A0A075QRX4_GADMO Loading...

Elongation of very long chain fatty acids protein

AlphaFold DB , UniProt , Accession A0A075QRX4, Species GADMO (Gadus morhua, Atlantic cod), Gene elovl1a, Length 306 aa.

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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
1M79.5Confident87.4Confident168 Ų168120.5 Ų120.583%0.82861%0.605SS**  0-74.20-152.2174.174.800114.4Q3 E4 I5M1-Q3 PolarHBondContact O-N 3.38Å; M1-E4 VanDerWaalsContact CA-OE2 3.24Å; M1-E4 WeakPolarHBondContact CA-OE2 3.2Å; M1-E4 PolarHBondContact N-OE2 3.47Å; M1-E4 PolarHBondContact O-N 3.4Å; M1-I5 HydrophobicContact CG-CD1 4.14Å; M1-I5 VanDerWaalsContact O-CG1 3.3Å; M1-I5 WeakPolarHBondContact O-CG1 3.46Å; M1-I5 PolarHBondContact O-N 2.98Å
2L85.8Confident87.2Confident139 Ų139119.6 Ų119.673%0.72860%0.603SS**Hα-helixtrans-64.3-41.8-174.7-158.195.8000113.2I5 M6L2-I5 PolarHBondContact O-N 2.92Å; L2-M6 WeakPolarHBondContact O-CB 3.46Å; L2-M6 PolarHBondContact O-N 2.91Å
3Q86.9Confident87Confident175 Ų175115.3 Ų115.382%0.81858%0.579SS**Hα-helixtrans-65-37.3176.4-72.6175.9-25.300112.4M1 M6 A7M1-Q3 PolarHBondContact O-N 3.38Å; Q3-M6 PolarHBondContact O-N 3.31Å; Q3-A7 WeakPolarHBondContact O-CB 3.4Å; Q3-A7 PolarHBondContact O-N 3.23Å
4E89.5Confident86.9Confident123 Ų123111.1 Ų111.158%0.57557%0.571SS**Hα-helixtrans-69.1-41.7176.1-68163.7140.600111.6M1 M6 A7 N8M1-E4 VanDerWaalsContact CA-OE2 3.24Å; M1-E4 WeakPolarHBondContact CA-OE2 3.2Å; M1-E4 PolarHBondContact N-OE2 3.47Å; M1-E4 PolarHBondContact O-N 3.4Å; E4-M6 VanDerWaalsContact C-N 3.31Å; E4-M6 PolarHBondContact O-N 2.86Å; E4-A7 PolarHBondContact O-N 3.4Å; E4-N8 WeakPolarHBondContact O-CB 3.5Å; E4-N8 PolarHBondContact O-N 3.27Å; E4-N8 PolarHBondContact O-ND2 2.99Å
5I87.6Confident86.8Confident92 Ų92108.9 Ų108.947%0.47256%0.56SS.*Hα-helixtrans-59.2-47173.2-68.3166.3000109.5M1 L2 A7 N8 V9M1-I5 HydrophobicContact CG-CD1 4.14Å; M1-I5 VanDerWaalsContact O-CG1 3.3Å; M1-I5 WeakPolarHBondContact O-CG1 3.46Å; M1-I5 PolarHBondContact O-N 2.98Å; L2-I5 PolarHBondContact O-N 2.92Å; I5-A7 PolarHBondContact O-N 2.98Å; I5-N8 PolarHBondContact O-N 3.11Å; I5-V9 HydrophobicContact CG2-CG2 4.44Å; I5-V9 VanDerWaalsContact O-CG2 3.29Å; I5-V9 WeakPolarHBondContact O-CG2 3.2Å; I5-V9 PolarHBondContact O-N 2.85Å
6M89.1Confident86.5Confident108 Ų108103.1 Ų103.153%0.53253%0.531SS..Hα-helixtrans-60.8-45.6178-169.865.572.900111.8L2 Q3 E4 N8 V9 L10L2-M6 WeakPolarHBondContact O-CB 3.46Å; L2-M6 PolarHBondContact O-N 2.91Å; Q3-M6 PolarHBondContact O-N 3.31Å; E4-M6 VanDerWaalsContact C-N 3.31Å; E4-M6 PolarHBondContact O-N 2.86Å; M6-N8 VanDerWaalsContact C-N 3.33Å; M6-N8 PolarHBondContact O-N 3.31Å; M6-V9 PolarHBondContact O-N 2.86Å; M6-L10 HydrophobicContact CG-CD1 4.21Å; M6-L10 WeakPolarHBondContact O-CG 3.48Å; M6-L10 PolarHBondContact O-N 3.31Å
7A89.4Confident86.3Confident53 Ų5399.8 Ų99.844%0.43851%0.514SS..Hα-helixtrans-61.1-41.9177.500000112Q3 E4 I5 L10 R11Q3-A7 WeakPolarHBondContact O-CB 3.4Å; Q3-A7 PolarHBondContact O-N 3.23Å; E4-A7 PolarHBondContact O-N 3.4Å; I5-A7 PolarHBondContact O-N 2.98Å; A7-L10 PolarHBondContact O-N 3.37Å; A7-R11 WeakPolarHBondContact O-CB 3.47Å; A7-R11 PolarHBondContact O-N 2.93Å
8N90.3Very high86.1Confident103 Ų103102.1 Ų102.155%0.55152%0.522SS*.Hα-helixtrans-65.5-40.5176.7-72.6-24.9000112.2E4 I5 M6 R11 L12E4-N8 WeakPolarHBondContact O-CB 3.5Å; E4-N8 PolarHBondContact O-N 3.27Å; E4-N8 PolarHBondContact O-ND2 2.99Å; I5-N8 PolarHBondContact O-N 3.11Å; M6-N8 VanDerWaalsContact C-N 3.33Å; M6-N8 PolarHBondContact O-N 3.31Å; N8-R11 PolarHBondContact O-N 3.15Å; N8-L12 WeakPolarHBondContact O-CB 3.36Å; N8-L12 PolarHBondContact O-N 3.06Å
9V85.7Confident85.9Confident82 Ų82106.6 Ų106.650%0.49753%0.532SS..Hα-helixtrans-63.7-46.2176.2169.10000111I5 M6 R11 L12 H13I5-V9 HydrophobicContact CG2-CG2 4.44Å; I5-V9 VanDerWaalsContact O-CG2 3.29Å; I5-V9 WeakPolarHBondContact O-CG2 3.2Å; I5-V9 PolarHBondContact O-N 2.85Å; M6-V9 PolarHBondContact O-N 2.86Å; V9-R11 VanDerWaalsContact C-N 3.33Å; V9-R11 PolarHBondContact O-N 3.03Å; V9-L12 PolarHBondContact O-N 3.43Å; V9-H13 WeakPolarHBondContact O-CB 3.23Å; V9-H13 PolarHBondContact O-N 3.47Å
10L88.8Confident85.7Confident106 Ų106101.5 Ų101.556%0.55551%0.507SS*.Hα-helixtrans-63.8-39.6177.7-70172.6000111.7M6 A7 H13 A14M6-L10 HydrophobicContact CG-CD1 4.21Å; M6-L10 WeakPolarHBondContact O-CG 3.48Å; M6-L10 PolarHBondContact O-N 3.31Å; A7-L10 PolarHBondContact O-N 3.37Å; L10-H13 PolarHBondContact O-N 3Å; L10-A14 WeakPolarHBondContact O-CB 3.49Å; L10-A14 PolarHBondContact O-N 3.28Å
11R89.3Confident85.5Confident176 Ų17697.9 Ų97.966%0.66449%0.489SS*.Hα-helixtrans-63.3-45.2175.3-173.4178.4-179.4179.50.9111.7A7 N8 V9 H13 A14 L15A7-R11 WeakPolarHBondContact O-CB 3.47Å; A7-R11 PolarHBondContact O-N 2.93Å; N8-R11 PolarHBondContact O-N 3.15Å; V9-R11 VanDerWaalsContact C-N 3.33Å; V9-R11 PolarHBondContact O-N 3.03Å; R11-H13 VanDerWaalsContact C-N 3.35Å; R11-A14 PolarHBondContact O-N 3.4Å; R11-L15 HydrophobicContact CG-CD1 4.32Å; R11-L15 VanDerWaalsContact O-CG 3.29Å; R11-L15 WeakPolarHBondContact O-CG 3.35Å; R11-L15 PolarHBondContact O-N 3.31Å
12L84.6Confident85.8Confident110 Ų11095.1 Ų95.158%0.57648%0.478SS*.Hα-helixtrans-61.9-45176.3179.763.3000111N8 V9 A14 L15 V16N8-L12 WeakPolarHBondContact O-CB 3.36Å; N8-L12 PolarHBondContact O-N 3.06Å; V9-L12 PolarHBondContact O-N 3.43Å; L12-A14 PolarHBondContact O-N 3.28Å; L12-L15 PolarHBondContact O-N 3.01Å; L12-V16 HydrophobicContact CD1-CG2 4.35Å; L12-V16 HydrophobicContact CG-CG2 4.5Å; L12-V16 VanDerWaalsContact O-CG2 3.27Å; L12-V16 WeakPolarHBondContact O-CG2 3.22Å; L12-V16 PolarHBondContact O-N 3.38Å
13H84.9Confident86Confident64 Ų6490.3 Ų90.330%0.29645%0.45SS..Hα-helixtrans-59.4-45.8177.6177.8-97.7000112V9 L10 R11 L15 V16 I17 S32V9-H13 WeakPolarHBondContact O-CB 3.23Å; V9-H13 PolarHBondContact O-N 3.47Å; L10-H13 PolarHBondContact O-N 3Å; R11-H13 VanDerWaalsContact C-N 3.35Å; H13-L15 PolarHBondContact O-N 3.18Å; H13-V16 PolarHBondContact O-N 3.32Å; H13-I17 WeakPolarHBondContact CE1-CD1 3.4Å; H13-I17 WeakPolarHBondContact O-CG1 3.1Å; H13-I17 PolarHBondContact O-N 3.2Å; H13-S32 PolarHBondContact NE2-OG 3.06Å
14A85.1Confident86.1Confident56 Ų5682 Ų8246%0.46341%0.411SS..Hα-helixtrans-61.4-43.1175.800000112.3L10 R11 L12 V16 I17 Q18L10-A14 WeakPolarHBondContact O-CB 3.49Å; L10-A14 PolarHBondContact O-N 3.28Å; R11-A14 PolarHBondContact O-N 3.4Å; L12-A14 PolarHBondContact O-N 3.28Å; A14-V16 VanDerWaalsContact C-N 3.33Å; A14-V16 PolarHBondContact O-N 2.97Å; A14-I17 PolarHBondContact O-N 2.79Å; A14-Q18 WeakPolarHBondContact O-CB 3.36Å; A14-Q18 PolarHBondContact O-N 2.98Å
15L85.4Confident85.8Confident79 Ų7981.3 Ų81.341%0.41440%0.403SS..Hα-helixtrans-61.6-41.1176-74.3169.6000112R11 L12 H13 Q18 R19R11-L15 HydrophobicContact CG-CD1 4.32Å; R11-L15 VanDerWaalsContact O-CG 3.29Å; R11-L15 WeakPolarHBondContact O-CG 3.35Å; R11-L15 PolarHBondContact O-N 3.31Å; L12-L15 PolarHBondContact O-N 3.01Å; H13-L15 PolarHBondContact O-N 3.18Å; L15-Q18 PolarHBondContact O-N 3.36Å; L15-R19 WeakPolarHBondContact O-CB 3.2Å; L15-R19 VanDerWaalsContact O-CG 3.23Å; L15-R19 WeakPolarHBondContact O-CG 3.42Å; L15-R19 PolarHBondContact O-N 3.25Å
16V82.9Confident85.9Confident15 Ų1580.7 Ų80.79%0.09142%0.419CS..Hα-helixtrans-64.8-44.6178.4169.50000111.1L12 H13 A14 Q18 R19 T20 P33 W158 W159L12-V16 HydrophobicContact CD1-CG2 4.35Å; L12-V16 HydrophobicContact CG-CG2 4.5Å; L12-V16 VanDerWaalsContact O-CG2 3.27Å; L12-V16 WeakPolarHBondContact O-CG2 3.22Å; L12-V16 PolarHBondContact O-N 3.38Å; H13-V16 PolarHBondContact O-N 3.32Å; A14-V16 VanDerWaalsContact C-N 3.33Å; A14-V16 PolarHBondContact O-N 2.97Å; V16-Q18 VanDerWaalsContact C-N 3.33Å; V16-Q18 PolarHBondContact O-N 3.23Å; V16-R19 PolarHBondContact O-N 3.31Å; V16-T20 PolarHBondContact O-N 3.15Å; V16-T20 PolarHBondContact O-OG1 3.02Å; V16-P33 HydrophobicContact CG1-CG 4.28Å; V16-W158 HydrophobicContact CG1-CH2 3.57Å; V16-W158 HydrophobicContact CG1-CZ3 3.85Å; V16-W159 HydrophobicContact CB-CZ3 4.45Å; V16-W159 HydrophobicContact CG1-CH2 4.05Å; V16-W159 HydrophobicContact CG1-CZ3 3.78Å; V16-W159 HydrophobicContact CG2-CH2 3.85Å; V16-W159 HydrophobicContact CG2-CZ3 3.74Å
