0 | 0 | 0 | 0 | 111.8 | N180 Y181 V187 I188 H240 R243 | N180-S184 VanDerWaalsContact O-CB 3.24Å; N180-S184 WeakPolarHBondContact O-CB 3.47Å; N180-S184 PolarHBondContact O-N 3.28Å; N180-S184 PolarHBondContact O-OG 3.34Å; Y181-S184 PolarHBondContact O-N 2.97Å; S184-V187 PolarHBondContact O-N 3.02Å; S184-I188 WeakPolarHBondContact O-CD1 3.12Å; S184-I188 VanDerWaalsContact O-CG1 3.26Å; S184-I188 WeakPolarHBondContact O-CG1 3.29Å; S184-I188 PolarHBondContact O-N 3.3Å; S184-I188 VanDerWaalsContact O-N 3.08Å; S184-H240 WeakPolarHBondContact CA-ND1 3.26Å; S184-H240 WeakPolarHBondContact CB-ND1 3.34Å; S184-H240 PolarHBondContact OG-ND1 2.77Å; S184-R243 PolarHBondContact OG-NH1 2.95Å |
| 185 | T | 89.3 | Confident | 85.6 | Confident | 64 Ų | 64 | 55.8 Ų | 55.8 | 39% | 0.393 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -63 | -44.6 | 175 | -54.7 | 0 | 0 | 0 | 0 | 111 | Y181 I182 V187 I188 V189 | Y181-T185 VanDerWaalsContact O-CB 3.26Å; Y181-T185 WeakPolarHBondContact O-CB 3.27Å; Y181-T185 PolarHBondContact O-N 2.69Å; Y181-T185 PolarHBondContact O-OG1 3.35Å; I182-T185 PolarHBondContact O-N 2.95Å; T185-V187 PolarHBondContact O-N 3.26Å; T185-I188 PolarHBondContact O-N 2.94Å; T185-V189 HydrophobicContact CG2-CG2 4.21Å; T185-V189 WeakPolarHBondContact O-CB 3.37Å; T185-V189 VanDerWaalsContact O-CG2 3.3Å; T185-V189 WeakPolarHBondContact O-CG2 3.28Å; T185-V189 PolarHBondContact O-N 2.98Å |
| 186 | L | 90.4 | Very high | 87.2 | Confident | 95 Ų | 95 | 54.1 Ų | 54.1 | 50% | 0.497 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -57.8 | -50.3 | 176.9 | 179.7 | 68.6 | 0 | 0 | 0 | 111.1 | I182 L183 I188 V189 V190 | I182-L186 VanDerWaalsContact O-CB 3.24Å; I182-L186 WeakPolarHBondContact O-CB 3.49Å; I182-L186 PolarHBondContact O-N 3.38Å; L183-L186 PolarHBondContact O-N 3.24Å; L186-I188 VanDerWaalsContact C-N 3.34Å; L186-I188 PolarHBondContact O-N 2.87Å; L186-V189 PolarHBondContact O-N 3.47Å; L186-V190 HydrophobicContact CD1-CG2 3.8Å; L186-V190 HydrophobicContact CG-CG2 4.27Å; L186-V190 WeakPolarHBondContact O-CB 3.22Å; L186-V190 WeakPolarHBondContact O-CG2 3.42Å; L186-V190 PolarHBondContact O-N 2.91Å |
| 187 | V | 91 | Very high | 88.2 | Confident | 2 Ų | 2 | 56.3 Ų | 56.3 | 1% | 0.012 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -58.6 | -45.9 | 179.8 | 171.5 | 0 | 0 | 0 | 0 | 111.1 | Y99 F102 L183 S184 T185 A191 H240 | Y99-V187 HydrophobicContact CE1-CG2 4.16Å; F102-V187 HydrophobicContact CD1-CG2 4.25Å; F102-V187 HydrophobicContact CD2-CG1 4.17Å; F102-V187 HydrophobicContact CE1-CG2 4.04Å; F102-V187 HydrophobicContact CE2-CG1 3.87Å; F102-V187 HydrophobicContact CZ-CB 4.28Å; F102-V187 HydrophobicContact CZ-CG1 4.08Å; F102-V187 HydrophobicContact CZ-CG2 4.27Å; L183-V187 WeakPolarHBondContact O-CG2 3.47Å; L183-V187 PolarHBondContact O-N 3.31Å; S184-V187 PolarHBondContact O-N 3.02Å; T185-V187 PolarHBondContact O-N 3.26Å; V187-A191 WeakPolarHBondContact O-CB 3.27Å; V187-A191 PolarHBondContact O-N 2.69Å; V187-H240 VanDerWaalsContact CG1-CD2 3.4Å; V187-H240 WeakPolarHBondContact CG1-CD2 3.29Å |
| 188 | I | 92.9 | Very high | 88.9 | Confident | 30 Ų | 30 | 52.2 Ų | 52.2 | 15% | 0.154 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -62.4 | -53.9 | 179.5 | -66.3 | 164.3 | 0 | 0 | 0 | 111.1 | S184 T185 L186 V190 A191 V192 V237 H240 L244 | S184-I188 WeakPolarHBondContact O-CD1 3.12Å; S184-I188 VanDerWaalsContact O-CG1 3.26Å; S184-I188 WeakPolarHBondContact O-CG1 3.29Å; S184-I188 PolarHBondContact O-N 3.3Å; S184-I188 VanDerWaalsContact O-N 3.08Å; T185-I188 PolarHBondContact O-N 2.94Å; L186-I188 VanDerWaalsContact C-N 3.34Å; L186-I188 PolarHBondContact O-N 2.87Å; I188-V190 VanDerWaalsContact C-N 3.29Å; I188-V190 PolarHBondContact O-N 2.98Å; I188-A191 PolarHBondContact O-N 3.43Å; I188-V192 HydrophobicContact CG2-CG2 4.42Å; I188-V192 WeakPolarHBondContact O-CB 3.4Å; I188-V192 VanDerWaalsContact O-CG2 3.3Å; I188-V192 WeakPolarHBondContact O-CG2 3.49Å; I188-V192 PolarHBondContact O-N 2.81Å; I188-V237 HydrophobicContact CG1-CG1 4.49Å; I188-V237 HydrophobicContact CG2-CG1 4.46Å; I188-H240 HydrophobicContact CD1-CB 3.95Å; I188-H240 HydrophobicContact CG1-CB 3.8Å; I188-L244 HydrophobicContact CD1-CD1 3.71Å |
| 189 | V | 92.9 | Very high | 89.5 | Confident | 80 Ų | 80 | 47.8 Ų | 47.8 | 49% | 0.485 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -57.4 | -48.2 | -177.1 | 168.8 | 0 | 0 | 0 | 0 | 110.1 | T185 L186 V192 V193 | T185-V189 HydrophobicContact CG2-CG2 4.21Å; T185-V189 WeakPolarHBondContact O-CB 3.37Å; T185-V189 VanDerWaalsContact O-CG2 3.3Å; T185-V189 WeakPolarHBondContact O-CG2 3.28Å; T185-V189 PolarHBondContact O-N 2.98Å; L186-V189 PolarHBondContact O-N 3.47Å; V189-V192 PolarHBondContact O-N 3.34Å; V189-V193 HydrophobicContact CG1-CG2 4.32Å; V189-V193 WeakPolarHBondContact O-CB 3.26Å; V189-V193 VanDerWaalsContact O-CG2 3.22Å; V189-V193 WeakPolarHBondContact O-CG2 3.12Å; V189-V193 PolarHBondContact O-N 2.87Å |
| 190 | V | 89.9 | Confident | 90.1 | Very high | 27 Ų | 27 | 46.4 Ų | 46.4 | 16% | 0.164 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -66.6 | -43.4 | -177.6 | 169.3 | 0 | 0 | 0 | 0 | 111.6 | F102 M106 L186 I188 V192 V193 L194 | F102-V190 HydrophobicContact CE1-CG1 4.22Å; F102-V190 HydrophobicContact CE2-CG1 4.49Å; F102-V190 HydrophobicContact CZ-CB 3.92Å; F102-V190 HydrophobicContact CZ-CG1 3.58Å; M106-V190 HydrophobicContact CE-CG1 3.17Å; M106-V190 HydrophobicContact CG-CG1 4.31Å; M106-V190 HydrophobicContact SD-CB 4.45Å; M106-V190 HydrophobicContact SD-CG1 2.97Å; M106-V190 WeakPolarHBondContact SD-CG1 3.37Å; L186-V190 HydrophobicContact CD1-CG2 3.8Å; L186-V190 HydrophobicContact CG-CG2 4.27Å; L186-V190 WeakPolarHBondContact O-CB 3.22Å; L186-V190 WeakPolarHBondContact O-CG2 3.42Å; L186-V190 PolarHBondContact O-N 2.91Å; I188-V190 VanDerWaalsContact C-N 3.29Å; I188-V190 PolarHBondContact O-N 2.98Å; V190-V192 VanDerWaalsContact C-N 3.34Å; V190-V192 PolarHBondContact O-N 3.46Å; V190-V193 PolarHBondContact O-N 3.48Å; V190-L194 WeakPolarHBondContact O-CB 3.32Å; V190-L194 WeakPolarHBondContact O-CG 3.3Å; V190-L194 PolarHBondContact O-N 2.82Å |
| 191 | A | 91.6 | Very high | 90.5 | Very high | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -60 | -43.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | F102 V187 I188 T195 M232 V237 | F102-A191 HydrophobicContact CE2-CB 4.32Å; V187-A191 WeakPolarHBondContact O-CB 3.27Å; V187-A191 PolarHBondContact O-N 2.69Å; I188-A191 PolarHBondContact O-N 3.43Å; A191-T195 WeakPolarHBondContact O-CB 3.16Å; A191-T195 PolarHBondContact O-N 3.06Å; A191-T195 VanDerWaalsContact O-N 3.11Å; A191-T195 PolarHBondContact O-OG1 2.78Å; A191-M232 HydrophobicContact CB-CE 3.73Å; A191-V237 HydrophobicContact CB-CG2 4.11Å |
| 192 | V | 93.4 | Very high | 90.6 | Very high | 73 Ų | 73 | 43.3 Ų | 43.3 | 44% | 0.442 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -67.7 | -47.4 | 179.2 | 171.7 | 0 | 0 | 0 | 0 | 110.9 | I188 V189 V190 T195 A196 | I188-V192 HydrophobicContact CG2-CG2 4.42Å; I188-V192 WeakPolarHBondContact O-CB 3.4Å; I188-V192 VanDerWaalsContact O-CG2 3.3Å; I188-V192 WeakPolarHBondContact O-CG2 3.49Å; I188-V192 PolarHBondContact O-N 2.81Å; V189-V192 PolarHBondContact O-N 3.34Å; V190-V192 VanDerWaalsContact C-N 3.34Å; V190-V192 PolarHBondContact O-N 3.46Å; V192-T195 PolarHBondContact O-N 3.45Å; V192-A196 WeakPolarHBondContact O-CB 3.41Å; V192-A196 PolarHBondContact O-N 3.35Å |
| 193 | V | 92.3 | Very high | 90.8 | Very high | 76 Ų | 76 | 45.9 Ų | 45.9 | 46% | 0.461 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -61 | -48.9 | -179.5 | 168.6 | 0 | 0 | 0 | 0 | 111.1 | V189 V190 T195 A196 L197 | V189-V193 HydrophobicContact CG1-CG2 4.32Å; V189-V193 WeakPolarHBondContact O-CB 3.26Å; V189-V193 VanDerWaalsContact O-CG2 3.22Å; V189-V193 WeakPolarHBondContact O-CG2 3.12Å; V189-V193 PolarHBondContact O-N 2.87Å; V190-V193 PolarHBondContact O-N 3.48Å; V193-T195 PolarHBondContact O-N 3.45Å; V193-A196 PolarHBondContact O-N 3.49Å; V193-L197 HydrophobicContact CG1-CD1 4Å; V193-L197 HydrophobicContact CG1-CG 4.43Å; V193-L197 WeakPolarHBondContact O-CG 3.18Å; V193-L197 PolarHBondContact O-N 2.95Å |
| 194 | L | 89.5 | Confident | 90.8 | Very high | 14 Ų | 14 | 46.7 Ų | 46.7 | 7% | 0.073 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -65 | -39.7 | 179.8 | -72.2 | -165.5 | 0 | 0 | 0 | 112.6 | M106 L109 V110 L113 V190 A196 L197 Q198 | M106-L194 HydrophobicContact CE-CD1 3.77Å; M106-L194 HydrophobicContact CE-CG 4.41Å; M106-L194 HydrophobicContact SD-CD1 3.12Å; M106-L194 WeakPolarHBondContact SD-CD1 3.3Å; M106-L194 HydrophobicContact SD-CG 4.08Å; L109-L194 HydrophobicContact CB-CD1 3.84Å; L109-L194 HydrophobicContact CD1-CB 4.14Å; L109-L194 HydrophobicContact CD1-CD1 3.63Å; L109-L194 HydrophobicContact CG-CD1 4.4Å; V110-L194 HydrophobicContact CG2-CD2 4.47Å; L113-L194 HydrophobicContact CD1-CD2 4.19Å; V190-L194 WeakPolarHBondContact O-CB 3.32Å; V190-L194 WeakPolarHBondContact O-CG 3.3Å; V190-L194 PolarHBondContact O-N 2.82Å; L194-A196 VanDerWaalsContact C-N 3.32Å; L194-A196 PolarHBondContact O-N 2.91Å; L194-L197 HydrophobicContact CD2-CD1 4.33Å; L194-L197 PolarHBondContact O-N 3.5Å; L194-Q198 VanDerWaalsContact O-CB 3.27Å; L194-Q198 WeakPolarHBondContact O-CB 3.44Å; L194-Q198 PolarHBondContact O-N 3.29Å |