17I82.2Confident86Confident48 Ų4878.9 Ų78.925%0.24641%0.407CS..Hα-helixtrans-62.3-42.7176.1-69175.5000110.8H13 A14 R19 T20 R25H13-I17 WeakPolarHBondContact CE1-CD1 3.4Å; H13-I17 WeakPolarHBondContact O-CG1 3.1Å; H13-I17 PolarHBondContact O-N 3.2Å; A14-I17 PolarHBondContact O-N 2.79Å; I17-R19 VanDerWaalsContact C-N 3.3Å; I17-R19 PolarHBondContact O-N 3Å; I17-T20 WeakPolarHBondContact O-CB 3.2Å; I17-T20 PolarHBondContact O-N 2.7Å; I17-R25 PolarHBondContact O-NH2 3.33Å
18Q83.4Confident86.2Confident140 Ų14081.9 Ų81.965%0.65442%0.415SS*.Hα-helixtrans-63.6-36.8178.2-171.9-177.121.300112.4A14 L15 V16 T20A14-Q18 WeakPolarHBondContact O-CB 3.36Å; A14-Q18 PolarHBondContact O-N 2.98Å; L15-Q18 PolarHBondContact O-N 3.36Å; V16-Q18 VanDerWaalsContact C-N 3.33Å; V16-Q18 PolarHBondContact O-N 3.23Å; Q18-T20 VanDerWaalsContact C-N 3.32Å
19R81.1Confident86.3Confident189 Ų18978.1 Ų78.171%0.71340%0.395SS*.Hα-helixtrans-82.7-8.9178.9-68.6-68.9-172.9166.51.6113.8L15 V16 I17 D21 L163L15-R19 WeakPolarHBondContact O-CB 3.2Å; L15-R19 VanDerWaalsContact O-CG 3.23Å; L15-R19 WeakPolarHBondContact O-CG 3.42Å; L15-R19 PolarHBondContact O-N 3.25Å; V16-R19 PolarHBondContact O-N 3.31Å; I17-R19 VanDerWaalsContact C-N 3.3Å; I17-R19 PolarHBondContact O-N 3Å; R19-D21 PolarHBondContact O-N 3.24Å; R19-L163 HydrophobicContact CB-CD2 4.3Å
20T82Confident86.6Confident4 Ų474.2 Ų74.23%0.02537%0.371CS..SBendtrans-68.8125.8175-59.30000109.2V16 I17 Q18 D22 R25 T162V16-T20 PolarHBondContact O-N 3.15Å; V16-T20 PolarHBondContact O-OG1 3.02Å; I17-T20 WeakPolarHBondContact O-CB 3.2Å; I17-T20 PolarHBondContact O-N 2.7Å; Q18-T20 VanDerWaalsContact C-N 3.32Å; T20-D22 PolarHBondContact O-N 3.11Å; T20-R25 HydrophobicContact CG2-CG 4.33Å; T20-T162 HydrophobicContact CG2-CG2 3.91Å; T20-T162 WeakPolarHBondContact OG1-CG2 3.31Å
21D82.7Confident86.5Confident26 Ų2675.8 Ų75.814%0.13938%0.376CS..  trans-56.8126.2176.7-171.8-51.2000111.8R19 R23 L24 P165R19-D21 PolarHBondContact O-N 3.24Å; D21-R23 PolarHBondContact O-N 3.48Å; D21-R23 VanDerWaalsContact O-N 3.15Å; D21-R23 WeakPolarHBondContact OD1-CA 3.33Å; D21-R23 WeakPolarHBondContact OD1-CB 3.48Å; D21-R23 WeakPolarHBondContact OD1-CG 3.23Å; D21-R23 IonicContact OD1-CZ 2.8Å; D21-R23 PolarHBondContact OD1-N 3.05Å; D21-R23 IonicContact OD1-NE 2.86Å; D21-R23 PolarHBondContact OD1-NE 2.72Å; D21-R23 IonicContact OD2-CZ 2.76Å; D21-R23 VanDerWaalsContact OD2-CZ 3.24Å; D21-R23 IonicContact OD2-NE 3.76Å; D21-R23 PolarHBondContact OD2-NE 3.05Å; D21-R23 IonicContact OD2-NH2 3.4Å; D21-R23 PolarHBondContact OD2-NH2 3.26Å; D21-L24 PolarHBondContact O-N 3.16Å; D21-P165 HydrophobicContact CB-CB 4.15Å; D21-P165 HydrophobicContact CB-CG 3.59Å; D21-P165 WeakPolarHBondContact OD2-CG 3.41Å
22D85.4Confident86.4Confident109 Ų10968.2 Ų68.258%0.58335%0.35SS*.G310 helixtrans-57.5-30.3-176.4-68.7-23.6000112.4T20 L24 R25T20-D22 PolarHBondContact O-N 3.11Å; D22-L24 PolarHBondContact O-N 3.49Å; D22-R25 PolarHBondContact O-N 3.39Å; D22-R25 IonicContact OD1-CZ 2.67Å; D22-R25 IonicContact OD1-NE 3.01Å; D22-R25 PolarHBondContact OD1-NE 3.43Å; D22-R25 VanDerWaalsContact OD1-NE 3.13Å; D22-R25 IonicContact OD1-NH1 3.01Å; D22-R25 PolarHBondContact OD1-NH1 2.89Å; D22-R25 IonicContact OD1-NH2 3.98Å; D22-R25 PolarHBondContact OD1-NH2 3.48Å
23R89.3Confident86.6Confident38 Ų3863.8 Ų63.814%0.14333%0.328CS..G310 helixtrans-64.2-22.6178.7-57.5173.7-68.4173.73.9112.4D21 Y27 D102 S104 L110D21-R23 PolarHBondContact O-N 3.48Å; D21-R23 VanDerWaalsContact O-N 3.15Å; D21-R23 WeakPolarHBondContact OD1-CA 3.33Å; D21-R23 WeakPolarHBondContact OD1-CB 3.48Å; D21-R23 WeakPolarHBondContact OD1-CG 3.23Å; D21-R23 IonicContact OD1-CZ 2.8Å; D21-R23 PolarHBondContact OD1-N 3.05Å; D21-R23 IonicContact OD1-NE 2.86Å; D21-R23 PolarHBondContact OD1-NE 2.72Å; D21-R23 IonicContact OD2-CZ 2.76Å; D21-R23 VanDerWaalsContact OD2-CZ 3.24Å; D21-R23 IonicContact OD2-NE 3.76Å; D21-R23 PolarHBondContact OD2-NE 3.05Å; D21-R23 IonicContact OD2-NH2 3.4Å; D21-R23 PolarHBondContact OD2-NH2 3.26Å; R23-Y27 WeakPolarHBondContact O-CE1 3.21Å; R23-D102 PolarHBondContact NH1-O 3.02Å; R23-D102 PolarHBondContact NH2-O 2.79Å; R23-S104 PolarHBondContact NH1-O 3.22Å; R23-L110 HydrophobicContact CB-CD2 4.31Å; R23-L110 HydrophobicContact CG-CD2 4.09Å
24L88.5Confident86.9Confident1 Ų165 Ų651%0.00534%0.339CS..G310 helixtrans-97.8-13.3-179.8-76.2171.4000113.8D21 D22 G26 Y27 M30 V113 W117 I161 P165D21-L24 PolarHBondContact O-N 3.16Å; D22-L24 PolarHBondContact O-N 3.49Å; L24-G26 PolarHBondContact O-N 2.92Å; L24-G26 VanDerWaalsContact O-N 3.13Å; L24-Y27 HydrophobicContact CD2-CD2 4.27Å; L24-Y27 HydrophobicContact CD2-CG 4.35Å; L24-Y27 VanDerWaalsContact O-CB 3.3Å; L24-Y27 WeakPolarHBondContact O-CB 3.23Å; L24-Y27 PolarHBondContact O-N 2.83Å; L24-M30 HydrophobicContact CB-CB 4.31Å; L24-M30 HydrophobicContact CB-CE 4.36Å; L24-M30 HydrophobicContact CB-CG 4.27Å; L24-M30 HydrophobicContact CD1-CE 4.12Å; L24-M30 HydrophobicContact CD2-CG 4.39Å; L24-M30 WeakPolarHBondContact O-CB 3.25Å; L24-V113 HydrophobicContact CD1-CG1 4.48Å; L24-V113 HydrophobicContact CD2-CG1 3.4Å; L24-V113 VanDerWaalsContact CD2-CG1 3.4Å; L24-V113 HydrophobicContact CG-CG1 3.73Å; L24-W117 HydrophobicContact CD2-CB 4.27Å; L24-I161 HydrophobicContact CD1-CB 4.08Å; L24-I161 HydrophobicContact CD1-CG1 4.38Å; L24-I161 WeakPolarHBondContact CD1-O 3.41Å; L24-P165 HydrophobicContact CD1-CB 3.75Å
25R84.3Confident87.2Confident108 Ų10866.7 Ų66.741%0.40834%0.34SS..THydrogen-bonded Turntrans-59.6-32.1-171.6-74.1-175.9177.3167.29.5114.5I17 T20 D22 Y27I17-R25 PolarHBondContact O-NH2 3.33Å; T20-R25 HydrophobicContact CG2-CG 4.33Å; D22-R25 PolarHBondContact O-N 3.39Å; D22-R25 IonicContact OD1-CZ 2.67Å; D22-R25 IonicContact OD1-NE 3.01Å; D22-R25 PolarHBondContact OD1-NE 3.43Å; D22-R25 VanDerWaalsContact OD1-NE 3.13Å; D22-R25 IonicContact OD1-NH1 3.01Å; D22-R25 PolarHBondContact OD1-NH1 2.89Å; D22-R25 IonicContact OD1-NH2 3.98Å; D22-R25 PolarHBondContact OD1-NH2 3.48Å; R25-Y27 VanDerWaalsContact C-N 3.27Å; R25-Y27 PolarHBondContact O-N 3.43Å
26G88.6Confident87.6Confident79 Ų7963 Ų6381%0.81432%0.32SS*.THydrogen-bonded Turntrans-78.6-5.7177.600000114.7L24L24-G26 PolarHBondContact O-N 2.92Å; L24-G26 VanDerWaalsContact O-N 3.13Å
27Y92.6Very high88.1Confident71 Ų7164.5 Ų64.528%0.27833%0.33SS..SBendtrans-90.3148.6-172.5-7550.5000111.3R23 L24 R25 L29 M30 R114 W117R23-Y27 WeakPolarHBondContact O-CE1 3.21Å; L24-Y27 HydrophobicContact CD2-CD2 4.27Å; L24-Y27 HydrophobicContact CD2-CG 4.35Å; L24-Y27 VanDerWaalsContact O-CB 3.3Å; L24-Y27 WeakPolarHBondContact O-CB 3.23Å; L24-Y27 PolarHBondContact O-N 2.83Å; R25-Y27 VanDerWaalsContact C-N 3.27Å; R25-Y27 PolarHBondContact O-N 3.43Å; Y27-L29 PolarHBondContact O-N 3.21Å; Y27-M30 WeakPolarHBondContact O-CB 3.31Å; Y27-M30 PolarHBondContact O-N 2.91Å; Y27-M30 VanDerWaalsContact O-N 3.15Å; Y27-R114 HydrophobicContact CE2-CB 4.48Å; Y27-R114 HydrophobicContact CE2-CG 4.38Å; Y27-W117 HydrophobicContact CD2-CB 3.79Å; Y27-W117 AromaticContact CD2-CD1 3.76Å; Y27-W117 AromaticContact CD2-CD2 3.42Å; Y27-W117 HydrophobicContact CD2-CD2 3.42Å; Y27-W117 VanDerWaalsContact CD2-CD2 3.42Å; Y27-W117 AromaticContact CD2-CE2 3.77Å; Y27-W117 AromaticContact CD2-CE3 3.82Å; Y27-W117 HydrophobicContact CD2-CE3 3.82Å; Y27-W117 AromaticContact CD2-CG 3.39Å; Y27-W117 HydrophobicContact CD2-CG 3.39Å; Y27-W117 HydrophobicContact CD2-CZ2 4.44Å; Y27-W117 AromaticContact CD2-NE1 3.99Å; Y27-W117 HydrophobicContact CE2-CB 4.13Å; Y27-W117 HydrophobicContact CE2-CD2 4.08Å; Y27-W117 HydrophobicContact CE2-CE3 4.06Å; Y27-W117 HydrophobicContact CE2-CG 4.13Å; Y27-W117 HydrophobicContact CG-CD2 4.41Å; Y27-W117 HydrophobicContact CG-CG 4.33Å
28L93.7Very high88.7Confident116 Ų11667 Ų6761%0.60734%0.343SS*.THydrogen-bonded Turntrans-57.8138.1-179.7-169.967.1000110.7M30 W117 I121L28-M30 PolarHBondContact O-N 3.45Å; L28-W117 HydrophobicContact CB-CZ2 3.78Å; L28-W117 PolarHBondContact O-NE1 3.24Å; L28-I121 HydrophobicContact CB-CD1 4.46Å; L28-I121 HydrophobicContact CD2-CD1 4.45Å
29L92.4Very high89.3Confident24 Ų2463.1 Ų63.113%0.12633%0.326CS..THydrogen-bonded Turntrans63.46.6-177.6-60.3178.9000115.9Y27 L35 I39 Y120 I121 Y124 W158Y27-L29 PolarHBondContact O-N 3.21Å; L29-L35 HydrophobicContact CD2-CB 4.42Å; L29-L35 HydrophobicContact CD2-CD2 3.56Å; L29-L35 HydrophobicContact CD2-CG 3.67Å; L29-I39 HydrophobicContact CD1-CD1 4.3Å; L29-I39 HydrophobicContact CD2-CD1 3.69Å; L29-Y120 HydrophobicContact CB-CE1 3.91Å; L29-I121 HydrophobicContact CD1-CD1 4.11Å; L29-I121 HydrophobicContact CG-CD1 4.49Å; L29-Y124 HydrophobicContact CD1-CD1 4.09Å; L29-Y124 HydrophobicContact CD1-CD2 3.93Å; L29-Y124 HydrophobicContact CD1-CE1 4.03Å; L29-Y124 HydrophobicContact CD1-CE2 3.91Å; L29-Y124 HydrophobicContact CD1-CG 4.04Å; L29-W158 PolarHBondContact O-NE1 3.16Å
30M91.6Very high90.1Very high0 Ų054.6 Ų54.60%030%0.295CS..  trans-95.1-13.6-178-64.5-47.8-49.500115.4L24 Y27 L28 S32 Y120 I161 T162L24-M30 HydrophobicContact CB-CB 4.31Å; L24-M30 HydrophobicContact CB-CE 4.36Å; L24-M30 HydrophobicContact CB-CG 4.27Å; L24-M30 HydrophobicContact CD1-CE 4.12Å; L24-M30 HydrophobicContact CD2-CG 4.39Å; L24-M30 WeakPolarHBondContact O-CB 3.25Å; Y27-M30 WeakPolarHBondContact O-CB 3.31Å; Y27-M30 PolarHBondContact O-N 2.91Å; Y27-M30 VanDerWaalsContact O-N 3.15Å; L28-M30 PolarHBondContact O-N 3.45Å; M30-S32 PolarHBondContact O-N 3.33Å; M30-Y120 HydrophobicContact SD-CD1 4.07Å; M30-Y120 HydrophobicContact SD-CE1 3.81Å; M30-I161 HydrophobicContact CE-CD1 3.71Å; M30-I161 HydrophobicContact CE-CG1 3.55Å; M30-I161 HydrophobicContact SD-CD1 3.35Å; M30-I161 WeakPolarHBondContact SD-CD1 3.36Å; M30-I161 HydrophobicContact SD-CG1 3.94Å; M30-T162 VanDerWaalsContact CE-OG1 3.25Å; M30-T162 WeakPolarHBondContact CE-OG1 3.45Å
31H86.7Confident90.8Very high139 Ų13959.9 Ų59.964%0.64432%0.323SS*.SBendtrans-65.5-35.6-176.6-175.4-85.3000113.7
32S86.9Confident91.5Very high17 Ų1761.6 Ų61.612%0.11933%0.334CS..  trans-159.8147.7-176.3-176.30000111.5H13 M30 V34H13-S32 PolarHBondContact NE2-OG 3.06Å; M30-S32 PolarHBondContact O-N 3.33Å; S32-V34 PolarHBondContact O-N 3.15Å; S32-V34 WeakPolarHBondContact OG-CG2 3.42Å; S32-V34 PolarHBondContact OG-N 3.4Å
33P88.8Confident92Very high17 Ų1757.2 Ų57.211%0.1131%0.309CS..Hα-helixtrans-71.9-6.5176.130.1-35.2000113.1V16 M36 T37 W158 W159V16-P33 HydrophobicContact CG1-CG 4.28Å; P33-M36 HydrophobicContact CB-CE 3.58Å; P33-M36 HydrophobicContact CB-CG 4.44Å; P33-M36 WeakPolarHBondContact O-CG 3.23Å; P33-T37 VanDerWaalsContact O-CB 3.26Å; P33-T37 WeakPolarHBondContact O-CB 3.02Å; P33-T37 PolarHBondContact O-N 3.25Å; P33-T37 PolarHBondContact O-OG1 3.1Å; P33-W158 HydrophobicContact CB-CD2 4.23Å; P33-W158 HydrophobicContact CB-CE3 3.95Å; P33-W158 HydrophobicContact CB-CH2 3.8Å; P33-W158 HydrophobicContact CB-CZ2 4.03Å; P33-W158 HydrophobicContact CB-CZ3 3.73Å; P33-W158 VanDerWaalsContact CD-CH2 3.45Å; P33-W158 HydrophobicContact CG-CH2 3.9Å; P33-W158 HydrophobicContact CG-CZ2 4.35Å; P33-W158 HydrophobicContact CG-CZ3 4.12Å; P33-W159 HydrophobicContact CB-CZ2 4.34Å
34V90.6Very high92.4Very high90 Ų9058 Ų5855%0.54532%0.318SS..Hα-helixtrans-66.3-52.5-177.1175.50000111.2S32 M36 T37 L38S32-V34 PolarHBondContact O-N 3.15Å; S32-V34 WeakPolarHBondContact OG-CG2 3.42Å; S32-V34 PolarHBondContact OG-N 3.4Å; V34-M36 PolarHBondContact O-N 3.35Å; V34-T37 PolarHBondContact O-N 3.29Å; V34-L38 WeakPolarHBondContact O-CB 3.45Å; V34-L38 PolarHBondContact O-N 3.12Å
35L92.1Very high92.8Very high91 Ų9163.5 Ų63.548%0.47634%0.342SS..Hα-helixtrans-64.9-42.7-176.7-179.957.3000111.2L29 T37 L38 I39L29-L35 HydrophobicContact CD2-CB 4.42Å; L29-L35 HydrophobicContact CD2-CD2 3.56Å; L29-L35 HydrophobicContact CD2-CG 3.67Å; L35-T37 VanDerWaalsContact C-N 3.33Å; L35-T37 PolarHBondContact O-N 3.02Å; L35-L38 PolarHBondContact O-N 2.74Å; L35-I39 HydrophobicContact CD1-CD1 4.22Å; L35-I39 HydrophobicContact CD1-CG1 4.37Å; L35-I39 HydrophobicContact CG-CD1 4.11Å; L35-I39 WeakPolarHBondContact O-CG1 3.43Å; L35-I39 PolarHBondContact O-N 3.13Å
36M93.1Very high93.4Very high0 Ų062.6 Ų62.60%035%0.345CS..Hα-helixtrans-64.1-38.6178.277.394.1-178.300111.8P33 V34 L40 Y124 W158P33-M36 HydrophobicContact CB-CE 3.58Å; P33-M36 HydrophobicContact CB-CG 4.44Å; P33-M36 WeakPolarHBondContact O-CG 3.23Å; V34-M36 PolarHBondContact O-N 3.35Å; M36-L40 VanDerWaalsContact O-CG 3.29Å; M36-L40 WeakPolarHBondContact O-CG 3.34Å; M36-L40 PolarHBondContact O-N 3.49Å; M36-Y124 WeakPolarHBondContact CB-OH 3.36Å; M36-W158 HydrophobicContact CE-CB 3.84Å; M36-W158 HydrophobicContact CE-CD2 3.79Å; M36-W158 HydrophobicContact CE-CE3 3.84Å; M36-W158 HydrophobicContact CE-CG 3.79Å; M36-W158 HydrophobicContact CG-CB 4.26Å; M36-W158 HydrophobicContact CG-CD2 4.24Å; M36-W158 HydrophobicContact CG-CG 3.79Å; M36-W158 HydrophobicContact SD-CB 3.74Å; M36-W158 HydrophobicContact SD-CD2 4.45Å; M36-W158 HydrophobicContact SD-CG 3.87Å
37T93.6Very high93.7Very high47 Ų4759.1 Ų59.129%0.28831%0.308SS..Hα-helixtrans-66.5-44174.5-58.40000111.8P33 V34 L35 I39 L40 L41P33-T37 VanDerWaalsContact O-CB 3.26Å; P33-T37 WeakPolarHBondContact O-CB 3.02Å; P33-T37 PolarHBondContact O-N 3.25Å; P33-T37 PolarHBondContact O-OG1 3.1Å; V34-T37 PolarHBondContact O-N 3.29Å; L35-T37 VanDerWaalsContact C-N 3.33Å; L35-T37 PolarHBondContact O-N 3.02Å; T37-I39 PolarHBondContact O-N 2.9Å; T37-L40 PolarHBondContact O-N 2.91Å; T37-L41 HydrophobicContact CG2-CD1 4.02Å; T37-L41 HydrophobicContact CG2-CG 4.29Å; T37-L41 WeakPolarHBondContact O-CG 3.3Å; T37-L41 PolarHBondContact O-N 2.82Å
38L95.8Very high93.8Very high100 Ų10059.7 Ų59.752%0.52432%0.319SS..Hα-helixtrans-59.8-46.6179-179.662.7000111.5V34 L35 L40 L41 T42V34-L38 WeakPolarHBondContact O-CB 3.45Å; V34-L38 PolarHBondContact O-N 3.12Å; L35-L38 PolarHBondContact O-N 2.74Å; L38-L40 VanDerWaalsContact C-N 3.27Å; L38-L40 PolarHBondContact O-N 2.92Å; L38-L41 PolarHBondContact O-N 2.83Å; L38-T42 WeakPolarHBondContact O-CB 3.37Å; L38-T42 PolarHBondContact O-N 3.46Å; L38-T42 PolarHBondContact O-OG1 3.3Å; L38-T42 VanDerWaalsContact O-OG1 3.05Å
39I96.7Very high93.9Very high59 Ų5959.8 Ų59.830%0.30331%0.312SS..Hα-helixtrans-56.1-44177.2-69.8166.2000110.8L29 L35 T37 T42 Y43 Y124 L127L29-I39 HydrophobicContact CD1-CD1 4.3Å; L29-I39 HydrophobicContact CD2-CD1 3.69Å; L35-I39 HydrophobicContact CD1-CD1 4.22Å; L35-I39 HydrophobicContact CD1-CG1 4.37Å; L35-I39 HydrophobicContact CG-CD1 4.11Å; L35-I39 WeakPolarHBondContact O-CG1 3.43Å; L35-I39 PolarHBondContact O-N 3.13Å; T37-I39 PolarHBondContact O-N 2.9Å; I39-T42 PolarHBondContact O-N 3.02Å; I39-Y43 VanDerWaalsContact O-CB 3.29Å; I39-Y43 WeakPolarHBondContact O-CB 3.46Å; I39-Y43 PolarHBondContact O-N 3.05Å; I39-Y124 HydrophobicContact CB-CE1 4.49Å; I39-Y124 HydrophobicContact CG2-CD1 3.88Å; I39-Y124 HydrophobicContact CG2-CE1 4.07Å; I39-L127 HydrophobicContact CG2-CD1 4.33Å
40L97Very high94.1Very high11 Ų1159.9 Ų59.96%0.05832%0.316CS..Hα-helixtrans-72-38.8-177.9-64.3174.2000112.8M36 T37 L38 Y43 V44 Y124 L127 P154 W155M36-L40 VanDerWaalsContact O-CG 3.29Å; M36-L40 WeakPolarHBondContact O-CG 3.34Å; M36-L40 PolarHBondContact O-N 3.49Å; T37-L40 PolarHBondContact O-N 2.91Å; L38-L40 VanDerWaalsContact C-N 3.27Å; L38-L40 PolarHBondContact O-N 2.92Å; L40-Y43 WeakPolarHBondContact O-CB 3.02Å; L40-Y43 PolarHBondContact O-N 3.32Å; L40-V44 WeakPolarHBondContact O-CG2 3.43Å; L40-V44 PolarHBondContact O-N 3.48Å; L40-Y124 HydrophobicContact CD2-CE1 4.12Å; L40-Y124 HydrophobicContact CG-CE1 4.3Å; L40-L127 HydrophobicContact CD2-CD1 4.09Å; L40-P154 HydrophobicContact CD1-CB 4.39Å; L40-P154 HydrophobicContact CD1-CG 4.15Å; L40-P154 HydrophobicContact CD2-CB 4.17Å; L40-P154 HydrophobicContact CD2-CG 3.51Å; L40-P154 HydrophobicContact CG-CG 4.48Å; L40-W155 HydrophobicContact CD1-CB 3.66Å; L40-W155 HydrophobicContact CD1-CG 4.47Å