| 195 | T | 91.4 | Very high | 90.5 | Very high | 16 Ų | 16 | 47.7 Ų | 47.7 | 10% | 0.098 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 174.9 | -57.1 | 0 | 0 | 0 | 0 | 111.1 | A191 V192 V193 Q198 A199 L230 L233 | A191-T195 WeakPolarHBondContact O-CB 3.16Å; A191-T195 PolarHBondContact O-N 3.06Å; A191-T195 VanDerWaalsContact O-N 3.11Å; A191-T195 PolarHBondContact O-OG1 2.78Å; V192-T195 PolarHBondContact O-N 3.45Å; V193-T195 PolarHBondContact O-N 3.45Å; T195-Q198 PolarHBondContact O-N 2.96Å; T195-A199 WeakPolarHBondContact O-CB 3.4Å; T195-A199 PolarHBondContact O-N 2.97Å; T195-L230 HydrophobicContact CG2-CD2 4.35Å; T195-L233 HydrophobicContact CG2-CD1 4.06Å |
| 196 | A | 93 | Very high | 90.3 | Very high | 59 Ų | 59 | 50.6 Ų | 50.6 | 49% | 0.488 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -63.9 | -43 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | V192 V193 L194 A199 N200 | V192-A196 WeakPolarHBondContact O-CB 3.41Å; V192-A196 PolarHBondContact O-N 3.35Å; V193-A196 PolarHBondContact O-N 3.49Å; L194-A196 VanDerWaalsContact C-N 3.32Å; L194-A196 PolarHBondContact O-N 2.91Å; A196-A199 PolarHBondContact O-N 3.41Å; A196-N200 WeakPolarHBondContact O-CB 3.16Å; A196-N200 PolarHBondContact O-N 2.98Å |
| 197 | L | 91.3 | Very high | 89.9 | Confident | 59 Ų | 59 | 53.2 Ų | 53.2 | 31% | 0.309 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -63 | -44.2 | 175.2 | -68 | 173.2 | 0 | 0 | 0 | 111.5 | L113 Y117 V193 L194 A199 N200 V201 | L113-L197 HydrophobicContact CD1-CB 3.82Å; L113-L197 HydrophobicContact CD1-CD1 4.39Å; L113-L197 HydrophobicContact CD2-CB 4.44Å; Y117-L197 HydrophobicContact CE1-CD2 4.39Å; Y117-L197 HydrophobicContact CE2-CB 4.35Å; Y117-L197 HydrophobicContact CE2-CD2 4.26Å; Y117-L197 PolarHBondContact OH-O 2.98Å; V193-L197 HydrophobicContact CG1-CD1 4Å; V193-L197 HydrophobicContact CG1-CG 4.43Å; V193-L197 WeakPolarHBondContact O-CG 3.18Å; V193-L197 PolarHBondContact O-N 2.95Å; L194-L197 HydrophobicContact CD2-CD1 4.33Å; L194-L197 PolarHBondContact O-N 3.5Å; L197-A199 PolarHBondContact O-N 3.35Å; L197-N200 PolarHBondContact O-N 2.97Å; L197-V201 WeakPolarHBondContact O-CG2 3.39Å; L197-V201 PolarHBondContact O-N 2.92Å |
| 198 | Q | 90.4 | Very high | 89.3 | Confident | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -61.7 | -43.4 | 177.1 | -171.4 | 63.3 | 52.9 | 0 | 0 | 112.1 | L113 L194 T195 V201 L202 Q222 S225 L226 T229 | L113-Q198 HydrophobicContact CD2-CB 4.42Å; L194-Q198 VanDerWaalsContact O-CB 3.27Å; L194-Q198 WeakPolarHBondContact O-CB 3.44Å; L194-Q198 PolarHBondContact O-N 3.29Å; T195-Q198 PolarHBondContact O-N 2.96Å; Q198-V201 PolarHBondContact O-N 2.87Å; Q198-L202 PolarHBondContact O-N 3.24Å; Q198-Q222 PolarHBondContact NE2-O 2.89Å; Q198-S225 VanDerWaalsContact CD-OG 3.26Å; Q198-S225 PolarHBondContact NE2-OG 2.85Å; Q198-S225 PolarHBondContact OE1-OG 3.38Å; Q198-L226 HydrophobicContact CG-CB 4.21Å; Q198-L226 HydrophobicContact CG-CD1 4.2Å; Q198-T229 HydrophobicContact CB-CG2 4.2Å; Q198-T229 HydrophobicContact CG-CG2 4.09Å |
| 199 | A | 91.4 | Very high | 88.1 | Confident | 42 Ų | 42 | 62.8 Ų | 62.8 | 35% | 0.347 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -63.5 | -40.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | T195 A196 L197 L202 W203 L226 | T195-A199 WeakPolarHBondContact O-CB 3.4Å; T195-A199 PolarHBondContact O-N 2.97Å; A196-A199 PolarHBondContact O-N 3.41Å; L197-A199 PolarHBondContact O-N 3.35Å; A199-L202 PolarHBondContact O-N 3.37Å; A199-W203 VanDerWaalsContact O-CB 3.27Å; A199-W203 WeakPolarHBondContact O-CB 3.39Å; A199-W203 PolarHBondContact O-N 3.19Å; A199-L226 HydrophobicContact CB-CD1 4.32Å |
| 200 | N | 91.6 | Very high | 86.8 | Confident | 78 Ų | 78 | 69 Ų | 69 | 42% | 0.417 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -64.6 | -42.8 | 178 | -175.4 | 24.6 | 0 | 0 | 0 | 112.5 | Y117 A196 L197 W203 T204 | Y117-N200 PolarHBondContact OH-ND2 3.4Å; A196-N200 WeakPolarHBondContact O-CB 3.16Å; A196-N200 PolarHBondContact O-N 2.98Å; L197-N200 PolarHBondContact O-N 2.97Å; N200-W203 PolarHBondContact O-N 3.48Å; N200-T204 WeakPolarHBondContact O-CB 3.33Å; N200-T204 PolarHBondContact O-N 3.45Å; N200-T204 PolarHBondContact O-OG1 2.95Å |
| 201 | V | 88.5 | Confident | 85.5 | Confident | 6 Ų | 6 | 75.8 Ų | 75.8 | 4% | 0.036 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -61.4 | -47.9 | 174.2 | 170.7 | 0 | 0 | 0 | 0 | 110.6 | L113 H116 Y117 L197 Q198 W203 T204 L205 Q222 | L113-V201 HydrophobicContact CD2-CB 4.29Å; L113-V201 HydrophobicContact CD2-CG2 3.72Å; H116-V201 HydrophobicContact CB-CG1 4.4Å; H116-V201 HydrophobicContact CB-CG2 4Å; Y117-V201 HydrophobicContact CD2-CG2 4.37Å; Y117-V201 HydrophobicContact CE2-CG2 3.45Å; Y117-V201 VanDerWaalsContact CE2-CG2 3.45Å; L197-V201 WeakPolarHBondContact O-CG2 3.39Å; L197-V201 PolarHBondContact O-N 2.92Å; Q198-V201 PolarHBondContact O-N 2.87Å; V201-W203 VanDerWaalsContact C-N 3.33Å; V201-W203 PolarHBondContact O-N 3.34Å; V201-T204 PolarHBondContact O-N 3.47Å; V201-L205 HydrophobicContact CG1-CD1 4.12Å; V201-L205 WeakPolarHBondContact O-CG 2.99Å; V201-L205 PolarHBondContact O-N 3.01Å; V201-Q222 HydrophobicContact CG1-CG 4.31Å |
| 202 | L | 89.1 | Confident | 83.6 | Confident | 19 Ų | 19 | 78.5 Ų | 78.5 | 10% | 0.099 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -61.3 | -42.8 | 178.6 | -174.2 | 67.2 | 0 | 0 | 0 | 111.7 | Q198 A199 T204 L205 Y206 F219 Q222 L223 L226 | Q198-L202 PolarHBondContact O-N 3.24Å; A199-L202 PolarHBondContact O-N 3.37Å; L202-T204 VanDerWaalsContact C-N 3.35Å; L202-T204 PolarHBondContact O-N 3Å; L202-L205 PolarHBondContact O-N 3.14Å; L202-Y206 WeakPolarHBondContact O-CB 3.17Å; L202-Y206 PolarHBondContact O-N 3.43Å; L202-F219 HydrophobicContact CD1-CD2 3.58Å; L202-F219 HydrophobicContact CD1-CE2 3.45Å; L202-F219 VanDerWaalsContact CD1-CE2 3.45Å; L202-F219 HydrophobicContact CD1-CG 4.35Å; L202-F219 HydrophobicContact CD1-CZ 4.15Å; L202-F219 HydrophobicContact CG-CE2 4.09Å; L202-Q222 HydrophobicContact CD1-CB 3.94Å; L202-L223 HydrophobicContact CD1-CB 4.39Å; L202-L223 HydrophobicContact CD2-CD1 4.15Å; L202-L226 HydrophobicContact CD2-CB 4.31Å; L202-L226 HydrophobicContact CD2-CD2 3.43Å; L202-L226 VanDerWaalsContact CD2-CD2 3.43Å; L202-L226 HydrophobicContact CD2-CG 4.47Å |
| 203 | W | 89.1 | Confident | 81.9 | Confident | 164 Ų | 164 | 81.1 Ų | 81.1 | 62% | 0.621 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -61.1 | -43.2 | 176.2 | 178.7 | -105.6 | 0 | 0 | 0 | 112.2 | A199 N200 V201 L205 Y206 K207 | A199-W203 VanDerWaalsContact O-CB 3.27Å; A199-W203 WeakPolarHBondContact O-CB 3.39Å; A199-W203 PolarHBondContact O-N 3.19Å; N200-W203 PolarHBondContact O-N 3.48Å; V201-W203 VanDerWaalsContact C-N 3.33Å; V201-W203 PolarHBondContact O-N 3.34Å; W203-L205 VanDerWaalsContact C-N 3.35Å; W203-L205 PolarHBondContact O-N 3.12Å; W203-Y206 HydrophobicContact CE3-CD1 4.42Å; W203-Y206 HydrophobicContact CZ3-CD1 4.35Å; W203-Y206 PolarHBondContact O-N 3.4Å; W203-K207 PolarHBondContact O-N 2.99Å |
| 204 | T | 86.9 | Confident | 80 | Confident | 76 Ų | 76 | 89 Ų | 89 | 47% | 0.466 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62.8 | -42.6 | 176.8 | -59.8 | 0 | 0 | 0 | 0 | 111.3 | N200 V201 L202 K207 R208 | N200-T204 WeakPolarHBondContact O-CB 3.33Å; N200-T204 PolarHBondContact O-N 3.45Å; N200-T204 PolarHBondContact O-OG1 2.95Å; V201-T204 PolarHBondContact O-N 3.47Å; L202-T204 VanDerWaalsContact C-N 3.35Å; L202-T204 PolarHBondContact O-N 3Å; T204-K207 PolarHBondContact O-N 2.87Å; T204-R208 WeakPolarHBondContact O-CB 3.43Å; T204-R208 PolarHBondContact O-N 3.1Å |
| 205 | L | 84.7 | Confident | 78.6 | Confident | 21 Ų | 21 | 89.1 Ų | 89.1 | 11% | 0.11 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -65.8 | -44.1 | 175.7 | -70.9 | 173.8 | 0 | 0 | 0 | 111.9 | V201 L202 W203 K207 R208 D209 Q222 | V201-L205 HydrophobicContact CG1-CD1 4.12Å; V201-L205 WeakPolarHBondContact O-CG 2.99Å; V201-L205 PolarHBondContact O-N 3.01Å; L202-L205 PolarHBondContact O-N 3.14Å; W203-L205 VanDerWaalsContact C-N 3.35Å; W203-L205 PolarHBondContact O-N 3.12Å; L205-K207 VanDerWaalsContact C-N 3.29Å; L205-K207 PolarHBondContact O-N 3.49Å; L205-R208 PolarHBondContact O-N 3.33Å; L205-D209 PolarHBondContact O-N 3.28Å; L205-Q222 HydrophobicContact CD1-CB 4.12Å; L205-Q222 HydrophobicContact CD1-CG 3.57Å |
| 206 | Y | 84.7 | Confident | 77.3 | Confident | 125 Ų | 125 | 95.7 Ų | 95.7 | 49% | 0.49 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -56.1 | -44.3 | 175.8 | 177 | -104.8 | 0 | 0 | 0 | 111.8 | L202 W203 R208 R210 F219 | L202-Y206 WeakPolarHBondContact O-CB 3.17Å; L202-Y206 PolarHBondContact O-N 3.43Å; W203-Y206 HydrophobicContact CE3-CD1 4.42Å; W203-Y206 HydrophobicContact CZ3-CD1 4.35Å; W203-Y206 PolarHBondContact O-N 3.4Å; Y206-R208 VanDerWaalsContact C-N 3.28Å; Y206-R208 PolarHBondContact O-N 2.9Å; Y206-R210 PolarHBondContact O-N 3.37Å; Y206-F219 HydrophobicContact CD2-CE2 4.27Å |