41L96.6Very high94.4Very high115 Ų11560.4 Ų60.460%0.60232%0.322SS*.Hα-helixtrans-62.7-45.1173.1-70.3175.5000111.2T37 L38 Y43 V44 F45T37-L41 HydrophobicContact CG2-CD1 4.02Å; T37-L41 HydrophobicContact CG2-CG 4.29Å; T37-L41 WeakPolarHBondContact O-CG 3.3Å; T37-L41 PolarHBondContact O-N 2.82Å; L38-L41 PolarHBondContact O-N 2.83Å; L41-Y43 VanDerWaalsContact C-N 3.34Å; L41-Y43 PolarHBondContact O-N 3.45Å; L41-V44 PolarHBondContact O-N 3.36Å; L41-F45 WeakPolarHBondContact O-CB 3.32Å; L41-F45 PolarHBondContact O-N 3.48Å
42T97.1Very high94.8Very high62 Ų6255.3 Ų55.338%0.3830%0.301SS..Hα-helixtrans-61-43.6173.9-60.40000110.9L38 I39 V44 F45 L46L38-T42 WeakPolarHBondContact O-CB 3.37Å; L38-T42 PolarHBondContact O-N 3.46Å; L38-T42 PolarHBondContact O-OG1 3.3Å; L38-T42 VanDerWaalsContact O-OG1 3.05Å; I39-T42 PolarHBondContact O-N 3.02Å; T42-V44 PolarHBondContact O-N 2.98Å; T42-F45 PolarHBondContact O-N 3.37Å; T42-L46 HydrophobicContact CG2-CD1 3.7Å; T42-L46 HydrophobicContact CG2-CG 4.03Å; T42-L46 VanDerWaalsContact O-CB 3.31Å; T42-L46 WeakPolarHBondContact O-CB 3.28Å; T42-L46 VanDerWaalsContact O-CG 3.23Å; T42-L46 WeakPolarHBondContact O-CG 3.4Å; T42-L46 PolarHBondContact O-N 3.49Å
43Y97.4Very high95.2Very high17 Ų1761.3 Ų61.37%0.06732%0.321CS..Hα-helixtrans-57.3-48.9175.9159.1-98.7000112.3I39 L40 L41 L46 S47 L127 T130 V147 H150 S151I39-Y43 VanDerWaalsContact O-CB 3.29Å; I39-Y43 WeakPolarHBondContact O-CB 3.46Å; I39-Y43 PolarHBondContact O-N 3.05Å; L40-Y43 WeakPolarHBondContact O-CB 3.02Å; L40-Y43 PolarHBondContact O-N 3.32Å; L41-Y43 VanDerWaalsContact C-N 3.34Å; L41-Y43 PolarHBondContact O-N 3.45Å; Y43-L46 PolarHBondContact O-N 3.29Å; Y43-S47 WeakPolarHBondContact CD2-OG 3.33Å; Y43-S47 VanDerWaalsContact CE2-OG 3.28Å; Y43-S47 WeakPolarHBondContact CE2-OG 3.48Å; Y43-S47 WeakPolarHBondContact O-CB 3.39Å; Y43-S47 PolarHBondContact O-N 2.82Å; Y43-S47 PolarHBondContact O-OG 3.13Å; Y43-L127 HydrophobicContact CD1-CD2 4.13Å; Y43-L127 HydrophobicContact CD2-CB 3.82Å; Y43-L127 HydrophobicContact CD2-CD1 4.18Å; Y43-L127 HydrophobicContact CD2-CD2 3.89Å; Y43-L127 HydrophobicContact CD2-CG 4.17Å; Y43-L127 HydrophobicContact CE1-CD2 4.06Å; Y43-L127 HydrophobicContact CE2-CB 3.94Å; Y43-L127 HydrophobicContact CE2-CD2 3.78Å; Y43-L127 HydrophobicContact CE2-CG 4.36Å; Y43-L127 HydrophobicContact CG-CD1 4.16Å; Y43-L127 HydrophobicContact CG-CD2 4.06Å; Y43-L127 HydrophobicContact CG-CG 4.5Å; Y43-T130 HydrophobicContact CE2-CG2 4.09Å; Y43-T130 WeakPolarHBondContact CE2-OG1 3.43Å; Y43-T130 PolarHBondContact OH-OG1 2.93Å; Y43-V147 HydrophobicContact CE1-CG1 4.43Å; Y43-H150 HydrophobicContact CE1-CB 4.39Å; Y43-H150 WeakPolarHBondContact OH-CB 3.19Å; Y43-S151 WeakPolarHBondContact CE1-OG 3.33Å
44V97Very high95.6Very high54 Ų5466.2 Ų66.233%0.32734%0.341SS..Hα-helixtrans-62.7-47179172.50000110.4L40 L41 T42 L46 S47 V48 V147 S151L40-V44 WeakPolarHBondContact O-CG2 3.43Å; L40-V44 PolarHBondContact O-N 3.48Å; L41-V44 PolarHBondContact O-N 3.36Å; T42-V44 PolarHBondContact O-N 2.98Å; V44-L46 PolarHBondContact O-N 2.97Å; V44-S47 PolarHBondContact O-N 3.34Å; V44-V48 WeakPolarHBondContact O-CB 3.45Å; V44-V48 PolarHBondContact O-N 2.89Å; V44-V147 HydrophobicContact CG2-CG1 4.28Å; V44-S151 VanDerWaalsContact CG2-OG 3.27Å; V44-S151 WeakPolarHBondContact CG2-OG 3.49Å
45F97.3Very high95.9Very high116 Ų11662.1 Ų62.151%0.50932%0.316SS..Iπ-helixtrans-59.4-47.3178.4174.2-106.3000112.3L41 T42 Y49 A50L41-F45 WeakPolarHBondContact O-CB 3.32Å; L41-F45 PolarHBondContact O-N 3.48Å; T42-F45 PolarHBondContact O-N 3.37Å; F45-Y49 HydrophobicContact CD2-CD1 4.24Å; F45-Y49 HydrophobicContact CD2-CG 4.48Å; F45-Y49 AromaticContact CE2-CD1 3.51Å; F45-Y49 HydrophobicContact CE2-CD1 3.51Å; F45-Y49 HydrophobicContact CE2-CE1 4.18Å; F45-Y49 HydrophobicContact CE2-CG 4.15Å; F45-Y49 HydrophobicContact CZ-CD1 4.01Å; F45-Y49 WeakPolarHBondContact O-CA 3.29Å; F45-Y49 WeakPolarHBondContact O-CB 3.32Å; F45-Y49 PolarHBondContact O-N 2.93Å; F45-A50 HydrophobicContact CD1-CB 4.2Å; F45-A50 HydrophobicContact CE1-CB 3.7Å; F45-A50 HydrophobicContact CZ-CB 3.95Å; F45-A50 PolarHBondContact O-N 2.84Å
46L96.7Very high96Very high90 Ų9060.3 Ų60.347%0.47131%0.314SS..Iπ-helixtrans-66.2-41.6178.1-70.2-179.8000111.8T42 Y43 V44 A50 G51T42-L46 HydrophobicContact CG2-CD1 3.7Å; T42-L46 HydrophobicContact CG2-CG 4.03Å; T42-L46 VanDerWaalsContact O-CB 3.31Å; T42-L46 WeakPolarHBondContact O-CB 3.28Å; T42-L46 VanDerWaalsContact O-CG 3.23Å; T42-L46 WeakPolarHBondContact O-CG 3.4Å; T42-L46 PolarHBondContact O-N 3.49Å; Y43-L46 PolarHBondContact O-N 3.29Å; V44-L46 PolarHBondContact O-N 2.97Å; L46-A50 HydrophobicContact CD2-CB 4.07Å; L46-G51 WeakPolarHBondContact O-CA 3.34Å; L46-G51 PolarHBondContact O-N 3.48Å
47S95Very high96.2Very high5 Ų568.3 Ų68.34%0.03536%0.357CS..Iπ-helixtrans-71.3-42.1-174.8-630000113Y43 V44 P52 T130Y43-S47 WeakPolarHBondContact CD2-OG 3.33Å; Y43-S47 VanDerWaalsContact CE2-OG 3.28Å; Y43-S47 WeakPolarHBondContact CE2-OG 3.48Å; Y43-S47 WeakPolarHBondContact O-CB 3.39Å; Y43-S47 PolarHBondContact O-N 2.82Å; Y43-S47 PolarHBondContact O-OG 3.13Å; V44-S47 PolarHBondContact O-N 3.34Å; S47-P52 WeakPolarHBondContact O-CD 3.43Å; S47-P52 WeakPolarHBondContact O-CG 3.49Å; S47-T130 VanDerWaalsContact OG-CG2 3.32Å; S47-T130 WeakPolarHBondContact OG-CG2 3.05Å
48V94.6Very high96.3Very high84 Ų8472.5 Ų72.551%0.50937%0.367SS..Iπ-helixtrans-97.8-33.3-171.1-178.80000112.1V44 V147V44-V48 WeakPolarHBondContact O-CB 3.45Å; V44-V48 PolarHBondContact O-N 2.89Å; V48-V147 HydrophobicContact CG2-CG1 4.25Å; V48-V147 HydrophobicContact CG2-CG2 4.22Å
49Y95.5Very high96.3Very high117 Ų11776.6 Ų76.646%0.45938%0.381SS..Iπ-helixtrans-112.7-63.6-170.8-174.4-88.7000113.5F45 R53F45-Y49 HydrophobicContact CD2-CD1 4.24Å; F45-Y49 HydrophobicContact CD2-CG 4.48Å; F45-Y49 AromaticContact CE2-CD1 3.51Å; F45-Y49 HydrophobicContact CE2-CD1 3.51Å; F45-Y49 HydrophobicContact CE2-CE1 4.18Å; F45-Y49 HydrophobicContact CE2-CG 4.15Å; F45-Y49 HydrophobicContact CZ-CD1 4.01Å; F45-Y49 WeakPolarHBondContact O-CA 3.29Å; F45-Y49 WeakPolarHBondContact O-CB 3.32Å; F45-Y49 PolarHBondContact O-N 2.93Å; Y49-R53 VanDerWaalsContact CZ-CZ 3.48Å; Y49-R53 WeakPolarHBondContact O-CG 3.37Å; Y49-R53 PolarHBondContact O-NH1 3.14Å
50A97.2Very high96.3Very high26 Ų2677.5 Ų77.522%0.21539%0.391CS..Iπ-helixtrans-77.7-44.6-167.800000112.7F45 L46 R53 F54F45-A50 HydrophobicContact CD1-CB 4.2Å; F45-A50 HydrophobicContact CE1-CB 3.7Å; F45-A50 HydrophobicContact CZ-CB 3.95Å; F45-A50 PolarHBondContact O-N 2.84Å; L46-A50 HydrophobicContact CD2-CB 4.07Å; A50-R53 PolarHBondContact O-N 3.23Å; A50-F54 WeakPolarHBondContact O-CB 3.45Å; A50-F54 PolarHBondContact O-N 3.09Å
51G96.1Very high96.2Very high12 Ų1281 Ų8112%0.12441%0.41CS..Hα-helixtrans-60.9-49.8-179.600000113.8L46 R53 F54 M55L46-G51 WeakPolarHBondContact O-CA 3.34Å; L46-G51 PolarHBondContact O-N 3.48Å; G51-R53 VanDerWaalsContact C-N 3.3Å; G51-R53 PolarHBondContact O-N 3.14Å; G51-F54 PolarHBondContact O-N 3.19Å; G51-M55 WeakPolarHBondContact O-CB 3.37Å; G51-M55 WeakPolarHBondContact O-CG 3.41Å; G51-M55 PolarHBondContact O-N 2.95Å
52P95.4Very high96.1Very high32 Ų3282.3 Ų82.321%0.20842%0.417CS..Hα-helixtrans-58-40175.1-2634.4000113.3S47 M55 A56S47-P52 WeakPolarHBondContact O-CD 3.43Å; S47-P52 WeakPolarHBondContact O-CG 3.49Å; P52-M55 PolarHBondContact O-N 3.25Å; P52-A56 PolarHBondContact O-N 3Å
53R96.3Very high95.9Very high143 Ų14380.7 Ų80.754%0.5441%0.406SS..Hα-helixtrans-66.5-44.8175.9-76.8179.1171.872.21112.1Y49 A50 G51 M55 A56Y49-R53 VanDerWaalsContact CZ-CZ 3.48Å; Y49-R53 WeakPolarHBondContact O-CG 3.37Å; Y49-R53 PolarHBondContact O-NH1 3.14Å; A50-R53 PolarHBondContact O-N 3.23Å; G51-R53 VanDerWaalsContact C-N 3.3Å; G51-R53 PolarHBondContact O-N 3.14Å; R53-M55 PolarHBondContact O-N 2.87Å; R53-A56 VanDerWaalsContact O-CB 3.23Å; R53-A56 WeakPolarHBondContact O-CB 3.15Å; R53-A56 PolarHBondContact O-N 2.97Å; R53-A56 VanDerWaalsContact O-N 3.11Å
54F96.3Very high95.7Very high120 Ų12084.4 Ų84.453%0.52642%0.422SS..Hα-helixtrans-59.3-36.5176177.4-100000112.4A50 G51 R58A50-F54 WeakPolarHBondContact O-CB 3.45Å; A50-F54 PolarHBondContact O-N 3.09Å; G51-F54 PolarHBondContact O-N 3.19Å; F54-R58 VanDerWaalsContact CE2-NH2 3.3Å; F54-R58 WeakPolarHBondContact O-CD 3.44Å; F54-R58 PolarHBondContact O-NE 2.79Å
55M96.9Very high95.6Very high4 Ų485.1 Ų85.12%0.0243%0.434CS..THydrogen-bonded Turntrans-86.7-3.7178.4-68.5-60.7-60.600114.2G51 P52 R53 N57 R58 K59 L61 V134 L135 K137G51-M55 WeakPolarHBondContact O-CB 3.37Å; G51-M55 WeakPolarHBondContact O-CG 3.41Å; G51-M55 PolarHBondContact O-N 2.95Å; P52-M55 PolarHBondContact O-N 3.25Å; R53-M55 PolarHBondContact O-N 2.87Å; M55-N57 PolarHBondContact O-N 3.38Å; M55-R58 HydrophobicContact CE-CB 4.11Å; M55-R58 PolarHBondContact O-N 3.35Å; M55-R58 HydrophobicContact SD-CB 4.25Å; M55-K59 WeakPolarHBondContact CE-O 3.38Å; M55-L61 HydrophobicContact CE-CG 4.41Å; M55-V134 HydrophobicContact CG-CG1 4.27Å; M55-L135 WeakPolarHBondContact CE-O 3.45Å; M55-L135 HydrophobicContact SD-CD2 4.12Å; M55-K137 HydrophobicContact CB-CG 4.28Å; M55-K137 HydrophobicContact CE-CG 4.22Å; M55-K137 WeakPolarHBondContact O-CE 3.33Å; M55-K137 PolarHBondContact O-NZ 3Å
56A95.2Very high95.5Very high53 Ų5382.8 Ų82.844%0.43843%0.43SS..THydrogen-bonded Turntrans-57.4-50.4-175.200000111.4P52 R53 K137P52-A56 PolarHBondContact O-N 3Å; R53-A56 VanDerWaalsContact O-CB 3.23Å; R53-A56 WeakPolarHBondContact O-CB 3.15Å; R53-A56 PolarHBondContact O-N 2.97Å; R53-A56 VanDerWaalsContact O-N 3.11Å; A56-K137 PolarHBondContact O-NZ 3.47Å
57N96.2Very high95.5Very high168 Ų16879.1 Ų79.190%0.89841%0.411SS*.THydrogen-bonded Turntrans-94.512.8-178.3-61.3-29.1000113.7M55M55-N57 PolarHBondContact O-N 3.38Å
58R96.1Very high95.6Very high134 Ų13480.5 Ų80.551%0.50642%0.419SS..SBendtrans-112.1151.7179-61.2-179.5-175-103.3-2110.8F54 M55 K137F54-R58 VanDerWaalsContact CE2-NH2 3.3Å; F54-R58 WeakPolarHBondContact O-CD 3.44Å; F54-R58 PolarHBondContact O-NE 2.79Å; M55-R58 HydrophobicContact CE-CB 4.11Å; M55-R58 PolarHBondContact O-N 3.35Å; M55-R58 HydrophobicContact SD-CB 4.25Å; R58-K137 WeakPolarHBondContact O-CD 3.3Å; R58-K137 PolarHBondContact O-NZ 2.9Å
59K95.6Very high95.7Very high186 Ų18681 Ų8181%0.80942%0.422SS*.PPolyproline II helixtrans-70.2146.1168.4-66.5-177-178.8179.10109.3M55 L61M55-K59 WeakPolarHBondContact CE-O 3.38Å; K59-L61 PolarHBondContact O-N 3.45Å
60P96.1Very high95.8Very high79 Ų7976.5 Ų76.551%0.51341%0.405SS..PPolyproline II helixtrans-60.3136.7174.427.1-33.7000109.9R136 K137P60-R136 WeakPolarHBondContact CB-O 3.29Å; P60-K137 HydrophobicContact CB-CB 4.31Å; P60-K137 HydrophobicContact CB-CD 4.26Å; P60-K137 HydrophobicContact CB-CG 4.12Å
61L95.5Very high95.9Very high85 Ų8575.4 Ų75.445%0.44540%0.395SS..PPolyproline II helixtrans-74.3141.5179.1-61.3-176.5000110.8M55 K59 L63 L135M55-L61 HydrophobicContact CE-CG 4.41Å; K59-L61 PolarHBondContact O-N 3.45Å; L61-L63 HydrophobicContact CB-CD1 4.23Å; L61-L63 HydrophobicContact CB-CD2 4.17Å; L61-L63 HydrophobicContact CB-CG 3.89Å; L61-L63 PolarHBondContact O-N 3.28Å; L61-L135 HydrophobicContact CD1-CB 4.22Å; L61-L135 HydrophobicContact CD1-CD1 4.41Å; L61-L135 HydrophobicContact CD1-CD2 4.17Å; L61-L135 PolarHBondContact N-O 3.22Å
62D93.9Very high96Very high141 Ų14178.6 Ų78.675%0.75441%0.405SS*.  trans-83.3101.1167.7-172.25.8000109.6K64D62-K64 WeakPolarHBondContact OD1-CB 3.41Å; D62-K64 PolarHBondContact OD1-N 2.93Å
63L94.6Very high96.1Very high28 Ų2880.2 Ų80.215%0.14742%0.418CS..  trans-11125.2-178.5-60.5176.4000111.8L61 A65 P66 M67 F132 L135 R136L61-L63 HydrophobicContact CB-CD1 4.23Å; L61-L63 HydrophobicContact CB-CD2 4.17Å; L61-L63 HydrophobicContact CB-CG 3.89Å; L61-L63 PolarHBondContact O-N 3.28Å; L63-A65 PolarHBondContact O-N 3.3Å; L63-P66 HydrophobicContact CD2-CG 4.46Å; L63-P66 WeakPolarHBondContact O-CD 3.26Å; L63-M67 HydrophobicContact CB-CG 4.33Å; L63-M67 VanDerWaalsContact O-CB 3.31Å; L63-M67 WeakPolarHBondContact O-CB 3.39Å; L63-M67 WeakPolarHBondContact O-CG 3.34Å; L63-M67 PolarHBondContact O-N 3.45Å; L63-F132 HydrophobicContact CB-CD1 4.29Å; L63-F132 HydrophobicContact CD1-CD1 3.87Å; L63-F132 HydrophobicContact CD1-CE1 4.4Å; L63-L135 HydrophobicContact CD1-CB 3.66Å; L63-L135 HydrophobicContact CD1-CD1 3.84Å; L63-L135 HydrophobicContact CD1-CG 4.42Å; L63-R136 HydrophobicContact CD1-CG 4.33Å
64K92.5Very high96.2Very high96 Ų9673.5 Ų73.542%0.41739%0.393SS..Hα-helixtrans-54.8-55.9-175.5-168-170.1176.3-172.10113D62 M67 V68 S192 A193D62-K64 WeakPolarHBondContact OD1-CB 3.41Å; D62-K64 PolarHBondContact OD1-N 2.93Å; K64-M67 PolarHBondContact O-N 3.15Å; K64-V68 WeakPolarHBondContact O-CG2 3.43Å; K64-V68 PolarHBondContact O-N 3.03Å; K64-S192 VanDerWaalsContact CE-O 3.22Å; K64-S192 WeakPolarHBondContact CE-O 3.4Å; K64-S192 WeakPolarHBondContact CG-O 3.36Å; K64-A193 WeakPolarHBondContact CE-O 3.45Å; K64-A193 PolarHBondContact NZ-O 2.79Å
65A94.3Very high96.3Very high69 Ų6969 Ų6957%0.5738%0.375SS*.Hα-helixtrans-64.6-48.1-178.500000112.6L63 M67 V68 V69L63-A65 PolarHBondContact O-N 3.3Å; A65-M67 VanDerWaalsContact C-N 3.3Å; A65-M67 PolarHBondContact O-N 2.98Å; A65-V68 PolarHBondContact O-N 2.87Å; A65-V68 VanDerWaalsContact O-N 3.15Å; A65-V69 WeakPolarHBondContact O-CG2 3.27Å; A65-V69 PolarHBondContact O-N 3.43Å
66P96.5Very high96.4Very high66 Ų6673.9 Ų73.943%0.42941%0.405SS..Hα-helixtrans-54-43.4172.7-28.534.1000113.6L63 V69 Y70 F132L63-P66 HydrophobicContact CD2-CG 4.46Å; L63-P66 WeakPolarHBondContact O-CD 3.26Å; P66-V69 PolarHBondContact O-N 3.12Å; P66-Y70 WeakPolarHBondContact O-CB 3.49Å; P66-Y70 PolarHBondContact O-N 2.94Å; P66-F132 HydrophobicContact CB-CE1 4.34Å
67M96.3Very high96.5Very high13 Ų1373.2 Ų73.26%0.06439%0.393CS..Hα-helixtrans-65.4-40.2178.1-74.6-176.872.400112.3L63 K64 A65 N71 F132 R136L63-M67 HydrophobicContact CB-CG 4.33Å; L63-M67 VanDerWaalsContact O-CB 3.31Å; L63-M67 WeakPolarHBondContact O-CB 3.39Å; L63-M67 WeakPolarHBondContact O-CG 3.34Å; L63-M67 PolarHBondContact O-N 3.45Å; K64-M67 PolarHBondContact O-N 3.15Å; A65-M67 VanDerWaalsContact C-N 3.3Å; A65-M67 PolarHBondContact O-N 2.98Å; M67-N71 VanDerWaalsContact O-CB 3.32Å; M67-N71 WeakPolarHBondContact O-CB 3.23Å; M67-N71 VanDerWaalsContact O-CG 3.32Å; M67-N71 PolarHBondContact O-N 2.93Å; M67-N71 PolarHBondContact O-ND2 3.25Å; M67-F132 HydrophobicContact CE-CB 4.34Å; M67-F132 HydrophobicContact CG-CB 4.34Å; M67-F132 HydrophobicContact CG-CD1 3.56Å; M67-F132 HydrophobicContact CG-CD2 4.19Å; M67-F132 HydrophobicContact CG-CE1 3.82Å; M67-F132 HydrophobicContact CG-CE2 4.43Å; M67-F132 HydrophobicContact CG-CG 3.78Å; M67-F132 HydrophobicContact CG-CZ 4.25Å; M67-F132 HydrophobicContact SD-CB 4.23Å; M67-F132 HydrophobicContact SD-CD1 4.35Å; M67-F132 HydrophobicContact SD-CG 4.32Å; M67-R136 WeakPolarHBondContact SD-CD 3.48Å; M67-R136 PolarHBondContact SD-NH1 3.26Å
68V96.1Very high96.7Very high34 Ų3465.2 Ų65.221%0.20635%0.35CS..Hα-helixtrans-61.5-49.8176.8169.40000110.2K64 A65 Y70 N71 F72 A193K64-V68 WeakPolarHBondContact O-CG2 3.43Å; K64-V68 PolarHBondContact O-N 3.03Å; A65-V68 PolarHBondContact O-N 2.87Å; A65-V68 VanDerWaalsContact O-N 3.15Å; V68-Y70 PolarHBondContact O-N 3.47Å; V68-N71 PolarHBondContact O-N 3.06Å; V68-F72 HydrophobicContact CG1-CD2 3.7Å; V68-F72 HydrophobicContact CG1-CE2 3.77Å; V68-F72 VanDerWaalsContact O-CD2 3.23Å; V68-F72 WeakPolarHBondContact O-CD2 3.44Å; V68-F72 PolarHBondContact O-N 3.15Å; V68-A193 HydrophobicContact CG2-CB 4.27Å