| 207 | K | 83.3 | Confident | 76.2 | Confident | 150 Ų | 150 | 101.1 Ų | 101.1 | 65% | 0.652 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -65.8 | -31.3 | 178 | -160.2 | 179.6 | -176.6 | -178.4 | 0 | 112.6 | W203 T204 L205 | W203-K207 PolarHBondContact O-N 2.99Å; T204-K207 PolarHBondContact O-N 2.87Å; L205-K207 VanDerWaalsContact C-N 3.29Å; L205-K207 PolarHBondContact O-N 3.49Å |
| 208 | R | 77 | Confident | 75.4 | Confident | 186 Ų | 186 | 102.9 Ų | 102.9 | 70% | 0.702 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -84.2 | -34.9 | -179 | -162.2 | 172 | -172.4 | 168.8 | 1.3 | 113.2 | T204 L205 Y206 R210 Q211 | T204-R208 WeakPolarHBondContact O-CB 3.43Å; T204-R208 PolarHBondContact O-N 3.1Å; L205-R208 PolarHBondContact O-N 3.33Å; Y206-R208 VanDerWaalsContact C-N 3.28Å; Y206-R208 PolarHBondContact O-N 2.9Å; R208-R210 PolarHBondContact O-N 2.99Å; R208-Q211 WeakPolarHBondContact O-CB 3.46Å; R208-Q211 PolarHBondContact O-N 3.29Å |
| 209 | D | 69.1 | Low | 74.9 | Confident | 47 Ų | 47 | 105.4 Ų | 105.4 | 25% | 0.251 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.3 | -31.5 | 176.3 | -167.2 | 49 | 0 | 0 | 0 | 111.7 | L205 Q211 G212 S215 | L205-D209 PolarHBondContact O-N 3.28Å; D209-Q211 PolarHBondContact O-N 3.09Å; D209-G212 PolarHBondContact O-N 3.41Å; D209-S215 WeakPolarHBondContact OD1-CB 3.32Å |
| 210 | R | 64.8 | Low | 74.3 | Confident | 212 Ų | 212 | 104.6 Ų | 104.6 | 80% | 0.8 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | -11.7 | 170.5 | -155.9 | 175.9 | 166.5 | 177.5 | -4 | 113.7 | Y206 R208 | Y206-R210 PolarHBondContact O-N 3.37Å; R208-R210 PolarHBondContact O-N 2.99Å |
| 211 | Q | 63.5 | Low | 73.7 | Confident | 168 Ų | 168 | 102.6 Ų | 102.6 | 79% | 0.785 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.9 | 0.1 | 178.4 | -60.9 | -179.3 | -28.2 | 0 | 0 | 114.4 | R208 D209 | R208-Q211 WeakPolarHBondContact O-CB 3.46Å; R208-Q211 PolarHBondContact O-N 3.29Å; D209-Q211 PolarHBondContact O-N 3.09Å |
| 212 | G | 51.8 | Low | 73.5 | Confident | 58 Ų | 58 | 102.9 Ų | 102.9 | 60% | 0.598 | 49% | 0.492 | S | S | * | . | trans | 106.4 | 121.5 | 165.6 | 0 | 0 | 0 | 0 | 0 | 117.4 | D209 | D209-G212 PolarHBondContact O-N 3.41Š| ||
| 213 | C | 56.6 | Low | 73.3 | Confident | 128 Ų | 128 | 105.5 Ų | 105.5 | 87% | 0.865 | 51% | 0.506 | S | S | * | . | S | Bend | trans | 56.4 | 85.2 | 151.4 | -109.1 | 0 | 0 | 0 | 0 | 120.6 | ||
| 214 | R | 52.4 | Low | 73 | Confident | 241 Ų | 241 | 101.3 Ų | 101.3 | 91% | 0.909 | 49% | 0.492 | S | S | * | . | S | Bend | trans | 176.2 | -7.2 | 143.8 | -114.7 | 179.3 | 141 | -167.9 | -6.6 | 112 | ||
| 215 | S | 59.3 | Low | 72.9 | Confident | 16 Ų | 16 | 98.1 Ų | 98.1 | 11% | 0.112 | 47% | 0.473 | C | S | . | . | trans | -90 | -5.7 | -165.1 | 180 | 0 | 0 | 0 | 0 | 115.6 | D209 Q217 D218 F219 | D209-S215 WeakPolarHBondContact OD1-CB 3.32Å; S215-Q217 PolarHBondContact O-N 3.26Å; S215-D218 PolarHBondContact O-N 2.87Å; S215-F219 WeakPolarHBondContact O-CA 3.28Å; S215-F219 WeakPolarHBondContact O-CB 3.27Å; S215-F219 PolarHBondContact O-N 3.37Å | ||
| 216 | Q | 65.6 | Low | 73 | Confident | 154 Ų | 154 | 98.5 Ų | 98.5 | 72% | 0.72 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -66.2 | -40.8 | -173.5 | -74.7 | -128.7 | -29.3 | 0 | 0 | 114.3 | G220 | Q216-G220 PolarHBondContact O-N 3.02Å |
| 217 | Q | 68.4 | Low | 73.1 | Confident | 174 Ų | 174 | 95 Ų | 95 | 81% | 0.813 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -68.8 | -43 | 176.8 | -72.6 | -177.9 | -13.9 | 0 | 0 | 111.8 | S215 G220 A221 | S215-Q217 PolarHBondContact O-N 3.26Å; Q217-G220 PolarHBondContact O-N 2.84Å; Q217-A221 WeakPolarHBondContact O-CB 3.46Å; Q217-A221 PolarHBondContact O-N 3.46Å |
| 218 | D | 74.7 | Confident | 73.1 | Confident | 95 Ų | 95 | 88.2 Ų | 88.2 | 51% | 0.508 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.7 | -41.9 | 175.8 | -74.2 | -20.6 | 0 | 0 | 0 | 111.3 | S215 A221 Q222 | S215-D218 PolarHBondContact O-N 2.87Å; D218-A221 PolarHBondContact O-N 3.35Å; D218-Q222 WeakPolarHBondContact O-CG 3.27Å; D218-Q222 PolarHBondContact O-N 3.2Å |
| 219 | F | 80.2 | Confident | 73.5 | Confident | 54 Ų | 54 | 79.4 Ų | 79.4 | 24% | 0.237 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -61.7 | -47.4 | 175.9 | -179.2 | -95.5 | 0 | 0 | 0 | 111.3 | L202 Y206 S215 A221 Q222 L223 | L202-F219 HydrophobicContact CD1-CD2 3.58Å; L202-F219 HydrophobicContact CD1-CE2 3.45Å; L202-F219 VanDerWaalsContact CD1-CE2 3.45Å; L202-F219 HydrophobicContact CD1-CG 4.35Å; L202-F219 HydrophobicContact CD1-CZ 4.15Å; L202-F219 HydrophobicContact CG-CE2 4.09Å; Y206-F219 HydrophobicContact CD2-CE2 4.27Å; S215-F219 WeakPolarHBondContact O-CA 3.28Å; S215-F219 WeakPolarHBondContact O-CB 3.27Å; S215-F219 PolarHBondContact O-N 3.37Å; F219-A221 VanDerWaalsContact C-N 3.32Å; F219-A221 PolarHBondContact O-N 3.47Å; F219-Q222 PolarHBondContact O-N 3.5Å; F219-L223 HydrophobicContact CE1-CD2 4.31Å; F219-L223 VanDerWaalsContact O-CB 3.3Å; F219-L223 WeakPolarHBondContact O-CB 3.5Å; F219-L223 PolarHBondContact O-N 3.43Å |
| 220 | G | 78.8 | Confident | 74.5 | Confident | 25 Ų | 25 | 80.6 Ų | 80.6 | 26% | 0.258 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -59.9 | -40.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q216 Q217 K224 | Q216-G220 PolarHBondContact O-N 3.02Å; Q217-G220 PolarHBondContact O-N 2.84Å; G220-K224 WeakPolarHBondContact O-CG 2.92Å; G220-K224 PolarHBondContact O-N 2.85Å; G220-K224 VanDerWaalsContact O-N 3.07Å |
| 221 | A | 79.4 | Confident | 75.6 | Confident | 35 Ų | 35 | 72.4 Ų | 72.4 | 29% | 0.289 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -65.7 | -41.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q217 D218 F219 S225 | Q217-A221 WeakPolarHBondContact O-CB 3.46Å; Q217-A221 PolarHBondContact O-N 3.46Å; D218-A221 PolarHBondContact O-N 3.35Å; F219-A221 VanDerWaalsContact C-N 3.32Å; F219-A221 PolarHBondContact O-N 3.47Å; A221-S225 PolarHBondContact O-N 3.45Å |
| 222 | Q | 84.1 | Confident | 76.7 | Confident | 12 Ų | 12 | 64.4 Ų | 64.4 | 6% | 0.056 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -74.7 | -30.3 | 178.8 | -62.7 | -64.5 | -22.4 | 0 | 0 | 112.5 | H116 Q198 V201 L202 L205 D218 F219 S225 L226 | H116-Q222 PolarHBondContact NE2-NE2 2.85Å; H116-Q222 VanDerWaalsContact NE2-NE2 3.15Å; Q198-Q222 PolarHBondContact NE2-O 2.89Å; V201-Q222 HydrophobicContact CG1-CG 4.31Å; L202-Q222 HydrophobicContact CD1-CB 3.94Å; L205-Q222 HydrophobicContact CD1-CB 4.12Å; L205-Q222 HydrophobicContact CD1-CG 3.57Å; D218-Q222 WeakPolarHBondContact O-CG 3.27Å; D218-Q222 PolarHBondContact O-N 3.2Å; F219-Q222 PolarHBondContact O-N 3.5Å; Q222-S225 PolarHBondContact O-N 2.87Å; Q222-L226 PolarHBondContact O-N 3.17Å |
| 223 | L | 85.2 | Confident | 78.5 | Confident | 74 Ų | 74 | 64.1 Ų | 64.1 | 39% | 0.387 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -65.3 | -44.8 | 171.7 | -179.9 | 62.7 | 0 | 0 | 0 | 110.9 | L202 F219 S225 L226 C227 | L202-L223 HydrophobicContact CD1-CB 4.39Å; L202-L223 HydrophobicContact CD2-CD1 4.15Å; F219-L223 HydrophobicContact CE1-CD2 4.31Å; F219-L223 VanDerWaalsContact O-CB 3.3Å; F219-L223 WeakPolarHBondContact O-CB 3.5Å; F219-L223 PolarHBondContact O-N 3.43Å; L223-S225 VanDerWaalsContact C-N 3.33Å; L223-S225 PolarHBondContact O-N 3.23Å; L223-L226 WeakPolarHBondContact O-CB 3.42Å; L223-L226 PolarHBondContact O-N 3.38Å; L223-L226 VanDerWaalsContact O-N 3.16Å; L223-C227 PolarHBondContact O-N 2.89Å; L223-C227 PolarHBondContact O-SG 2.87Å |
| 224 | K | 83.3 | Confident | 80.1 | Confident | 76 Ų | 76 | 63.6 Ų | 63.6 | 33% | 0.33 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -59.7 | -44.5 | 172.9 | -72 | 173.6 | -176 | -176.3 | 0 | 111.7 | G220 L226 C227 F228 G275 | G220-K224 WeakPolarHBondContact O-CG 2.92Å; G220-K224 PolarHBondContact O-N 2.85Å; G220-K224 VanDerWaalsContact O-N 3.07Å; K224-L226 VanDerWaalsContact C-N 3.29Å; K224-L226 PolarHBondContact O-N 3.27Å; K224-C227 PolarHBondContact O-N 3.23Å; K224-F228 PolarHBondContact O-N 2.84Å; K224-G275 WeakPolarHBondContact CE-O 3.46Å; K224-G275 PolarHBondContact NZ-O 3.3Å |
| 225 | S | 83.7 | Confident | 81.9 | Confident | 9 Ų | 9 | 52.7 Ų | 52.7 | 6% | 0.063 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.6 | -38.4 | 175.2 | -167.1 | 0 | 0 | 0 | 0 | 111.7 | L109 Q198 A221 Q222 L223 F228 T229 | L109-S225 WeakPolarHBondContact CD2-OG 3.12Å; Q198-S225 VanDerWaalsContact CD-OG 3.26Å; Q198-S225 PolarHBondContact NE2-OG 2.85Å; Q198-S225 PolarHBondContact OE1-OG 3.38Å; A221-S225 PolarHBondContact O-N 3.45Å; Q222-S225 PolarHBondContact O-N 2.87Å; L223-S225 VanDerWaalsContact C-N 3.33Å; L223-S225 PolarHBondContact O-N 3.23Å; S225-F228 WeakPolarHBondContact O-CB 3.35Å; S225-F228 PolarHBondContact O-N 3.48Å; S225-T229 WeakPolarHBondContact O-CG2 3.37Å; S225-T229 PolarHBondContact O-N 2.86Å |