69V97.5Very high96.8Very high96 Ų9660.3 Ų60.358%0.58234%0.341SS*.Hα-helixtrans-60-47.9178.2174.60000111A65 P66 F72 S73A65-V69 WeakPolarHBondContact O-CG2 3.27Å; A65-V69 PolarHBondContact O-N 3.43Å; P66-V69 PolarHBondContact O-N 3.12Å; V69-F72 PolarHBondContact O-N 3.06Å; V69-S73 WeakPolarHBondContact O-CB 3.37Å; V69-S73 PolarHBondContact O-N 3.44Å; V69-S73 PolarHBondContact O-OG 3.44Å
70Y98.1Very high96.9Very high22 Ų2256.2 Ų56.29%0.08632%0.321CS..Hα-helixtrans-58.3-52.9178.1165-96.8000111.8P66 V68 F72 S73 M74 I125 L128 D129 F132 Y185P66-Y70 WeakPolarHBondContact O-CB 3.49Å; P66-Y70 PolarHBondContact O-N 2.94Å; V68-Y70 PolarHBondContact O-N 3.47Å; Y70-F72 PolarHBondContact O-N 2.66Å; Y70-S73 WeakPolarHBondContact O-CB 3.04Å; Y70-S73 PolarHBondContact O-N 3.16Å; Y70-S73 VanDerWaalsContact O-N 3.13Å; Y70-M74 HydrophobicContact CD1-CG 4.43Å; Y70-M74 HydrophobicContact CD2-CG 4.22Å; Y70-M74 HydrophobicContact CE1-CG 4.02Å; Y70-M74 HydrophobicContact CE2-CG 3.8Å; Y70-M74 HydrophobicContact CE2-SD 3.94Å; Y70-M74 WeakPolarHBondContact O-CG 3.41Å; Y70-M74 PolarHBondContact O-N 3.24Å; Y70-I125 HydrophobicContact CE2-CG2 4.06Å; Y70-I125 PolarHBondContact OH-O 2.82Å; Y70-L128 HydrophobicContact CD2-CB 4.44Å; Y70-L128 HydrophobicContact CD2-CD1 4.09Å; Y70-L128 HydrophobicContact CE2-CB 3.8Å; Y70-L128 HydrophobicContact CE2-CD1 3.87Å; Y70-L128 HydrophobicContact CE2-CG 4.43Å; Y70-D129 WeakPolarHBondContact CE1-OD1 3.25Å; Y70-D129 VanDerWaalsContact CZ-OD1 3.23Å; Y70-D129 PolarHBondContact OH-OD1 2.94Å; Y70-F132 HydrophobicContact CD1-CD2 4.19Å; Y70-F132 AromaticContact CD1-CE2 3.49Å; Y70-F132 HydrophobicContact CD1-CE2 3.49Å; Y70-F132 VanDerWaalsContact CD1-CE2 3.49Å; Y70-F132 HydrophobicContact CD1-CZ 4.33Å; Y70-F132 HydrophobicContact CD2-CE2 4.06Å; Y70-F132 HydrophobicContact CE1-CD2 4.3Å; Y70-F132 AromaticContact CE1-CE2 3.89Å; Y70-F132 HydrophobicContact CE1-CE2 3.89Å; Y70-F132 HydrophobicContact CE2-CE2 4.41Å; Y70-F132 AromaticContact CG-CE2 3.57Å; Y70-F132 HydrophobicContact CG-CE2 3.57Å; Y70-F132 HydrophobicContact CG-CZ 4.07Å; Y70-Y185 HydrophobicContact CE1-CE1 4.08Å
71N98Very high97Very high3 Ų352.4 Ų52.42%0.01630%0.297CS..Hα-helixtrans-61.9-42.5-177.4-76.5-64.5000111.6M67 V68 M74 V75 Y185 Y188 G189M67-N71 VanDerWaalsContact O-CB 3.32Å; M67-N71 WeakPolarHBondContact O-CB 3.23Å; M67-N71 VanDerWaalsContact O-CG 3.32Å; M67-N71 PolarHBondContact O-N 2.93Å; M67-N71 PolarHBondContact O-ND2 3.25Å; V68-N71 PolarHBondContact O-N 3.06Å; N71-M74 WeakPolarHBondContact O-CB 3.21Å; N71-M74 PolarHBondContact O-N 3.17Å; N71-V75 WeakPolarHBondContact O-CG2 3.28Å; N71-V75 PolarHBondContact O-N 3.18Å; N71-Y185 WeakPolarHBondContact OD1-CD1 3.23Å; N71-Y188 WeakPolarHBondContact OD1-CB 3.33Å; N71-G189 VanDerWaalsContact CB-CA 3.48Å
72F97.9Very high97.2Very high78 Ų7849.9 Ų49.934%0.34229%0.285SS..Hα-helixtrans-69.3-33.2176.2-77-62.7000112.8V68 V69 Y70 M74 V75 V76 F186V68-F72 HydrophobicContact CG1-CD2 3.7Å; V68-F72 HydrophobicContact CG1-CE2 3.77Å; V68-F72 VanDerWaalsContact O-CD2 3.23Å; V68-F72 WeakPolarHBondContact O-CD2 3.44Å; V68-F72 PolarHBondContact O-N 3.15Å; V69-F72 PolarHBondContact O-N 3.06Å; Y70-F72 PolarHBondContact O-N 2.66Å; F72-M74 VanDerWaalsContact C-N 3.3Å; F72-M74 PolarHBondContact O-N 2.63Å; F72-V75 WeakPolarHBondContact O-CB 3.26Å; F72-V75 PolarHBondContact O-N 3.21Å; F72-V76 PolarHBondContact O-N 3.15Å; F72-V76 VanDerWaalsContact O-N 3.09Å; F72-F186 AromaticContact CE1-CD2 3.88Å; F72-F186 HydrophobicContact CE1-CD2 3.88Å; F72-F186 AromaticContact CE1-CE2 3.97Å; F72-F186 HydrophobicContact CE1-CE2 3.97Å
73S98.3Very high97.4Very high66 Ų6648 Ų4846%0.46227%0.271SS..Hα-helixtrans-63.4-39171.4-55.80000111.2V69 Y70 V76 M77V69-S73 WeakPolarHBondContact O-CB 3.37Å; V69-S73 PolarHBondContact O-N 3.44Å; V69-S73 PolarHBondContact O-OG 3.44Å; Y70-S73 WeakPolarHBondContact O-CB 3.04Å; Y70-S73 PolarHBondContact O-N 3.16Å; Y70-S73 VanDerWaalsContact O-N 3.13Å; S73-V76 PolarHBondContact O-N 2.84Å; S73-M77 WeakPolarHBondContact O-CB 3.49Å; S73-M77 PolarHBondContact O-N 3.46Å
74M98.4Very high97.5Very high3 Ų347.5 Ų47.52%0.01527%0.268CS..Hα-helixtrans-64.8-36.6173.9-68.1-58.8-60.400112.4Y70 N71 F72 M77 N78 I125 E126 Y185Y70-M74 HydrophobicContact CD1-CG 4.43Å; Y70-M74 HydrophobicContact CD2-CG 4.22Å; Y70-M74 HydrophobicContact CE1-CG 4.02Å; Y70-M74 HydrophobicContact CE2-CG 3.8Å; Y70-M74 HydrophobicContact CE2-SD 3.94Å; Y70-M74 WeakPolarHBondContact O-CG 3.41Å; Y70-M74 PolarHBondContact O-N 3.24Å; N71-M74 WeakPolarHBondContact O-CB 3.21Å; N71-M74 PolarHBondContact O-N 3.17Å; F72-M74 VanDerWaalsContact C-N 3.3Å; F72-M74 PolarHBondContact O-N 2.63Å; M74-M77 HydrophobicContact CE-CE 3.35Å; M74-M77 HydrophobicContact SD-CE 3.29Å; M74-M77 WeakPolarHBondContact SD-CE 3.26Å; M74-N78 WeakPolarHBondContact O-CB 3.3Å; M74-N78 PolarHBondContact O-N 2.79Å; M74-N78 PolarHBondContact O-ND2 3.48Å; M74-I125 HydrophobicContact SD-CB 4.42Å; M74-I125 HydrophobicContact SD-CG2 3.59Å; M74-I125 VanDerWaalsContact SD-CG2 3.59Å; M74-E126 HydrophobicContact CE-CG 3.39Å; M74-Y185 HydrophobicContact CB-CD1 3.69Å; M74-Y185 HydrophobicContact CB-CD2 3.63Å; M74-Y185 HydrophobicContact CB-CE1 4.17Å; M74-Y185 HydrophobicContact CB-CE2 4.09Å; M74-Y185 HydrophobicContact CB-CG 3.44Å; M74-Y185 VanDerWaalsContact CB-CG 3.44Å; M74-Y185 HydrophobicContact CE-CD2 4.2Å; M74-Y185 HydrophobicContact CE-CE2 3.61Å; M74-Y185 HydrophobicContact CG-CD1 3.98Å; M74-Y185 HydrophobicContact CG-CD2 4.38Å; M74-Y185 HydrophobicContact CG-CE1 4.02Å; M74-Y185 HydrophobicContact CG-CE2 4.38Å; M74-Y185 HydrophobicContact CG-CG 4.21Å
75V98.6Very high97.7Very high25 Ų2543 Ų4315%0.15225%0.248CC..Hα-helixtrans-59.8-50.6172.9172.60000110.4N71 F72 N78 G79 V182 F186N71-V75 WeakPolarHBondContact O-CG2 3.28Å; N71-V75 PolarHBondContact O-N 3.18Å; F72-V75 WeakPolarHBondContact O-CB 3.26Å; F72-V75 PolarHBondContact O-N 3.21Å; V75-N78 PolarHBondContact O-N 3.41Å; V75-G79 PolarHBondContact O-N 2.73Å; V75-V182 HydrophobicContact CG1-CG1 4.1Å; V75-F186 HydrophobicContact CG2-CB 3.9Å; V75-F186 VanDerWaalsContact CG2-N 3.27Å
76V98.6Very high97.9Very high107 Ų10742.7 Ų42.765%0.64824%0.237SC*.Hα-helixtrans-62.1-46.6179.4174.60000111F72 S73 G79 Y80F72-V76 PolarHBondContact O-N 3.15Å; F72-V76 VanDerWaalsContact O-N 3.09Å; S73-V76 PolarHBondContact O-N 2.84Å; V76-G79 PolarHBondContact O-N 3.45Å; V76-Y80 WeakPolarHBondContact O-CB 3.45Å; V76-Y80 PolarHBondContact O-N 3.02Å
77M98.5Very high97.9Very high39 Ų3942.2 Ų42.219%0.19223%0.233CC..Hα-helixtrans-62.3-46.1179.9-177.6176.459.900112S73 M74 Y80 I81 I125S73-M77 WeakPolarHBondContact O-CB 3.49Å; S73-M77 PolarHBondContact O-N 3.46Å; M74-M77 HydrophobicContact CE-CE 3.35Å; M74-M77 HydrophobicContact SD-CE 3.29Å; M74-M77 WeakPolarHBondContact SD-CE 3.26Å; M77-Y80 WeakPolarHBondContact O-CB 3.29Å; M77-Y80 PolarHBondContact O-N 3.12Å; M77-I81 HydrophobicContact CG-CD1 4.02Å; M77-I81 VanDerWaalsContact O-CG1 3.28Å; M77-I81 WeakPolarHBondContact O-CG1 3.2Å; M77-I81 PolarHBondContact O-N 2.82Å; M77-I125 HydrophobicContact CE-CB 4.45Å; M77-I125 HydrophobicContact CE-CD1 4.05Å; M77-I125 HydrophobicContact CE-CG2 4.41Å; M77-I125 HydrophobicContact SD-CD1 3.73Å
78N98.6Very high97.9Very high0 Ų044.6 Ų44.60%024%0.241CC..Hα-helixtrans-67.2-37.7177.9-79.5-78000111.9M74 V75 Y80 I81 V82 H181 V182M74-N78 WeakPolarHBondContact O-CB 3.3Å; M74-N78 PolarHBondContact O-N 2.79Å; M74-N78 PolarHBondContact O-ND2 3.48Å; V75-N78 PolarHBondContact O-N 3.41Å; N78-Y80 VanDerWaalsContact C-N 3.33Å; N78-Y80 PolarHBondContact O-N 2.72Å; N78-I81 PolarHBondContact O-N 3.3Å; N78-V82 WeakPolarHBondContact O-CG2 3.36Å; N78-V82 PolarHBondContact O-N 2.69Å; N78-H181 HydrophobicContact CB-CB 4.24Å; N78-H181 WeakPolarHBondContact OD1-CB 3.26Å; N78-V182 HydrophobicContact CB-CG2 3.7Å