| 226 | L | 86.9 | Confident | 83.5 | Confident | 29 Ų | 29 | 51.9 Ų | 51.9 | 15% | 0.152 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.9 | -47.2 | 173.4 | -176.6 | 68.3 | 0 | 0 | 0 | 111.8 | Q198 A199 L202 Q222 L223 K224 F228 T229 L230 | Q198-L226 HydrophobicContact CG-CB 4.21Å; Q198-L226 HydrophobicContact CG-CD1 4.2Å; A199-L226 HydrophobicContact CB-CD1 4.32Å; L202-L226 HydrophobicContact CD2-CB 4.31Å; L202-L226 HydrophobicContact CD2-CD2 3.43Å; L202-L226 VanDerWaalsContact CD2-CD2 3.43Å; L202-L226 HydrophobicContact CD2-CG 4.47Å; Q222-L226 PolarHBondContact O-N 3.17Å; L223-L226 WeakPolarHBondContact O-CB 3.42Å; L223-L226 PolarHBondContact O-N 3.38Å; L223-L226 VanDerWaalsContact O-N 3.16Å; K224-L226 VanDerWaalsContact C-N 3.29Å; K224-L226 PolarHBondContact O-N 3.27Å; L226-F228 PolarHBondContact O-N 3.06Å; L226-T229 WeakPolarHBondContact CA-OG1 3.35Å; L226-T229 PolarHBondContact O-N 2.9Å; L226-T229 VanDerWaalsContact O-N 3.08Å; L226-T229 PolarHBondContact O-OG1 2.89Å; L226-L230 HydrophobicContact CD1-CG 4.44Å; L226-L230 HydrophobicContact CG-CD1 4.14Å; L226-L230 HydrophobicContact CG-CG 4.34Å; L226-L230 WeakPolarHBondContact O-CG 3.49Å; L226-L230 PolarHBondContact O-N 3.27Å |
| 227 | C | 87.1 | Confident | 84.7 | Confident | 51 Ų | 51 | 45.7 Ų | 45.7 | 35% | 0.345 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -54.4 | -42.8 | 175.5 | -69.8 | 0 | 0 | 0 | 0 | 111.5 | L223 K224 L230 I231 T272 | L223-C227 PolarHBondContact O-N 2.89Å; L223-C227 PolarHBondContact O-SG 2.87Å; K224-C227 PolarHBondContact O-N 3.23Å; C227-L230 PolarHBondContact O-N 2.95Å; C227-I231 WeakPolarHBondContact O-CG1 3.48Å; C227-I231 PolarHBondContact O-N 3.33Å; C227-T272 HydrophobicContact CB-CG2 4.08Å |
| 228 | F | 82.5 | Confident | 85.9 | Confident | 9 Ų | 9 | 40.2 Ų | 40.2 | 4% | 0.039 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -61.1 | -46.1 | 175.9 | -165.7 | -110.8 | 0 | 0 | 0 | 112.3 | L57 Y105 I108 K224 S225 L226 L230 I231 M232 D269 M270 | L57-F228 HydrophobicContact CD2-CE2 3.95Å; L57-F228 HydrophobicContact CD2-CZ 3.53Å; Y105-F228 AromaticContact CD1-CD1 3.23Å; Y105-F228 HydrophobicContact CD1-CD1 3.23Å; Y105-F228 HydrophobicContact CD1-CD2 4.37Å; Y105-F228 AromaticContact CD1-CE1 2.88Å; Y105-F228 HydrophobicContact CD1-CE1 2.88Å; Y105-F228 HydrophobicContact CD1-CE2 4.09Å; Y105-F228 AromaticContact CD1-CG 3.99Å; Y105-F228 HydrophobicContact CD1-CG 3.99Å; Y105-F228 AromaticContact CD1-CZ 3.36Å; Y105-F228 HydrophobicContact CD1-CZ 3.36Å; Y105-F228 AromaticContact CD2-CE1 3.76Å; Y105-F228 HydrophobicContact CD2-CE1 3.76Å; Y105-F228 HydrophobicContact CD2-CE2 4.42Å; Y105-F228 AromaticContact CD2-CZ 3.51Å; Y105-F228 HydrophobicContact CD2-CZ 3.51Å; Y105-F228 AromaticContact CE1-CD1 3.26Å; Y105-F228 HydrophobicContact CE1-CD1 3.26Å; Y105-F228 AromaticContact CE1-CD2 3.57Å; Y105-F228 HydrophobicContact CE1-CD2 3.57Å; Y105-F228 AromaticContact CE1-CE1 3.08Å; Y105-F228 HydrophobicContact CE1-CE1 3.08Å; Y105-F228 AromaticContact CE1-CE2 3.36Å; Y105-F228 HydrophobicContact CE1-CE2 3.36Å; Y105-F228 AromaticContact CE1-CG 3.51Å; Y105-F228 HydrophobicContact CE1-CG 3.51Å; Y105-F228 AromaticContact CE1-CZ 3.1Å; Y105-F228 HydrophobicContact CE1-CZ 3.1Å; Y105-F228 AromaticContact CE2-CE1 3.96Å; Y105-F228 HydrophobicContact CE2-CE1 3.96Å; Y105-F228 AromaticContact CE2-CE2 3.82Å; Y105-F228 HydrophobicContact CE2-CE2 3.82Å; Y105-F228 AromaticContact CE2-CZ 3.33Å; Y105-F228 HydrophobicContact CE2-CZ 3.33Å; Y105-F228 HydrophobicContact CG-CD1 4.07Å; Y105-F228 AromaticContact CG-CE1 3.27Å; Y105-F228 HydrophobicContact CG-CE1 3.27Å; Y105-F228 AromaticContact CG-CZ 3.56Å; Y105-F228 HydrophobicContact CG-CZ 3.56Å; Y105-F228 AromaticContact CZ-CD2 3.81Å; Y105-F228 AromaticContact CZ-CE1 3.63Å; Y105-F228 AromaticContact CZ-CE2 3.21Å; Y105-F228 AromaticContact CZ-CZ 3.09Å; Y105-F228 VanDerWaalsContact OH-CE2 3.31Å; Y105-F228 WeakPolarHBondContact OH-CE2 3.47Å; I108-F228 HydrophobicContact CB-CE1 4.41Å; I108-F228 HydrophobicContact CD1-CE1 3.9Å; I108-F228 HydrophobicContact CD1-CZ 3.85Å; I108-F228 HydrophobicContact CG2-CE1 4.29Å; K224-F228 PolarHBondContact O-N 2.84Å; S225-F228 WeakPolarHBondContact O-CB 3.35Å; S225-F228 PolarHBondContact O-N 3.48Å; L226-F228 PolarHBondContact O-N 3.06Å; F228-L230 VanDerWaalsContact C-N 3.33Å; F228-L230 PolarHBondContact O-N 2.95Å; F228-I231 PolarHBondContact O-N 3.42Å; F228-M232 PolarHBondContact O-N 2.88Å; F228-M232 VanDerWaalsContact O-N 3.16Å; F228-D269 HydrophobicContact CD2-CB 3.88Å; F228-D269 HydrophobicContact CE2-CB 3.8Å; F228-D269 WeakPolarHBondContact CE2-OD2 3.36Å; F228-M270 HydrophobicContact CE2-CE 4.47Å |
| 229 | T | 86 | Confident | 86.7 | Confident | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -62.6 | -36.8 | 174.3 | 54.4 | 0 | 0 | 0 | 0 | 113.6 | L109 Q198 S225 L226 M232 L233 | L109-T229 HydrophobicContact CD1-CG2 3.54Å; L109-T229 HydrophobicContact CD2-CG2 3.18Å; L109-T229 HydrophobicContact CG-CG2 3.96Å; Q198-T229 HydrophobicContact CB-CG2 4.2Å; Q198-T229 HydrophobicContact CG-CG2 4.09Å; S225-T229 WeakPolarHBondContact O-CG2 3.37Å; S225-T229 PolarHBondContact O-N 2.86Å; L226-T229 WeakPolarHBondContact CA-OG1 3.35Å; L226-T229 PolarHBondContact O-N 2.9Å; L226-T229 VanDerWaalsContact O-N 3.08Å; L226-T229 PolarHBondContact O-OG1 2.89Å; T229-M232 WeakPolarHBondContact O-CB 3.4Å; T229-M232 PolarHBondContact O-N 2.75Å; T229-L233 WeakPolarHBondContact O-CB 3.43Å; T229-L233 PolarHBondContact O-N 3.31Å |
| 230 | L | 89.9 | Confident | 87.2 | Confident | 72 Ų | 72 | 33.3 Ų | 33.3 | 38% | 0.377 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -68.3 | -39.9 | -179.9 | -69.4 | 174.2 | 0 | 0 | 0 | 111.2 | T195 L226 C227 F228 M232 L233 I234 | T195-L230 HydrophobicContact CG2-CD2 4.35Å; L226-L230 HydrophobicContact CD1-CG 4.44Å; L226-L230 HydrophobicContact CG-CD1 4.14Å; L226-L230 HydrophobicContact CG-CG 4.34Å; L226-L230 WeakPolarHBondContact O-CG 3.49Å; L226-L230 PolarHBondContact O-N 3.27Å; C227-L230 PolarHBondContact O-N 2.95Å; F228-L230 VanDerWaalsContact C-N 3.33Å; F228-L230 PolarHBondContact O-N 2.95Å; L230-M232 VanDerWaalsContact C-N 3.34Å; L230-M232 PolarHBondContact O-N 3.06Å; L230-L233 PolarHBondContact O-N 2.69Å; L230-I234 WeakPolarHBondContact O-CB 3.24Å; L230-I234 VanDerWaalsContact O-CG1 3.26Å; L230-I234 WeakPolarHBondContact O-CG1 3.27Å; L230-I234 PolarHBondContact O-N 3.14Å |
| 231 | I | 88.5 | Confident | 87.8 | Confident | 40 Ų | 40 | 34 Ų | 34 | 21% | 0.205 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -59.8 | -46.9 | 173.3 | -67.3 | 169.4 | 0 | 0 | 0 | 109.9 | C227 F228 L233 I234 C235 D269 T272 | C227-I231 WeakPolarHBondContact O-CG1 3.48Å; C227-I231 PolarHBondContact O-N 3.33Å; F228-I231 PolarHBondContact O-N 3.42Å; I231-L233 VanDerWaalsContact C-N 3.34Å; I231-L233 PolarHBondContact O-N 3.32Å; I231-I234 PolarHBondContact O-N 3.26Å; I231-C235 WeakPolarHBondContact O-CB 3.42Å; I231-C235 PolarHBondContact O-N 2.98Å; I231-C235 PolarHBondContact O-SG 3.47Å; I231-D269 HydrophobicContact CD1-CB 4.31Å; I231-D269 HydrophobicContact CG2-CB 4.49Å; I231-T272 HydrophobicContact CD1-CG2 3.63Å |
| 232 | M | 85.6 | Confident | 88.2 | Confident | 0 Ų | 0 | 34.4 Ų | 34.4 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -58.1 | -45.3 | 175.6 | -176.9 | -169.3 | 65.7 | 0 | 0 | 111.9 | F102 Y105 L109 A191 F228 T229 L230 C235 Y236 | F102-M232 HydrophobicContact CD2-CG 4.32Å; F102-M232 HydrophobicContact CD2-SD 3.78Å; F102-M232 HydrophobicContact CE2-SD 3.81Å; Y105-M232 HydrophobicContact CD1-CB 3.96Å; Y105-M232 HydrophobicContact CD1-CG 4.3Å; Y105-M232 HydrophobicContact CD1-SD 4.15Å; Y105-M232 HydrophobicContact CE1-CB 4.03Å; Y105-M232 HydrophobicContact CG-SD 4.46Å; L109-M232 HydrophobicContact CD1-CE 4.35Å; A191-M232 HydrophobicContact CB-CE 3.73Å; F228-M232 PolarHBondContact O-N 2.88Å; F228-M232 VanDerWaalsContact O-N 3.16Å; T229-M232 WeakPolarHBondContact O-CB 3.4Å; T229-M232 PolarHBondContact O-N 2.75Å; L230-M232 VanDerWaalsContact C-N 3.34Å; L230-M232 PolarHBondContact O-N 3.06Å; M232-C235 PolarHBondContact O-N 3.37Å; M232-Y236 HydrophobicContact CB-CD2 4.48Å; M232-Y236 HydrophobicContact CG-CD2 3.47Å; M232-Y236 VanDerWaalsContact CG-CD2 3.47Å; M232-Y236 HydrophobicContact CG-CE2 3.8Å; M232-Y236 HydrophobicContact CG-CG 4.44Å; M232-Y236 VanDerWaalsContact O-CB 3.31Å; M232-Y236 WeakPolarHBondContact O-CB 3.44Å; M232-Y236 PolarHBondContact O-N 3.38Å |
| 233 | L | 90.1 | Very high | 88.2 | Confident | 53 Ų | 53 | 34.2 Ų | 34.2 | 28% | 0.277 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -62.5 | -48.3 | -179.8 | -171.5 | 146.3 | 0 | 0 | 0 | 111.3 | T195 T229 L230 I231 V237 P238 | T195-L233 HydrophobicContact CG2-CD1 4.06Å; T229-L233 WeakPolarHBondContact O-CB 3.43Å; T229-L233 PolarHBondContact O-N 3.31Å; L230-L233 PolarHBondContact O-N 2.69Å; I231-L233 VanDerWaalsContact C-N 3.34Å; I231-L233 PolarHBondContact O-N 3.32Å; L233-V237 HydrophobicContact CG-CG2 4.07Å; L233-V237 VanDerWaalsContact O-CB 3.24Å; L233-V237 WeakPolarHBondContact O-CB 3.44Å; L233-V237 WeakPolarHBondContact O-CG2 3.41Å; L233-V237 PolarHBondContact O-N 2.98Å; L233-V237 VanDerWaalsContact O-N 3.11Å; L233-P238 WeakPolarHBondContact O-CD 3.03Å |