79G98.6Very high97.8Very high31 Ų3143 Ų4332%0.3223%0.231SC..Hα-helixtrans-61.8-42.4173.500000112.1V75 V76 V82 H83V75-G79 PolarHBondContact O-N 2.73Å; V76-G79 PolarHBondContact O-N 3.45Å; G79-V82 PolarHBondContact O-N 2.94Å; G79-H83 PolarHBondContact O-N 3.29Å
80Y98.6Very high97.7Very high99 Ų9938.5 Ų38.539%0.38820%0.204SC..Hα-helixtrans-61.4-44.4172.8176.9-98.6000111.7V76 M77 N78 V82 H83 Q84 I118V76-Y80 WeakPolarHBondContact O-CB 3.45Å; V76-Y80 PolarHBondContact O-N 3.02Å; M77-Y80 WeakPolarHBondContact O-CB 3.29Å; M77-Y80 PolarHBondContact O-N 3.12Å; N78-Y80 VanDerWaalsContact C-N 3.33Å; N78-Y80 PolarHBondContact O-N 2.72Å; Y80-V82 PolarHBondContact O-N 3.07Å; Y80-H83 WeakPolarHBondContact O-CB 3.4Å; Y80-H83 PolarHBondContact O-N 3.05Å; Y80-Q84 HydrophobicContact CD1-CG 3.97Å; Y80-Q84 HydrophobicContact CD2-CG 4.49Å; Y80-Q84 HydrophobicContact CE1-CG 3.51Å; Y80-Q84 HydrophobicContact CE2-CG 4.1Å; Y80-Q84 VanDerWaalsContact CE2-NE2 3.26Å; Y80-Q84 HydrophobicContact CG-CG 4.45Å; Y80-Q84 VanDerWaalsContact CZ-CD 3.5Å; Y80-Q84 VanDerWaalsContact CZ-NE2 3.31Å; Y80-Q84 WeakPolarHBondContact O-CG 3.45Å; Y80-Q84 PolarHBondContact O-N 3.21Å; Y80-Q84 PolarHBondContact OH-NE2 3.45Å; Y80-I118 HydrophobicContact CE1-CD1 3.77Å
81I98.4Very high97.6Very high0 Ų040 Ų400%023%0.226CC..Hα-helixtrans-60.3-45.8177.4-69.6160.4000111.5M77 N78 H83 Q84 F85 I118 F119 A178M77-I81 HydrophobicContact CG-CD1 4.02Å; M77-I81 VanDerWaalsContact O-CG1 3.28Å; M77-I81 WeakPolarHBondContact O-CG1 3.2Å; M77-I81 PolarHBondContact O-N 2.82Å; N78-I81 PolarHBondContact O-N 3.3Å; I81-H83 VanDerWaalsContact C-N 3.31Å; I81-H83 PolarHBondContact O-N 2.94Å; I81-Q84 PolarHBondContact O-N 3.29Å; I81-F85 HydrophobicContact CG2-CD2 3.53Å; I81-F85 HydrophobicContact CG2-CE2 3.4Å; I81-F85 VanDerWaalsContact CG2-CE2 3.4Å; I81-F85 VanDerWaalsContact O-CD2 3.3Å; I81-F85 WeakPolarHBondContact O-CD2 3.23Å; I81-F85 PolarHBondContact O-N 2.92Å; I81-I118 HydrophobicContact CD1-CG2 4.06Å; I81-I118 HydrophobicContact CG1-CB 4.45Å; I81-I118 HydrophobicContact CG1-CG2 3.67Å; I81-F119 HydrophobicContact CG2-CB 4.04Å; I81-F119 HydrophobicContact CG2-CD2 3.96Å; I81-F119 HydrophobicContact CG2-CG 4.49Å; I81-A178 HydrophobicContact CB-CB 4.24Å; I81-A178 HydrophobicContact CG2-CB 3.86Å
82V98.6Very high97.4Very high31 Ų3144.1 Ų44.119%0.18825%0.252CS..Hα-helixtrans-56.7-48.3175.1172.40000110.5N78 G79 Y80 Q84 F85 L86 A178 G179N78-V82 WeakPolarHBondContact O-CG2 3.36Å; N78-V82 PolarHBondContact O-N 2.69Å; G79-V82 PolarHBondContact O-N 2.94Å; Y80-V82 PolarHBondContact O-N 3.07Å; V82-Q84 VanDerWaalsContact C-N 3.32Å; V82-Q84 PolarHBondContact O-N 2.64Å; V82-F85 PolarHBondContact O-N 3.45Å; V82-L86 HydrophobicContact CG1-CD1 3.93Å; V82-L86 HydrophobicContact CG1-CG 4.46Å; V82-L86 WeakPolarHBondContact O-CG 3.26Å; V82-L86 PolarHBondContact O-N 2.94Å; V82-A178 HydrophobicContact CG2-CB 3.64Å; V82-G179 VanDerWaalsContact CG2-N 3.29Å
83H98.4Very high97.1Very high102 Ų10244.6 Ų44.647%0.47226%0.261SS..Hα-helixtrans-57.6-44.2176.8173.6-83.8000112.1G79 Y80 I81 L86 V87G79-H83 PolarHBondContact O-N 3.29Å; Y80-H83 WeakPolarHBondContact O-CB 3.4Å; Y80-H83 PolarHBondContact O-N 3.05Å; I81-H83 VanDerWaalsContact C-N 3.31Å; I81-H83 PolarHBondContact O-N 2.94Å; H83-L86 PolarHBondContact O-N 2.87Å; H83-V87 WeakPolarHBondContact O-CG2 3.39Å; H83-V87 PolarHBondContact O-N 2.87Å
84Q97.4Very high96.9Very high18 Ų1843 Ų438%0.08425%0.245CC..Hα-helixtrans-62.6-43.9177.5-66-59.3-62.600112.1Y80 I81 V82 L86 V87 W88 A115Y80-Q84 HydrophobicContact CD1-CG 3.97Å; Y80-Q84 HydrophobicContact CD2-CG 4.49Å; Y80-Q84 HydrophobicContact CE1-CG 3.51Å; Y80-Q84 HydrophobicContact CE2-CG 4.1Å; Y80-Q84 VanDerWaalsContact CE2-NE2 3.26Å; Y80-Q84 HydrophobicContact CG-CG 4.45Å; Y80-Q84 VanDerWaalsContact CZ-CD 3.5Å; Y80-Q84 VanDerWaalsContact CZ-NE2 3.31Å; Y80-Q84 WeakPolarHBondContact O-CG 3.45Å; Y80-Q84 PolarHBondContact O-N 3.21Å; Y80-Q84 PolarHBondContact OH-NE2 3.45Å; I81-Q84 PolarHBondContact O-N 3.29Å; V82-Q84 VanDerWaalsContact C-N 3.32Å; V82-Q84 PolarHBondContact O-N 2.64Å; Q84-L86 VanDerWaalsContact C-N 3.29Å; Q84-L86 PolarHBondContact O-N 3.4Å; Q84-V87 PolarHBondContact O-N 3.49Å; Q84-W88 WeakPolarHBondContact O-CB 3.27Å; Q84-W88 PolarHBondContact O-N 2.88Å; Q84-A115 HydrophobicContact CB-CB 3.71Å
85F97Very high96.7Very high0 Ų046 Ų460%027%0.267CS..Hα-helixtrans-62.6-36.1176.5-83.9-64.1000112.7I81 V82 G89 W90 M112 A115 F119 N171 M175I81-F85 HydrophobicContact CG2-CD2 3.53Å; I81-F85 HydrophobicContact CG2-CE2 3.4Å; I81-F85 VanDerWaalsContact CG2-CE2 3.4Å; I81-F85 VanDerWaalsContact O-CD2 3.3Å; I81-F85 WeakPolarHBondContact O-CD2 3.23Å; I81-F85 PolarHBondContact O-N 2.92Å; V82-F85 PolarHBondContact O-N 3.45Å; F85-G89 PolarHBondContact O-N 3.47Å; F85-W90 PolarHBondContact O-N 3.47Å; F85-M112 HydrophobicContact CD1-CE 4.11Å; F85-M112 HydrophobicContact CD1-SD 3.46Å; F85-M112 WeakPolarHBondContact CD1-SD 3.39Å; F85-M112 HydrophobicContact CE1-SD 3.62Å; F85-A115 HydrophobicContact CD1-CB 4.44Å; F85-A115 HydrophobicContact CE1-CB 4.37Å; F85-F119 HydrophobicContact CE2-CB 4.05Å; F85-F119 HydrophobicContact CE2-CD2 4.36Å; F85-F119 HydrophobicContact CE2-CG 4.35Å; F85-F119 HydrophobicContact CZ-CB 4.25Å; F85-N171 HydrophobicContact CE1-CB 4.02Å; F85-M175 HydrophobicContact CB-CB 3.92Å; F85-M175 HydrophobicContact CB-CG 3.91Å; F85-M175 HydrophobicContact CB-SD 4.24Å; F85-M175 HydrophobicContact CD2-CB 4.22Å; F85-M175 HydrophobicContact CG-CB 4.07Å
86L97.3Very high96.5Very high64 Ų6450.2 Ų50.234%0.33528%0.28SS..Iπ-helixtrans-68.6-52.2175.9-70.5169.7000111.5V82 H83 Q84 W88 G89 W90 G91 M175V82-L86 HydrophobicContact CG1-CD1 3.93Å; V82-L86 HydrophobicContact CG1-CG 4.46Å; V82-L86 WeakPolarHBondContact O-CG 3.26Å; V82-L86 PolarHBondContact O-N 2.94Å; H83-L86 PolarHBondContact O-N 2.87Å; Q84-L86 VanDerWaalsContact C-N 3.29Å; Q84-L86 PolarHBondContact O-N 3.4Å; L86-W88 PolarHBondContact O-N 3.33Å; L86-G89 PolarHBondContact O-N 3.44Å; L86-W90 HydrophobicContact CD2-CB 4.13Å; L86-G91 VanDerWaalsContact O-CA 3.27Å; L86-G91 WeakPolarHBondContact O-CA 3.5Å; L86-G91 PolarHBondContact O-N 3.32Å; L86-M175 HydrophobicContact CD2-SD 3.78Å; L86-M175 HydrophobicContact CG-SD 4.18Å
87V96.9Very high96.3Very high56 Ų5653 Ų5334%0.33928%0.279SS..Iπ-helixtrans-62.9-43.9-177.1171.60000111.5H83 Q84 G89 T92 Q108H83-V87 WeakPolarHBondContact O-CG2 3.39Å; H83-V87 PolarHBondContact O-N 2.87Å; Q84-V87 PolarHBondContact O-N 3.49Å; V87-G89 PolarHBondContact O-N 3.32Å; V87-T92 WeakPolarHBondContact O-CG2 3.35Å; V87-T92 PolarHBondContact O-OG1 3.33Å; V87-Q108 PolarHBondContact O-NE2 2.92Å
88W95.6Very high96Very high63 Ų6352.6 Ų52.624%0.23928%0.279CS..Iπ-helixtrans-88.86.1-174.4-56.8122.4000114.9Q84 L86 T107 Q108 M112Q84-W88 WeakPolarHBondContact O-CB 3.27Å; Q84-W88 PolarHBondContact O-N 2.88Å; L86-W88 PolarHBondContact O-N 3.33Å; W88-T107 HydrophobicContact CH2-CG2 4.25Å; W88-T107 HydrophobicContact CZ3-CG2 4.05Å; W88-Q108 VanDerWaalsContact CA-NE2 3.31Å; W88-Q108 WeakPolarHBondContact O-CG 3.34Å; W88-Q108 PolarHBondContact O-NE2 3.24Å; W88-M112 HydrophobicContact CB-CB 4.32Å; W88-M112 HydrophobicContact CB-CE 4.25Å; W88-M112 WeakPolarHBondContact O-CE 3.39Å
89G94.3Very high95.8Very high0 Ų053.2 Ų53.20%028%0.283CS..Iπ-helixtrans-173.8-70.3174.500000114.2F85 L86 V87 G91 T92 T93 Y94F85-G89 PolarHBondContact O-N 3.47Å; L86-G89 PolarHBondContact O-N 3.44Å; V87-G89 PolarHBondContact O-N 3.32Å; G89-G91 VanDerWaalsContact C-N 3.29Å; G89-G91 PolarHBondContact O-N 3.06Å; G89-T92 PolarHBondContact O-N 3.28Å; G89-T92 PolarHBondContact O-OG1 3.45Å; G89-T93 PolarHBondContact O-N 2.93Å; G89-Y94 PolarHBondContact O-N 3.15Å