| 234 | I | 91.1 | Very high | 88.2 | Confident | 117 Ų | 117 | 32.3 Ų | 32.3 | 60% | 0.6 | 18% | 0.176 | S | C | * | . | H | α-helix | trans | -67.4 | -37.9 | -179.1 | -65.9 | 165.1 | 0 | 0 | 0 | 111.3 | L230 I231 P238 | L230-I234 WeakPolarHBondContact O-CB 3.24Å; L230-I234 VanDerWaalsContact O-CG1 3.26Å; L230-I234 WeakPolarHBondContact O-CG1 3.27Å; L230-I234 PolarHBondContact O-N 3.14Å; I231-I234 PolarHBondContact O-N 3.26Å; I234-P238 WeakPolarHBondContact O-CD 3.24Å; I234-P238 VanDerWaalsContact O-CG 3.28Å; I234-P238 WeakPolarHBondContact O-CG 3.45Å |
| 235 | C | 90.4 | Very high | 88.1 | Confident | 11 Ų | 11 | 35.8 Ų | 35.8 | 7% | 0.074 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -79.3 | -38.1 | -176.8 | -64.8 | 0 | 0 | 0 | 0 | 112.5 | I231 M232 T263 | I231-C235 WeakPolarHBondContact O-CB 3.42Å; I231-C235 PolarHBondContact O-N 2.98Å; I231-C235 PolarHBondContact O-SG 3.47Å; M232-C235 PolarHBondContact O-N 3.37Å; C235-T263 WeakPolarHBondContact O-CA 3.42Å; C235-T263 WeakPolarHBondContact O-CG2 3.47Å |
| 236 | Y | 91.1 | Very high | 87.6 | Confident | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -102.8 | -37.9 | -169.1 | -60.5 | -20.2 | 0 | 0 | 0 | 114.3 | M98 S101 F102 M232 Y239 H240 T263 N266 | M98-Y236 HydrophobicContact CG-CD1 4.19Å; M98-Y236 HydrophobicContact CG-CE1 3.99Å; S101-Y236 WeakPolarHBondContact CB-OH 3.47Å; F102-Y236 HydrophobicContact CB-CD2 4.47Å; F102-Y236 HydrophobicContact CB-CE2 4.03Å; F102-Y236 AromaticContact CD2-CD2 3.94Å; F102-Y236 HydrophobicContact CD2-CD2 3.94Å; F102-Y236 HydrophobicContact CD2-CE2 4.19Å; M232-Y236 HydrophobicContact CB-CD2 4.48Å; M232-Y236 HydrophobicContact CG-CD2 3.47Å; M232-Y236 VanDerWaalsContact CG-CD2 3.47Å; M232-Y236 HydrophobicContact CG-CE2 3.8Å; M232-Y236 HydrophobicContact CG-CG 4.44Å; M232-Y236 VanDerWaalsContact O-CB 3.31Å; M232-Y236 WeakPolarHBondContact O-CB 3.44Å; M232-Y236 PolarHBondContact O-N 3.38Å; Y236-Y239 PolarHBondContact O-N 3.07Å; Y236-H240 PolarHBondContact O-CD2 3.35Å; Y236-H240 VanDerWaalsContact O-CD2 3.28Å; Y236-H240 PolarHBondContact O-N 3Å; Y236-T263 HydrophobicContact CD1-CG2 4.14Å; Y236-N266 HydrophobicContact CE1-CB 4Å; Y236-N266 WeakPolarHBondContact OH-CB 3.46Å; Y236-N266 PolarHBondContact OH-ND2 3.21Å; Y236-N266 PolarHBondContact OH-OD1 3.18Å |
| 237 | V | 91.8 | Very high | 86.8 | Confident | 24 Ų | 24 | 35 Ų | 35 | 15% | 0.145 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.2 | -43.2 | -175 | 176.6 | 0 | 0 | 0 | 0 | 112.5 | I188 A191 L233 Y239 H240 S241 | I188-V237 HydrophobicContact CG1-CG1 4.49Å; I188-V237 HydrophobicContact CG2-CG1 4.46Å; A191-V237 HydrophobicContact CB-CG2 4.11Å; L233-V237 HydrophobicContact CG-CG2 4.07Å; L233-V237 VanDerWaalsContact O-CB 3.24Å; L233-V237 WeakPolarHBondContact O-CB 3.44Å; L233-V237 WeakPolarHBondContact O-CG2 3.41Å; L233-V237 PolarHBondContact O-N 2.98Å; L233-V237 VanDerWaalsContact O-N 3.11Å; V237-Y239 PolarHBondContact O-N 3.43Å; V237-H240 PolarHBondContact O-N 3.15Å; V237-S241 WeakPolarHBondContact O-CB 3.49Å; V237-S241 PolarHBondContact O-N 3.31Å; V237-S241 PolarHBondContact O-OG 3.08Å |
| 238 | P | 92.8 | Very high | 85.7 | Confident | 59 Ų | 59 | 35.5 Ų | 35.5 | 38% | 0.383 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -59.9 | -45.4 | 178.6 | -26.3 | 36.7 | 0 | 0 | 0 | 112.7 | L233 I234 S241 F242 L259 | L233-P238 WeakPolarHBondContact O-CD 3.03Å; I234-P238 WeakPolarHBondContact O-CD 3.24Å; I234-P238 VanDerWaalsContact O-CG 3.28Å; I234-P238 WeakPolarHBondContact O-CG 3.45Å; P238-S241 PolarHBondContact O-N 3.24Å; P238-F242 WeakPolarHBondContact O-CB 3.46Å; P238-F242 PolarHBondContact O-N 3.45Å; P238-L259 HydrophobicContact CB-CD2 4.44Å |
| 239 | Y | 92.1 | Very high | 85.4 | Confident | 2 Ų | 2 | 40.5 Ų | 40.5 | 1% | 0.008 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60.8 | -53.4 | 177.2 | 170.6 | -113.6 | 0 | 0 | 0 | 111.6 | M98 Y236 V237 S241 F242 R243 N256 L259 L260 T263 | M98-Y239 HydrophobicContact CE-CE1 3.94Å; M98-Y239 HydrophobicContact SD-CD1 3.75Å; M98-Y239 HydrophobicContact SD-CE1 3.66Å; Y236-Y239 PolarHBondContact O-N 3.07Å; V237-Y239 PolarHBondContact O-N 3.43Å; Y239-S241 VanDerWaalsContact C-N 3.31Å; Y239-S241 PolarHBondContact O-N 3.38Å; Y239-F242 PolarHBondContact O-N 3.22Å; Y239-R243 VanDerWaalsContact O-CB 3.25Å; Y239-R243 WeakPolarHBondContact O-CB 3.39Å; Y239-R243 PolarHBondContact O-N 2.86Å; Y239-R243 WeakPolarHBondContact OH-CD 3.35Å; Y239-R243 PolarHBondContact OH-NE 3.38Å; Y239-N256 WeakPolarHBondContact CE2-OD1 3.25Å; Y239-L259 HydrophobicContact CD2-CB 4.04Å; Y239-L260 HydrophobicContact CD2-CB 4.02Å; Y239-L260 HydrophobicContact CE1-CD1 3.99Å; Y239-L260 HydrophobicContact CE2-CB 3.7Å; Y239-L260 HydrophobicContact CE2-CD1 4.05Å; Y239-L260 HydrophobicContact CE2-CG 4.39Å; Y239-T263 HydrophobicContact CD1-CG2 3.84Å; Y239-T263 HydrophobicContact CG-CG2 3.83Å |
| 240 | H | 90.8 | Very high | 84.6 | Confident | 1 Ų | 1 | 44.6 Ų | 44.6 | 1% | 0.005 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -65.3 | -34.3 | -178.9 | -78.6 | -70.7 | 0 | 0 | 0 | 112.8 | Y99 S184 V187 I188 Y236 V237 R243 L244 | Y99-H240 AromaticContact CE1-CE1 3.96Å; S184-H240 WeakPolarHBondContact CA-ND1 3.26Å; S184-H240 WeakPolarHBondContact CB-ND1 3.34Å; S184-H240 PolarHBondContact OG-ND1 2.77Å; V187-H240 VanDerWaalsContact CG1-CD2 3.4Å; V187-H240 WeakPolarHBondContact CG1-CD2 3.29Å; I188-H240 HydrophobicContact CD1-CB 3.95Å; I188-H240 HydrophobicContact CG1-CB 3.8Å; Y236-H240 PolarHBondContact O-CD2 3.35Å; Y236-H240 VanDerWaalsContact O-CD2 3.28Å; Y236-H240 PolarHBondContact O-N 3Å; V237-H240 PolarHBondContact O-N 3.15Å; H240-R243 PolarHBondContact O-N 2.84Å; H240-L244 WeakPolarHBondContact O-CG 3.47Å; H240-L244 PolarHBondContact O-N 3.01Å; H240-L244 VanDerWaalsContact O-N 3.17Å |
| 241 | S | 90.8 | Very high | 83.8 | Confident | 41 Ų | 41 | 50 Ų | 50 | 29% | 0.287 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -65.8 | -44.3 | 176.1 | -58.7 | 0 | 0 | 0 | 0 | 111.1 | V237 P238 Y239 R243 L244 H245 | V237-S241 WeakPolarHBondContact O-CB 3.49Å; V237-S241 PolarHBondContact O-N 3.31Å; V237-S241 PolarHBondContact O-OG 3.08Å; P238-S241 PolarHBondContact O-N 3.24Å; Y239-S241 VanDerWaalsContact C-N 3.31Å; Y239-S241 PolarHBondContact O-N 3.38Å; S241-R243 VanDerWaalsContact C-N 3.34Å; S241-L244 PolarHBondContact O-N 2.95Å; S241-H245 PolarHBondContact O-ND1 2.92Å |
| 242 | F | 89.1 | Confident | 83.5 | Confident | 42 Ų | 42 | 50.1 Ų | 50.1 | 18% | 0.184 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -65.1 | -41.1 | 174.9 | -175.4 | -100.6 | 0 | 0 | 0 | 111.7 | P238 Y239 L244 H245 Y246 L252 I255 N256 L259 | P238-F242 WeakPolarHBondContact O-CB 3.46Å; P238-F242 PolarHBondContact O-N 3.45Å; Y239-F242 PolarHBondContact O-N 3.22Å; F242-L244 PolarHBondContact O-N 3.25Å; F242-H245 WeakPolarHBondContact O-CA 3.24Å; F242-H245 WeakPolarHBondContact O-CB 3.15Å; F242-H245 PolarHBondContact O-N 2.93Å; F242-Y246 HydrophobicContact CE1-CD2 4.37Å; F242-Y246 HydrophobicContact CE1-CG 4.49Å; F242-Y246 PolarHBondContact O-N 2.9Å; F242-L252 HydrophobicContact CE1-CB 4.43Å; F242-L252 HydrophobicContact CE2-CD2 4.45Å; F242-L252 HydrophobicContact CZ-CB 3.95Å; F242-L252 HydrophobicContact CZ-CD1 4.28Å; F242-L252 HydrophobicContact CZ-CD2 4.01Å; F242-L252 HydrophobicContact CZ-CG 4.31Å; F242-I255 HydrophobicContact CD2-CG2 4.41Å; F242-I255 HydrophobicContact CE1-CB 4.14Å; F242-I255 HydrophobicContact CE1-CG2 3.95Å; F242-I255 HydrophobicContact CE2-CB 4.43Å; F242-I255 HydrophobicContact CE2-CG2 3.74Å; F242-I255 HydrophobicContact CZ-CB 3.71Å; F242-I255 HydrophobicContact CZ-CG2 3.45Å; F242-I255 VanDerWaalsContact CZ-CG2 3.45Å; F242-N256 HydrophobicContact CD1-CB 4.4Å; F242-N256 HydrophobicContact CE1-CB 3.98Å; F242-L259 HydrophobicContact CB-CD1 3.31Å; F242-L259 HydrophobicContact CD1-CD1 3.59Å; F242-L259 HydrophobicContact CD2-CD1 3.87Å; F242-L259 HydrophobicContact CE1-CD1 4.32Å; F242-L259 HydrophobicContact CG-CD1 3.3Å |
| 243 | R | 84.6 | Confident | 83.2 | Confident | 8 Ų | 8 | 51.5 Ų | 51.5 | 3% | 0.03 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -58.8 | -32.5 | 179.1 | -164 | 170.9 | -169 | -99 | -3.8 | 112.9 | N180 S184 Y239 H240 S241 H245 Y246 I247 | N180-R243 VanDerWaalsContact CG-NH2 3.35Å; N180-R243 PolarHBondContact OD1-NH1 3.34Å; N180-R243 PolarHBondContact OD1-NH2 2.91Å; S184-R243 PolarHBondContact OG-NH1 2.95Å; Y239-R243 VanDerWaalsContact O-CB 3.25Å; Y239-R243 WeakPolarHBondContact O-CB 3.39Å; Y239-R243 PolarHBondContact O-N 2.86Å; Y239-R243 WeakPolarHBondContact OH-CD 3.35Å; Y239-R243 PolarHBondContact OH-NE 3.38Å; H240-R243 PolarHBondContact O-N 2.84Å; S241-R243 VanDerWaalsContact C-N 3.34Å; R243-H245 VanDerWaalsContact C-N 3.26Å; R243-H245 PolarHBondContact O-N 3.46Å; R243-Y246 PolarHBondContact O-N 2.73Å; R243-I247 WeakPolarHBondContact O-CD1 3.09Å; R243-I247 VanDerWaalsContact O-CG1 3.29Å; R243-I247 WeakPolarHBondContact O-CG1 3.07Å |
| 244 | L | 84.5 | Confident | 82.8 | Confident | 35 Ų | 35 | 51.3 Ų | 51.3 | 18% | 0.183 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -64.4 | -28.9 | 173.4 | -68.2 | 170.4 | 0 | 0 | 0 | 113.2 | Y181 I188 H240 S241 F242 | Y181-L244 HydrophobicContact CD1-CD2 3.36Å; Y181-L244 HydrophobicContact CE1-CB 4.22Å; Y181-L244 HydrophobicContact CE1-CD2 3.81Å; Y181-L244 VanDerWaalsContact CE1-O 3.27Å; Y181-L244 WeakPolarHBondContact CE1-O 3.47Å; Y181-L244 HydrophobicContact CG-CD2 4.24Å; Y181-L244 VanDerWaalsContact CZ-O 3.29Å; Y181-L244 PolarHBondContact OH-O 2.95Å; I188-L244 HydrophobicContact CD1-CD1 3.71Å; H240-L244 WeakPolarHBondContact O-CG 3.47Å; H240-L244 PolarHBondContact O-N 3.01Å; H240-L244 VanDerWaalsContact O-N 3.17Å; S241-L244 PolarHBondContact O-N 2.95Å; F242-L244 PolarHBondContact O-N 3.25Å |
| 245 | H | 80.1 | Confident | 82.6 | Confident | 148 Ų | 148 | 49.9 Ų | 49.9 | 69% | 0.685 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -91.4 | -30.2 | 178.7 | -61.4 | 84.6 | 0 | 0 | 0 | 112.2 | S241 F242 R243 I247 | S241-H245 PolarHBondContact O-ND1 2.92Å; F242-H245 WeakPolarHBondContact O-CA 3.24Å; F242-H245 WeakPolarHBondContact O-CB 3.15Å; F242-H245 PolarHBondContact O-N 2.93Å; R243-H245 VanDerWaalsContact C-N 3.26Å; R243-H245 PolarHBondContact O-N 3.46Å; H245-I247 VanDerWaalsContact C-N 3.31Å; H245-I247 PolarHBondContact O-N 3.4Å |
| 246 | Y | 74.7 | Confident | 82.5 | Confident | 8 Ų | 8 | 49.5 Ų | 49.5 | 3% | 0.031 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -64.4 | -27.3 | -178.6 | 174.2 | -114 | 0 | 0 | 0 | 114.3 | A170 M173 F242 R243 G248 Q249 L252 E253 N256 | A170-Y246 WeakPolarHBondContact CB-OH 3.41Å; M173-Y246 HydrophobicContact CE-CD1 4Å; M173-Y246 HydrophobicContact CE-CE1 3.64Å; F242-Y246 HydrophobicContact CE1-CD2 4.37Å; F242-Y246 HydrophobicContact CE1-CG 4.49Å; F242-Y246 PolarHBondContact O-N 2.9Å; R243-Y246 PolarHBondContact O-N 2.73Å; Y246-G248 PolarHBondContact O-N 3.04Å; Y246-Q249 WeakPolarHBondContact CD2-O 2.89Å; Y246-Q249 VanDerWaalsContact CE2-O 3.25Å; Y246-Q249 WeakPolarHBondContact CE2-O 3.18Å; Y246-Q249 PolarHBondContact O-N 3.25Å; Y246-L252 HydrophobicContact CD2-CB 3.73Å; Y246-L252 HydrophobicContact CE2-CB 4.07Å; Y246-E253 HydrophobicContact CE2-CB 4.46Å; Y246-N256 HydrophobicContact CD1-CB 4.5Å; Y246-N256 HydrophobicContact CD2-CB 4.35Å; Y246-N256 HydrophobicContact CE1-CB 4.42Å; Y246-N256 HydrophobicContact CE2-CB 4.3Å; Y246-N256 HydrophobicContact CG-CB 4.46Å |
| 247 | I | 68.9 | Low | 82.3 | Confident | 14 Ų | 14 | 49.8 Ų | 49.8 | 7% | 0.072 | 28% | 0.275 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.8 | 87.8 | -170.1 | -55.5 | 155.6 | 0 | 0 | 0 | 111.9 | K177 N180 Y181 R243 H245 | K177-I247 HydrophobicContact CB-CG2 3.91Å; K177-I247 HydrophobicContact CD-CG2 3.61Å; K177-I247 HydrophobicContact CG-CB 4.48Å; K177-I247 HydrophobicContact CG-CG2 3.48Å; K177-I247 VanDerWaalsContact CG-CG2 3.48Å; K177-I247 PolarHBondContact NZ-O 3.21Å; N180-I247 HydrophobicContact CB-CD1 3.77Å; Y181-I247 HydrophobicContact CD2-CD1 3.65Å; Y181-I247 HydrophobicContact CE1-CD1 4.4Å; Y181-I247 HydrophobicContact CE2-CB 4.07Å; Y181-I247 HydrophobicContact CE2-CD1 3.41Å; Y181-I247 VanDerWaalsContact CE2-CD1 3.41Å; Y181-I247 HydrophobicContact CE2-CG1 4.35Å; Y181-I247 HydrophobicContact CE2-CG2 4.37Å; Y181-I247 HydrophobicContact CG-CD1 4.22Å; R243-I247 WeakPolarHBondContact O-CD1 3.09Å; R243-I247 VanDerWaalsContact O-CG1 3.29Å; R243-I247 WeakPolarHBondContact O-CG1 3.07Å; H245-I247 VanDerWaalsContact C-N 3.31Å; H245-I247 PolarHBondContact O-N 3.4Å |
| 248 | G | 65.3 | Low | 82.3 | Confident | 61 Ų | 61 | 50.4 Ų | 50.4 | 63% | 0.629 | 28% | 0.278 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 132.7 | -0.5 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | Y246 | Y246-G248 PolarHBondContact O-N 3.04Š|
| 249 | Q | 75.3 | Confident | 82.2 | Confident | 114 Ų | 114 | 49.1 Ų | 49.1 | 53% | 0.533 | 27% | 0.268 | S | S | . | . | trans | -125.7 | 87.9 | -179.3 | -67.5 | -161.8 | -11.1 | 0 | 0 | 111.3 | Y246 E251 L252 | Y246-Q249 WeakPolarHBondContact CD2-O 2.89Å; Y246-Q249 VanDerWaalsContact CE2-O 3.25Å; Y246-Q249 WeakPolarHBondContact CE2-O 3.18Å; Y246-Q249 PolarHBondContact O-N 3.25Å; Q249-E251 PolarHBondContact O-N 3.17Å; Q249-L252 HydrophobicContact CB-CD1 3.86Å; Q249-L252 HydrophobicContact CB-CG 4.46Å; Q249-L252 PolarHBondContact O-N 2.98Å | ||
| 250 | P | 68.8 | Low | 82.2 | Confident | 86 Ų | 86 | 49 Ų | 49 | 56% | 0.558 | 27% | 0.268 | S | S | * | . | G | 310 helix | trans | -63.4 | -23.6 | -177.5 | 25.7 | -33.8 | 0 | 0 | 0 | 113.2 | A170 L252 E253 | A170-P250 HydrophobicContact CB-CB 4.18Å; P250-L252 PolarHBondContact O-N 3.24Å; P250-L252 VanDerWaalsContact O-N 3.11Å; P250-E253 WeakPolarHBondContact O-CB 3.49Å; P250-E253 PolarHBondContact O-N 2.64Å; P250-E253 VanDerWaalsContact O-N 3.17Å |
| 251 | E | 74 | Confident | 82.3 | Confident | 185 Ų | 185 | 49 Ų | 49 | 86% | 0.864 | 27% | 0.268 | S | S | * | . | G | 310 helix | trans | -61.7 | -19 | 178.1 | -59.7 | -177.4 | 172.8 | 0 | 0 | 113.8 | Q249 | Q249-E251 PolarHBondContact O-N 3.17Š|
| 252 | L | 81.1 | Confident | 82.5 | Confident | 43 Ų | 43 | 50.1 Ų | 50.1 | 23% | 0.225 | 27% | 0.27 | C | S | . | . | G | 310 helix | trans | -93.8 | 6.2 | -178.5 | -74 | 167.9 | 0 | 0 | 0 | 113.5 | F242 Y246 Q249 P250 P254 I255 N256 | F242-L252 HydrophobicContact CE1-CB 4.43Å; F242-L252 HydrophobicContact CE2-CD2 4.45Å; F242-L252 HydrophobicContact CZ-CB 3.95Å; F242-L252 HydrophobicContact CZ-CD1 4.28Å; F242-L252 HydrophobicContact CZ-CD2 4.01Å; F242-L252 HydrophobicContact CZ-CG 4.31Å; Y246-L252 HydrophobicContact CD2-CB 3.73Å; Y246-L252 HydrophobicContact CE2-CB 4.07Å; Q249-L252 HydrophobicContact CB-CD1 3.86Å; Q249-L252 HydrophobicContact CB-CG 4.46Å; Q249-L252 PolarHBondContact O-N 2.98Å; P250-L252 PolarHBondContact O-N 3.24Å; P250-L252 VanDerWaalsContact O-N 3.11Å; L252-P254 VanDerWaalsContact C-CD 3.49Å; L252-I255 HydrophobicContact CD2-CD1 3.81Å; L252-I255 PolarHBondContact O-N 2.89Å; L252-I255 VanDerWaalsContact O-N 3.13Å; L252-N256 PolarHBondContact O-N 3.45Å |
| 253 | E | 79.3 | Confident | 82.7 | Confident | 30 Ų | 30 | 48.1 Ų | 48.1 | 14% | 0.14 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -53.4 | -43.5 | -179.7 | -178.4 | 169.4 | -135.5 | 0 | 0 | 113.3 | H168 F169 A170 Y246 P250 I255 N256 E257 | H168-E253 WeakPolarHBondContact CA-OE1 3.17Å; H168-E253 IonicContact CE1-OE2 3.76Å; H168-E253 IonicContact ND1-OE1 3.81Å; H168-E253 IonicContact ND1-OE2 2.79Å; H168-E253 PolarHBondContact ND1-OE2 3.31Å; H168-E253 VanDerWaalsContact ND1-OE2 3.09Å; F169-E253 PolarHBondContact N-OE1 2.88Å; A170-E253 PolarHBondContact N-OE1 3.35Å; Y246-E253 HydrophobicContact CE2-CB 4.46Å; P250-E253 WeakPolarHBondContact O-CB 3.49Å; P250-E253 PolarHBondContact O-N 2.64Å; P250-E253 VanDerWaalsContact O-N 3.17Å; E253-I255 VanDerWaalsContact C-N 3.33Å; E253-I255 PolarHBondContact O-N 3.46Å; E253-N256 WeakPolarHBondContact O-CB 3.25Å; E253-N256 PolarHBondContact O-N 2.89Å; E253-E257 PolarHBondContact O-N 3.16Å |
| 254 | P | 83.3 | Confident | 83.2 | Confident | 49 Ų | 49 | 47.7 Ų | 47.7 | 32% | 0.318 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -59.9 | -41.7 | 177.3 | -24.5 | 34.9 | 0 | 0 | 0 | 112.7 | F16 L252 N256 E257 V258 | F16-P254 HydrophobicContact CD1-CB 4.37Å; F16-P254 HydrophobicContact CD2-CB 3.84Å; F16-P254 HydrophobicContact CE1-CB 4.39Å; F16-P254 HydrophobicContact CE2-CB 3.86Å; F16-P254 WeakPolarHBondContact CE2-O 3.14Å; F16-P254 HydrophobicContact CG-CB 4.1Å; F16-P254 HydrophobicContact CZ-CB 4.11Å; L252-P254 VanDerWaalsContact C-CD 3.49Å; P254-N256 VanDerWaalsContact C-N 3.35Å; P254-N256 PolarHBondContact O-N 3.29Å; P254-E257 PolarHBondContact O-N 3.41Å; P254-V258 WeakPolarHBondContact O-CG2 3.08Å; P254-V258 PolarHBondContact O-N 2.75Å |
| 255 | I | 86.2 | Confident | 83.7 | Confident | 86 Ų | 86 | 48.7 Ų | 48.7 | 44% | 0.441 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -68.1 | -39.4 | 179.5 | -57.8 | -178.4 | 0 | 0 | 0 | 110.4 | F242 L252 E253 E257 V258 L259 | F242-I255 HydrophobicContact CD2-CG2 4.41Å; F242-I255 HydrophobicContact CE1-CB 4.14Å; F242-I255 HydrophobicContact CE1-CG2 3.95Å; F242-I255 HydrophobicContact CE2-CB 4.43Å; F242-I255 HydrophobicContact CE2-CG2 3.74Å; F242-I255 HydrophobicContact CZ-CB 3.71Å; F242-I255 HydrophobicContact CZ-CG2 3.45Å; F242-I255 VanDerWaalsContact CZ-CG2 3.45Å; L252-I255 HydrophobicContact CD2-CD1 3.81Å; L252-I255 PolarHBondContact O-N 2.89Å; L252-I255 VanDerWaalsContact O-N 3.13Å; E253-I255 VanDerWaalsContact C-N 3.33Å; E253-I255 PolarHBondContact O-N 3.46Å; I255-E257 VanDerWaalsContact C-N 3.34Å; I255-E257 PolarHBondContact O-N 2.87Å; I255-V258 PolarHBondContact O-N 3Å; I255-L259 HydrophobicContact CG2-CD1 4.12Å; I255-L259 HydrophobicContact CG2-CG 4.44Å; I255-L259 WeakPolarHBondContact O-CG 3.45Å; I255-L259 PolarHBondContact O-N 2.9Å |
| 256 | N | 87.3 | Confident | 84.3 | Confident | 4 Ų | 4 | 41.6 Ų | 41.6 | 2% | 0.021 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -57.6 | -47 | 175.1 | 176.9 | 80 | 0 | 0 | 0 | 111.4 | Y239 F242 Y246 L252 E253 P254 L259 L260 | Y239-N256 WeakPolarHBondContact CE2-OD1 3.25Å; F242-N256 HydrophobicContact CD1-CB 4.4Å; F242-N256 HydrophobicContact CE1-CB 3.98Å; Y246-N256 HydrophobicContact CD1-CB 4.5Å; Y246-N256 HydrophobicContact CD2-CB 4.35Å; Y246-N256 HydrophobicContact CE1-CB 4.42Å; Y246-N256 HydrophobicContact CE2-CB 4.3Å; Y246-N256 HydrophobicContact CG-CB 4.46Å; L252-N256 PolarHBondContact O-N 3.45Å; E253-N256 WeakPolarHBondContact O-CB 3.25Å; E253-N256 PolarHBondContact O-N 2.89Å; P254-N256 VanDerWaalsContact C-N 3.35Å; P254-N256 PolarHBondContact O-N 3.29Å; N256-L259 PolarHBondContact O-N 2.03Å; N256-L260 VanDerWaalsContact O-CB 3.3Å; N256-L260 WeakPolarHBondContact O-CB 3.18Å; N256-L260 PolarHBondContact O-N 3.38Å |
| 257 | E | 87.6 | Confident | 85.1 | Confident | 5 Ų | 5 | 41.3 Ų | 41.3 | 2% | 0.023 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -66.7 | -38.4 | 179.4 | -73.4 | -57.7 | 124.8 | 0 | 0 | 112.7 | F16 L20 E253 P254 I255 L260 S261 | F16-E257 HydrophobicContact CE2-CB 3.96Å; F16-E257 HydrophobicContact CZ-CB 3.58Å; F16-E257 HydrophobicContact CZ-CG 4.19Å; L20-E257 HydrophobicContact CD1-CB 4.32Å; E253-E257 PolarHBondContact O-N 3.16Å; P254-E257 PolarHBondContact O-N 3.41Å; I255-E257 VanDerWaalsContact C-N 3.34Å; I255-E257 PolarHBondContact O-N 2.87Å; E257-L260 PolarHBondContact O-N 3.31Å; E257-S261 WeakPolarHBondContact O-CB 3.09Å; E257-S261 PolarHBondContact O-N 3Å |
| 258 | V | 91.3 | Very high | 86.1 | Confident | 37 Ų | 37 | 42.6 Ų | 42.6 | 22% | 0.224 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60 | -50.5 | 172 | 175.7 | 0 | 0 | 0 | 0 | 110 | F16 L20 I23 P254 I255 L260 S261 L262 | F16-V258 HydrophobicContact CD2-CG2 3.79Å; F16-V258 HydrophobicContact CE2-CG2 3.68Å; L20-V258 HydrophobicContact CD2-CG2 4.43Å; I23-V258 HydrophobicContact CD1-CG1 4.24Å; P254-V258 WeakPolarHBondContact O-CG2 3.08Å; P254-V258 PolarHBondContact O-N 2.75Å; I255-V258 PolarHBondContact O-N 3Å; V258-L260 VanDerWaalsContact C-N 3.32Å; V258-L260 PolarHBondContact O-N 2.85Å; V258-S261 WeakPolarHBondContact O-CB 3.24Å; V258-S261 PolarHBondContact O-N 2.88Å; V258-S261 VanDerWaalsContact O-N 3.11Å; V258-S261 PolarHBondContact O-OG 3.46Å; V258-L262 WeakPolarHBondContact O-CG 3.28Å; V258-L262 PolarHBondContact O-N 2.97Å |
| 259 | L | 92 | Very high | 87.1 | Confident | 32 Ų | 32 | 39.7 Ų | 39.7 | 17% | 0.168 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.8 | -37.7 | 179.8 | -69.4 | 174.9 | 0 | 0 | 0 | 112.5 | P238 Y239 F242 I255 N256 S261 L262 T263 | P238-L259 HydrophobicContact CB-CD2 4.44Å; Y239-L259 HydrophobicContact CD2-CB 4.04Å; F242-L259 HydrophobicContact CB-CD1 3.31Å; F242-L259 HydrophobicContact CD1-CD1 3.59Å; F242-L259 HydrophobicContact CD2-CD1 3.87Å; F242-L259 HydrophobicContact CE1-CD1 4.32Å; F242-L259 HydrophobicContact CG-CD1 3.3Å; I255-L259 HydrophobicContact CG2-CD1 4.12Å; I255-L259 HydrophobicContact CG2-CG 4.44Å; I255-L259 WeakPolarHBondContact O-CG 3.45Å; I255-L259 PolarHBondContact O-N 2.9Å; N256-L259 PolarHBondContact O-N 2.03Å; L259-S261 VanDerWaalsContact C-N 3.33Å; L259-L262 HydrophobicContact CD2-CD1 4.1Å; L259-L262 WeakPolarHBondContact O-CB 3.49Å; L259-L262 PolarHBondContact O-N 3.32Å; L259-T263 PolarHBondContact O-N 2.96Å |
| 260 | L | 91.9 | Very high | 87.5 | Confident | 1 Ų | 1 | 34.4 Ų | 34.4 | 1% | 0.005 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -61.3 | -43.3 | 172.6 | 178.5 | 59.7 | 0 | 0 | 0 | 110.7 | I94 Y239 N256 E257 V258 L262 T263 | I94-L260 HydrophobicContact CD1-CD1 4.21Å; I94-L260 HydrophobicContact CD1-CD2 4.28Å; I94-L260 HydrophobicContact CD1-CG 3.8Å; I94-L260 HydrophobicContact CG1-CD1 4.19Å; I94-L260 HydrophobicContact CG1-CG 4.31Å; I94-L260 HydrophobicContact CG2-CD1 4.43Å; I94-L260 HydrophobicContact CG2-CD2 4.06Å; I94-L260 HydrophobicContact CG2-CG 4.47Å; Y239-L260 HydrophobicContact CD2-CB 4.02Å; Y239-L260 HydrophobicContact CE1-CD1 3.99Å; Y239-L260 HydrophobicContact CE2-CB 3.7Å; Y239-L260 HydrophobicContact CE2-CD1 4.05Å; Y239-L260 HydrophobicContact CE2-CG 4.39Å; N256-L260 VanDerWaalsContact O-CB 3.3Å; N256-L260 WeakPolarHBondContact O-CB 3.18Å; N256-L260 PolarHBondContact O-N 3.38Å; E257-L260 PolarHBondContact O-N 3.31Å; V258-L260 VanDerWaalsContact C-N 3.32Å; V258-L260 PolarHBondContact O-N 2.85Å; L260-L262 VanDerWaalsContact C-N 3.26Å; L260-L262 PolarHBondContact O-N 3.13Å; L260-T263 WeakPolarHBondContact O-CB 3.18Å; L260-T263 WeakPolarHBondContact O-CG2 3.42Å; L260-T263 PolarHBondContact O-N 2.84Å; L260-T263 VanDerWaalsContact O-N 3.13Å; L260-T263 PolarHBondContact O-OG1 3.1Å |
| 261 | S | 93.4 | Very high | 88 | Confident | 0 Ų | 0 | 33.8 Ų | 33.8 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -62.8 | -32.8 | 175.6 | 80.1 | 0 | 0 | 0 | 0 | 112.2 | L20 I23 E257 V258 L259 T263 T264 | L20-S261 WeakPolarHBondContact CD2-OG 3.07Å; I23-S261 WeakPolarHBondContact CD1-OG 3.38Å; I23-S261 WeakPolarHBondContact CG2-OG 3.35Å; E257-S261 WeakPolarHBondContact O-CB 3.09Å; E257-S261 PolarHBondContact O-N 3Å; V258-S261 WeakPolarHBondContact O-CB 3.24Å; V258-S261 PolarHBondContact O-N 2.88Å; V258-S261 VanDerWaalsContact O-N 3.11Å; V258-S261 PolarHBondContact O-OG 3.46Å; L259-S261 VanDerWaalsContact C-N 3.33Å; S261-T263 PolarHBondContact O-N 2.89Å; S261-T264 WeakPolarHBondContact O-CB 3.33Å; S261-T264 WeakPolarHBondContact O-CG2 3.04Å; S261-T264 PolarHBondContact O-N 2.85Å; S261-T264 VanDerWaalsContact O-N 3.09Å; S261-T264 PolarHBondContact O-OG1 3.27Å |
| 262 | L | 93.8 | Very high | 88.1 | Confident | 64 Ų | 64 | 26.6 Ų | 26.6 | 34% | 0.335 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -64.4 | -28.7 | 175.7 | -64.2 | -175.4 | 0 | 0 | 0 | 112.9 | I23 V258 L259 L260 T264 F265 | I23-L262 HydrophobicContact CD1-CD2 4.18Å; V258-L262 WeakPolarHBondContact O-CG 3.28Å; V258-L262 PolarHBondContact O-N 2.97Å; L259-L262 HydrophobicContact CD2-CD1 4.1Å; L259-L262 WeakPolarHBondContact O-CB 3.49Å; L259-L262 PolarHBondContact O-N 3.32Å; L260-L262 VanDerWaalsContact C-N 3.26Å; L260-L262 PolarHBondContact O-N 3.13Å; L262-T264 PolarHBondContact O-N 3.21Å; L262-T264 VanDerWaalsContact O-N 3.11Å; L262-F265 HydrophobicContact CD2-CD2 4.07Å; L262-F265 HydrophobicContact CD2-CE2 3.73Å; L262-F265 WeakPolarHBondContact O-CD2 3.28Å; L262-F265 PolarHBondContact O-N 2.82Å |
| 263 | T | 94.6 | Very high | 87.4 | Confident | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -58.5 | -26.6 | 175.1 | 73.1 | 0 | 0 | 0 | 0 | 112.1 | M98 C235 Y236 Y239 L259 L260 S261 F265 N266 | M98-T263 HydrophobicContact SD-CG2 4Å; C235-T263 WeakPolarHBondContact O-CA 3.42Å; C235-T263 WeakPolarHBondContact O-CG2 3.47Å; Y236-T263 HydrophobicContact CD1-CG2 4.14Å; Y239-T263 HydrophobicContact CD1-CG2 3.84Å; Y239-T263 HydrophobicContact CG-CG2 3.83Å; L259-T263 PolarHBondContact O-N 2.96Å; L260-T263 WeakPolarHBondContact O-CB 3.18Å; L260-T263 WeakPolarHBondContact O-CG2 3.42Å; L260-T263 PolarHBondContact O-N 2.84Å; L260-T263 VanDerWaalsContact O-N 3.13Å; L260-T263 PolarHBondContact O-OG1 3.1Å; S261-T263 PolarHBondContact O-N 2.89Å; T263-F265 VanDerWaalsContact C-N 3.3Å; T263-F265 PolarHBondContact O-N 3.5Å; T263-N266 WeakPolarHBondContact O-CB 3.47Å; T263-N266 PolarHBondContact O-N 2.91Å; T263-N266 VanDerWaalsContact O-N 3.15Å |
| 264 | T | 94.6 | Very high | 86.7 | Confident | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 16% | 0.156 | C | C | . | . | G | 310 helix | trans | -76.5 | -15.5 | -174.8 | 74.3 | 0 | 0 | 0 | 0 | 113.6 | Y24 V27 F64 I94 S261 L262 N266 C267 | Y24-T264 HydrophobicContact CE1-CG2 4.16Å; V27-T264 VanDerWaalsContact CG2-OG1 3.3Å; V27-T264 WeakPolarHBondContact CG2-OG1 3.21Å; F64-T264 HydrophobicContact CE1-CG2 3.93Å; F64-T264 HydrophobicContact CE2-CG2 4.32Å; F64-T264 HydrophobicContact CZ-CG2 3.42Å; F64-T264 VanDerWaalsContact CZ-CG2 3.42Å; I94-T264 HydrophobicContact CD1-CG2 3.56Å; I94-T264 HydrophobicContact CG1-CG2 3.91Å; S261-T264 WeakPolarHBondContact O-CB 3.33Å; S261-T264 WeakPolarHBondContact O-CG2 3.04Å; S261-T264 PolarHBondContact O-N 2.85Å; S261-T264 VanDerWaalsContact O-N 3.09Å; S261-T264 PolarHBondContact O-OG1 3.27Å; L262-T264 PolarHBondContact O-N 3.21Å; L262-T264 VanDerWaalsContact O-N 3.11Å; T264-N266 PolarHBondContact O-N 3.3Å; T264-N266 VanDerWaalsContact O-N 3.09Å; T264-C267 WeakPolarHBondContact O-CB 3.26Å; T264-C267 PolarHBondContact O-N 2.95Å; T264-C267 VanDerWaalsContact O-N 3.09Å; T264-C267 PolarHBondContact O-SG 3.07Å; T264-C267 VanDerWaalsContact O-SG 3.36Å |
| 265 | F | 94 | Very high | 85.4 | Confident | 55 Ų | 55 | 29.8 Ų | 29.8 | 24% | 0.241 | 17% | 0.165 | C | C | . | . | G | 310 helix | trans | -61.9 | -12.4 | 167.4 | -76.8 | -81.7 | 0 | 0 | 0 | 112.7 | I23 V26 V27 L262 T263 C267 L268 | I23-F265 HydrophobicContact CG2-CE2 3.69Å; I23-F265 HydrophobicContact CG2-CZ 4.17Å; V26-F265 HydrophobicContact CG1-CE1 3.91Å; V26-F265 HydrophobicContact CG1-CZ 4.38Å; V27-F265 HydrophobicContact CG2-CD1 4.14Å; V27-F265 HydrophobicContact CG2-CD2 4.28Å; V27-F265 HydrophobicContact CG2-CE1 4.11Å; V27-F265 HydrophobicContact CG2-CE2 4.24Å; V27-F265 HydrophobicContact CG2-CG 4.23Å; V27-F265 HydrophobicContact CG2-CZ 4.16Å; L262-F265 HydrophobicContact CD2-CD2 4.07Å; L262-F265 HydrophobicContact CD2-CE2 3.73Å; L262-F265 WeakPolarHBondContact O-CD2 3.28Å; L262-F265 PolarHBondContact O-N 2.82Å; T263-F265 VanDerWaalsContact C-N 3.3Å; T263-F265 PolarHBondContact O-N 3.5Å; F265-C267 PolarHBondContact O-N 3.25Å; F265-C267 VanDerWaalsContact O-N 3.08Å; F265-L268 HydrophobicContact CD1-CD1 3.75Å; F265-L268 HydrophobicContact CD1-CG 4.4Å; F265-L268 HydrophobicContact CE1-CD1 4.49Å; F265-L268 WeakPolarHBondContact O-CB 3.46Å; F265-L268 WeakPolarHBondContact O-CG 3.41Å; F265-L268 PolarHBondContact O-N 2.97Å |
| 266 | N | 92.4 | Very high | 83.6 | Confident | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 19% | 0.19 | C | C | . | . | G | 310 helix | trans | -51.3 | -28.7 | 167.9 | -172.4 | -92.7 | 0 | 0 | 0 | 112.4 | H61 Y105 Y236 T263 T264 L268 D269 | H61-N266 PolarHBondContact CE1-OD1 3.27Å; H61-N266 VanDerWaalsContact CE1-OD1 3.26Å; Y105-N266 WeakPolarHBondContact CE2-OD1 3.4Å; Y105-N266 PolarHBondContact OH-ND2 3.15Å; Y105-N266 PolarHBondContact OH-OD1 2.79Å; Y236-N266 HydrophobicContact CE1-CB 4Å; Y236-N266 WeakPolarHBondContact OH-CB 3.46Å; Y236-N266 PolarHBondContact OH-ND2 3.21Å; Y236-N266 PolarHBondContact OH-OD1 3.18Å; T263-N266 WeakPolarHBondContact O-CB 3.47Å; T263-N266 PolarHBondContact O-N 2.91Å; T263-N266 VanDerWaalsContact O-N 3.15Å; T264-N266 PolarHBondContact O-N 3.3Å; T264-N266 VanDerWaalsContact O-N 3.09Å; N266-L268 PolarHBondContact O-N 3.45Å; N266-L268 VanDerWaalsContact O-N 3.08Å; N266-D269 WeakPolarHBondContact O-CB 3.46Å; N266-D269 PolarHBondContact O-N 3.44Å; N266-D269 VanDerWaalsContact O-N 3.09Å |
| 267 | C | 91.8 | Very high | 83.4 | Confident | 2 Ų | 2 | 39.3 Ų | 39.3 | 1% | 0.014 | 20% | 0.198 | C | C | . | . | G | 310 helix | trans | -61.7 | -12.1 | 174.2 | -62.6 | 0 | 0 | 0 | 0 | 115.4 | H61 T264 F265 D269 | H61-C267 PolarHBondContact ND1-SG 3.42Å; T264-C267 WeakPolarHBondContact O-CB 3.26Å; T264-C267 PolarHBondContact O-N 2.95Å; T264-C267 VanDerWaalsContact O-N 3.09Å; T264-C267 PolarHBondContact O-SG 3.07Å; T264-C267 VanDerWaalsContact O-SG 3.36Å; F265-C267 PolarHBondContact O-N 3.25Å; F265-C267 VanDerWaalsContact O-N 3.08Å; C267-D269 VanDerWaalsContact C-N 3.31Å |
| 268 | L | 89.8 | Confident | 83.1 | Confident | 41 Ų | 41 | 41.1 Ų | 41.1 | 22% | 0.215 | 21% | 0.207 | C | C | . | . | G | 310 helix | trans | -85.3 | -6.9 | 176.2 | -56.6 | -170.3 | 0 | 0 | 0 | 113.1 | C30 F265 N266 M270 L271 | C30-L268 HydrophobicContact CB-CD2 3.35Å; F265-L268 HydrophobicContact CD1-CD1 3.75Å; F265-L268 HydrophobicContact CD1-CG 4.4Å; F265-L268 HydrophobicContact CE1-CD1 4.49Å; F265-L268 WeakPolarHBondContact O-CB 3.46Å; F265-L268 WeakPolarHBondContact O-CG 3.41Å; F265-L268 PolarHBondContact O-N 2.97Å; N266-L268 PolarHBondContact O-N 3.45Å; N266-L268 VanDerWaalsContact O-N 3.08Å; L268-M270 PolarHBondContact O-N 3.27Å; L268-L271 HydrophobicContact CB-CD1 4.44Å; L268-L271 VanDerWaalsContact O-CB 3.28Å; L268-L271 WeakPolarHBondContact O-CB 3.45Å; L268-L271 PolarHBondContact O-N 3.21Å |
| 269 | D | 87.1 | Confident | 82.7 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 21% | 0.206 | C | C | . | . | G | 310 helix | trans | -54.6 | -31.7 | 174.5 | 66.6 | -20.9 | 0 | 0 | 0 | 113.7 | H61 Y105 F228 I231 N266 C267 L271 T272 | H61-D269 IonicContact CE1-OD1 3.09Å; H61-D269 IonicContact CE1-OD2 3.8Å; H61-D269 IonicContact NE2-OD1 3.92Å; H61-D269 PolarHBondContact NE2-OD1 3Å; H61-D269 IonicContact NE2-OD2 3.49Å; H61-D269 PolarHBondContact NE2-OD2 3.29Å; Y105-D269 VanDerWaalsContact CZ-OD2 3.31Å; Y105-D269 WeakPolarHBondContact OH-CB 3.22Å; Y105-D269 PolarHBondContact OH-OD2 2.98Å; F228-D269 HydrophobicContact CD2-CB 3.88Å; F228-D269 HydrophobicContact CE2-CB 3.8Å; F228-D269 WeakPolarHBondContact CE2-OD2 3.36Å; I231-D269 HydrophobicContact CD1-CB 4.31Å; I231-D269 HydrophobicContact CG2-CB 4.49Å; N266-D269 WeakPolarHBondContact O-CB 3.46Å; N266-D269 PolarHBondContact O-N 3.44Å; N266-D269 VanDerWaalsContact O-N 3.09Å; C267-D269 VanDerWaalsContact C-N 3.31Å; D269-L271 PolarHBondContact O-N 3.47Å; D269-L271 VanDerWaalsContact O-N 3.15Å; D269-T272 WeakPolarHBondContact O-CB 3.41Å; D269-T272 WeakPolarHBondContact O-CG2 2.92Å; D269-T272 PolarHBondContact O-N 2.81Å; D269-T272 PolarHBondContact O-OG1 3.42Å |
| 270 | M | 82.3 | Confident | 82.1 | Confident | 2 Ų | 2 | 41.9 Ų | 41.9 | 1% | 0.01 | 21% | 0.208 | C | C | . | . | G | 310 helix | trans | -60.6 | -24.5 | 176.1 | -66.5 | -56.9 | 103.6 | 0 | 0 | 111.9 | M38 L57 I58 F228 L268 T272 F273 | M38-M270 HydrophobicContact CB-CB 4.35Å; M38-M270 HydrophobicContact CE-SD 4.44Å; M38-M270 HydrophobicContact CG-SD 3.99Å; L57-M270 HydrophobicContact CD2-CE 3.7Å; L57-M270 HydrophobicContact CG-CE 4.16Å; I58-M270 HydrophobicContact CD1-SD 4.36Å; I58-M270 HydrophobicContact CG1-SD 3.64Å; F228-M270 HydrophobicContact CE2-CE 4.47Å; L268-M270 PolarHBondContact O-N 3.27Å; M270-T272 PolarHBondContact O-N 2.7Å; M270-F273 HydrophobicContact CE-CD2 4.37Å; M270-F273 HydrophobicContact CE-CE2 3.79Å; M270-F273 PolarHBondContact O-N 2.74Å; M270-F273 HydrophobicContact SD-CD2 4.27Å; M270-F273 HydrophobicContact SD-CE2 4.13Å |
| 271 | L | 81.1 | Confident | 81.5 | Confident | 74 Ų | 74 | 44.4 Ų | 44.4 | 39% | 0.387 | 22% | 0.221 | S | C | . | . | G | 310 helix | trans | -65.8 | -26.5 | 174.9 | -64.4 | 175.7 | 0 | 0 | 0 | 112.9 | S34 L268 D269 F273 L274 | S34-L271 VanDerWaalsContact OG-CD2 3.28Å; S34-L271 WeakPolarHBondContact OG-CD2 3.48Å; S34-L271 WeakPolarHBondContact OG-CG 3.4Å; L268-L271 HydrophobicContact CB-CD1 4.44Å; L268-L271 VanDerWaalsContact O-CB 3.28Å; L268-L271 WeakPolarHBondContact O-CB 3.45Å; L268-L271 PolarHBondContact O-N 3.21Å; D269-L271 PolarHBondContact O-N 3.47Å; D269-L271 VanDerWaalsContact O-N 3.15Å; L271-F273 PolarHBondContact O-N 3.46Å; L271-F273 VanDerWaalsContact O-N 3.15Å; L271-L274 HydrophobicContact CD2-CD1 4.15Å; L271-L274 WeakPolarHBondContact O-CB 3.4Å; L271-L274 PolarHBondContact O-N 2.77Å; L271-L274 VanDerWaalsContact O-N 3.11Å |
| 272 | T | 75.4 | Confident | 80.7 | Confident | 33 Ų | 33 | 47.4 Ų | 47.4 | 20% | 0.202 | 24% | 0.236 | C | C | . | . | G | 310 helix | trans | -65.7 | -16.9 | 178.5 | 68.9 | 0 | 0 | 0 | 0 | 112.8 | C227 I231 D269 M270 | C227-T272 HydrophobicContact CB-CG2 4.08Å; I231-T272 HydrophobicContact CD1-CG2 3.63Å; D269-T272 WeakPolarHBondContact O-CB 3.41Å; D269-T272 WeakPolarHBondContact O-CG2 2.92Å; D269-T272 PolarHBondContact O-N 2.81Å; D269-T272 PolarHBondContact O-OG1 3.42Å; M270-T272 PolarHBondContact O-N 2.7Å |
| 273 | F | 66.7 | Low | 79.8 | Confident | 66 Ų | 66 | 46.2 Ų | 46.2 | 29% | 0.289 | 23% | 0.229 | S | C | . | . | G | 310 helix | trans | -78.7 | -16.4 | 175.2 | -71.1 | -85.6 | 0 | 0 | 0 | 114.1 | M38 V54 M270 L271 | M38-F273 HydrophobicContact CE-CB 4.3Å; M38-F273 HydrophobicContact CE-CD1 3.86Å; M38-F273 HydrophobicContact CE-CD2 3.88Å; M38-F273 HydrophobicContact CE-CE1 4.11Å; M38-F273 HydrophobicContact CE-CE2 4.12Å; M38-F273 HydrophobicContact CE-CG 3.74Å; M38-F273 HydrophobicContact CE-CZ 4.23Å; M38-F273 HydrophobicContact SD-CB 3.82Å; M38-F273 HydrophobicContact SD-CD1 4.48Å; M38-F273 HydrophobicContact SD-CD2 4.15Å; M38-F273 HydrophobicContact SD-CG 3.91Å; V54-F273 HydrophobicContact CG1-CZ 4.28Å; M270-F273 HydrophobicContact CE-CD2 4.37Å; M270-F273 HydrophobicContact CE-CE2 3.79Å; M270-F273 PolarHBondContact O-N 2.74Å; M270-F273 HydrophobicContact SD-CD2 4.27Å; M270-F273 HydrophobicContact SD-CE2 4.13Å; L271-F273 PolarHBondContact O-N 3.46Å; L271-F273 VanDerWaalsContact O-N 3.15Å |
| 274 | L | 64.2 | Low | 78.7 | Confident | 73 Ų | 73 | 49.8 Ų | 49.8 | 38% | 0.382 | 25% | 0.246 | S | C | . | . | S | Bend | trans | -71.3 | -28.8 | -177.7 | -87.8 | 73.3 | 0 | 0 | 0 | 114 | L37 I41 L271 R276 | L37-L274 HydrophobicContact CD2-CD1 3.51Å; L37-L274 HydrophobicContact CD2-CD2 3.2Å; L37-L274 HydrophobicContact CD2-CG 3.48Å; L37-L274 VanDerWaalsContact CD2-CG 3.48Å; L37-L274 HydrophobicContact CG-CD1 3.77Å; L37-L274 HydrophobicContact CG-CD2 4.23Å; L37-L274 HydrophobicContact CG-CG 3.97Å; I41-L274 HydrophobicContact CD1-CD1 4.24Å; I41-L274 HydrophobicContact CD1-CG 4.24Å; L271-L274 HydrophobicContact CD2-CD1 4.15Å; L271-L274 WeakPolarHBondContact O-CB 3.4Å; L271-L274 PolarHBondContact O-N 2.77Å; L271-L274 VanDerWaalsContact O-N 3.11Å; L274-R276 PolarHBondContact O-N 3.45Å |
| 275 | G | 55.7 | Low | 77.3 | Confident | 50 Ų | 50 | 53.9 Ų | 53.9 | 52% | 0.515 | 27% | 0.267 | S | S | . | . | trans | -72.9 | 77.1 | -176.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | K224 | K224-G275 WeakPolarHBondContact CE-O 3.46Å; K224-G275 PolarHBondContact NZ-O 3.3Å | ||
| 276 | R | 47.7 | Very low | 75.8 | Confident | 251 Ų | 251 | 53.8 Ų | 53.8 | 95% | 0.947 | 27% | 0.269 | S | S | * | . | trans | -72.1 | 0 | 165.7 | -84 | -171.7 | 175.7 | 167.3 | 0.3 | 110.2 | L274 | L274-R276 PolarHBondContact O-N 3.45Š|
Retrieved 276 of 276 residues in 76 ms
(Link to these results)