90W96Very high95.5Very high2 Ų255.5 Ų55.51%0.00829%0.287CS..Iπ-helixtrans-62.8-29.8-166-70.6100.9000115F85 L86 Y94 W96 N171 F172 M175 H221F85-W90 PolarHBondContact O-N 3.47Å; L86-W90 HydrophobicContact CD2-CB 4.13Å; W90-Y94 AromaticContact CD2-CD2 3.8Å; W90-Y94 HydrophobicContact CD2-CD2 3.8Å; W90-Y94 AromaticContact CE2-CD2 3.61Å; W90-Y94 AromaticContact CE2-CE2 3.99Å; W90-Y94 HydrophobicContact CE3-CD2 4.18Å; W90-Y94 HydrophobicContact CG-CD2 4.25Å; W90-Y94 HydrophobicContact CH2-CD2 4.11Å; W90-Y94 AromaticContact CZ2-CD2 3.75Å; W90-Y94 HydrophobicContact CZ2-CD2 3.75Å; W90-Y94 HydrophobicContact CZ2-CE2 4.06Å; W90-Y94 HydrophobicContact CZ3-CD2 4.35Å; W90-W96 HydrophobicContact CB-CH2 4.45Å; W90-W96 HydrophobicContact CB-CZ2 4.12Å; W90-W96 AromaticContact CE3-CD2 3.66Å; W90-W96 HydrophobicContact CE3-CD2 3.66Å; W90-W96 AromaticContact CE3-CE2 3.9Å; W90-W96 AromaticContact CE3-CE3 3.74Å; W90-W96 HydrophobicContact CE3-CE3 3.74Å; W90-W96 HydrophobicContact CE3-CG 4.17Å; W90-W96 HydrophobicContact CE3-CH2 4.29Å; W90-W96 HydrophobicContact CE3-CZ2 4.21Å; W90-W96 HydrophobicContact CE3-CZ3 4.09Å; W90-W96 HydrophobicContact CZ3-CB 4.35Å; W90-W96 AromaticContact CZ3-CD2 3.96Å; W90-W96 HydrophobicContact CZ3-CD2 3.96Å; W90-W96 AromaticContact CZ3-CE3 3.93Å; W90-W96 HydrophobicContact CZ3-CE3 3.93Å; W90-W96 HydrophobicContact CZ3-CG 4.17Å; W90-W96 VanDerWaalsContact O-CE2 3.27Å; W90-W96 WeakPolarHBondContact O-CZ2 3.37Å; W90-W96 PolarHBondContact O-NE1 3.43Å; W90-N171 VanDerWaalsContact CE2-OD1 3.28Å; W90-N171 WeakPolarHBondContact CZ2-OD1 3.23Å; W90-N171 PolarHBondContact NE1-OD1 3.19Å; W90-F172 HydrophobicContact CD2-CD2 4.38Å; W90-F172 HydrophobicContact CE3-CD2 4.06Å; W90-F172 HydrophobicContact CH2-CB 3.6Å; W90-F172 AromaticContact CH2-CD2 3.68Å; W90-F172 HydrophobicContact CH2-CD2 3.68Å; W90-F172 HydrophobicContact CH2-CG 4.05Å; W90-F172 VanDerWaalsContact CZ2-CA 3.44Å; W90-F172 HydrophobicContact CZ2-CB 3.47Å; W90-F172 VanDerWaalsContact CZ2-CB 3.47Å; W90-F172 HydrophobicContact CZ2-CD2 4.01Å; W90-F172 HydrophobicContact CZ2-CG 4.24Å; W90-F172 HydrophobicContact CZ3-CB 4.44Å; W90-F172 AromaticContact CZ3-CD2 3.65Å; W90-F172 HydrophobicContact CZ3-CD2 3.65Å; W90-F172 HydrophobicContact CZ3-CE2 4.41Å; W90-F172 HydrophobicContact CZ3-CG 4.45Å; W90-M175 HydrophobicContact CB-CE 3.96Å; W90-M175 HydrophobicContact CB-SD 3.51Å; W90-M175 VanDerWaalsContact CB-SD 3.51Å; W90-M175 HydrophobicContact CD2-CE 3.87Å; W90-M175 HydrophobicContact CD2-SD 4.34Å; W90-M175 HydrophobicContact CE3-CE 4.26Å; W90-M175 HydrophobicContact CG-CE 3.69Å; W90-M175 HydrophobicContact CG-SD 3.53Å; W90-M175 VanDerWaalsContact CG-SD 3.53Å; W90-H221 AromaticContact CH2-CE1 3.6Å; W90-H221 AromaticContact CH2-NE2 3.46Å; W90-H221 WeakPolarHBondContact CH2-NE2 3.41Å; W90-H221 AromaticContact CZ3-NE2 3.69Å
91G95.6Very high95.1Very high54 Ų5451.1 Ų51.156%0.55727%0.271SS*.THydrogen-bonded Turntrans-96.2-0.6178.100000114.3L86 G89L86-G91 VanDerWaalsContact O-CA 3.27Å; L86-G91 WeakPolarHBondContact O-CA 3.5Å; L86-G91 PolarHBondContact O-N 3.32Å; G89-G91 VanDerWaalsContact C-N 3.29Å; G89-G91 PolarHBondContact O-N 3.06Å
92T93.8Very high94.7Very high89 Ų8953.9 Ų53.955%0.54629%0.286SS..THydrogen-bonded Turntrans-134.1-66-169.651.50000112.8V87 G89 Q108V87-T92 WeakPolarHBondContact O-CG2 3.35Å; V87-T92 PolarHBondContact O-OG1 3.33Å; G89-T92 PolarHBondContact O-N 3.28Å; G89-T92 PolarHBondContact O-OG1 3.45Å; T92-Q108 PolarHBondContact OG1-NE2 2.92Å
93T91.6Very high94.2Very high88 Ų8857.2 Ų57.254%0.5430%0.298SS..THydrogen-bonded Turntrans-107.9-21.6-168.256.30000114.2G89 Q108G89-T93 PolarHBondContact O-N 2.93Å; T93-Q108 HydrophobicContact CG2-CG 4.4Å
94Y95Very high93.8Very high33 Ų3354.7 Ų54.713%0.12929%0.291CS..  trans-82.2143.7-174.7-75.917.2000112G89 W90 D99 M112 G168G89-Y94 PolarHBondContact O-N 3.15Å; W90-Y94 AromaticContact CD2-CD2 3.8Å; W90-Y94 HydrophobicContact CD2-CD2 3.8Å; W90-Y94 AromaticContact CE2-CD2 3.61Å; W90-Y94 AromaticContact CE2-CE2 3.99Å; W90-Y94 HydrophobicContact CE3-CD2 4.18Å; W90-Y94 HydrophobicContact CG-CD2 4.25Å; W90-Y94 HydrophobicContact CH2-CD2 4.11Å; W90-Y94 AromaticContact CZ2-CD2 3.75Å; W90-Y94 HydrophobicContact CZ2-CD2 3.75Å; W90-Y94 HydrophobicContact CZ2-CE2 4.06Å; W90-Y94 HydrophobicContact CZ3-CD2 4.35Å; Y94-D99 WeakPolarHBondContact CA-OD1 3.42Å; Y94-D99 HydrophobicContact CD1-CB 4.43Å; Y94-D99 HydrophobicContact CD2-CB 3.95Å; Y94-D99 HydrophobicContact CE2-CB 4.27Å; Y94-D99 HydrophobicContact CG-CB 4.04Å; Y94-M112 HydrophobicContact CE2-CE 4.25Å; Y94-G168 WeakPolarHBondContact CE2-O 3.45Å
95S94.2Very high93.5Very high66 Ų6658.4 Ų58.446%0.46232%0.319SS..  trans-87.9-9.3-176.165.80000114.3R97 D99S95-R97 PolarHBondContact O-N 2.91Å; S95-R97 PolarHBondContact OG-N 2.83Å; S95-D99 WeakPolarHBondContact CB-OD1 3.41Å; S95-D99 PolarHBondContact N-OD1 3.05Å; S95-D99 PolarHBondContact N-OD2 2.85Å; S95-D99 PolarHBondContact OG-OD1 3.44Å; S95-D99 PolarHBondContact OG-OD2 3.37Å
96W93.9Very high93.3Very high113 Ų11360.5 Ų60.543%0.42833%0.334SS..SBendtrans63.627.4-172.6-53.270.4000113.5W90 D99 F172 M175W90-W96 HydrophobicContact CB-CH2 4.45Å; W90-W96 HydrophobicContact CB-CZ2 4.12Å; W90-W96 AromaticContact CE3-CD2 3.66Å; W90-W96 HydrophobicContact CE3-CD2 3.66Å; W90-W96 AromaticContact CE3-CE2 3.9Å; W90-W96 AromaticContact CE3-CE3 3.74Å; W90-W96 HydrophobicContact CE3-CE3 3.74Å; W90-W96 HydrophobicContact CE3-CG 4.17Å; W90-W96 HydrophobicContact CE3-CH2 4.29Å; W90-W96 HydrophobicContact CE3-CZ2 4.21Å; W90-W96 HydrophobicContact CE3-CZ3 4.09Å; W90-W96 HydrophobicContact CZ3-CB 4.35Å; W90-W96 AromaticContact CZ3-CD2 3.96Å; W90-W96 HydrophobicContact CZ3-CD2 3.96Å; W90-W96 AromaticContact CZ3-CE3 3.93Å; W90-W96 HydrophobicContact CZ3-CE3 3.93Å; W90-W96 HydrophobicContact CZ3-CG 4.17Å; W90-W96 VanDerWaalsContact O-CE2 3.27Å; W90-W96 WeakPolarHBondContact O-CZ2 3.37Å; W90-W96 PolarHBondContact O-NE1 3.43Å; W96-D99 PolarHBondContact N-OD2 3.23Å; W96-F172 HydrophobicContact CE3-CD2 4.45Å; W96-F172 AromaticContact CE3-CE2 3.88Å; W96-F172 HydrophobicContact CE3-CE2 3.88Å; W96-F172 HydrophobicContact CZ3-CD2 4.42Å; W96-F172 AromaticContact CZ3-CE2 3.71Å; W96-F172 HydrophobicContact CZ3-CE2 3.71Å; W96-M175 HydrophobicContact CH2-CE 3.73Å; W96-M175 HydrophobicContact CZ3-CE 3.86Å
97R93.8Very high93.1Very high165 Ų16562.6 Ų62.662%0.62335%0.35SS*.SBendtrans-140.6-115.4-177.7-64-174.9174.8166-0.5109.8S95 D99 M169 M228S95-R97 PolarHBondContact O-N 2.91Å; S95-R97 PolarHBondContact OG-N 2.83Å; R97-D99 VanDerWaalsContact C-N 3.31Å; R97-D99 PolarHBondContact N-OD2 3.01Å; R97-D99 PolarHBondContact O-N 2.92Å; R97-D99 VanDerWaalsContact O-N 3.13Å; R97-M169 WeakPolarHBondContact O-CB 3.41Å; R97-M228 HydrophobicContact CB-SD 4Å
98C93.2Very high92.9Very high31 Ų3162.5 Ų62.521%0.20935%0.346CS..SBendtrans-85.974.5177.3-170.90000110.1M228 C231C98-M228 HydrophobicContact CB-CE 3.81Å; C98-M228 HydrophobicContact CB-SD 3.82Å; C98-C231 HydrophobicContact CB-CB 3.75Å; C98-C231 WeakPolarHBondContact CB-SG 3.49Å; C98-C231 WeakPolarHBondContact SG-CA 3.32Å; C98-C231 WeakPolarHBondContact SG-CB 3.44Å; C98-C231 CovalentContact SG-SG 2.03Å; C98-C231 PolarHBondContact SG-SG 3.1Å
99D93.7Very high92.7Very high13 Ų1359.6 Ų59.67%0.0734%0.335CS..  trans-87.3114172.3-61.7-54.8000108.5Y94 S95 W96 R97 G168 M169Y94-D99 WeakPolarHBondContact CA-OD1 3.42Å; Y94-D99 HydrophobicContact CD1-CB 4.43Å; Y94-D99 HydrophobicContact CD2-CB 3.95Å; Y94-D99 HydrophobicContact CE2-CB 4.27Å; Y94-D99 HydrophobicContact CG-CB 4.04Å; S95-D99 WeakPolarHBondContact CB-OD1 3.41Å; S95-D99 PolarHBondContact N-OD1 3.05Å; S95-D99 PolarHBondContact N-OD2 2.85Å; S95-D99 PolarHBondContact OG-OD1 3.44Å; S95-D99 PolarHBondContact OG-OD2 3.37Å; W96-D99 PolarHBondContact N-OD2 3.23Å; R97-D99 VanDerWaalsContact C-N 3.31Å; R97-D99 PolarHBondContact N-OD2 3.01Å; R97-D99 PolarHBondContact O-N 2.92Å; R97-D99 VanDerWaalsContact O-N 3.13Å; D99-G168 CarbonylContact O-C 3.49Å; D99-G168 VanDerWaalsContact O-CA 3.26Å; D99-G168 WeakPolarHBondContact O-CA 3.3Å; D99-M169 HydrophobicContact CB-CB 4.35Å; D99-M169 PolarHBondContact O-N 2.78Å
100L92.6Very high92.7Very high78 Ų7862.9 Ų62.941%0.40835%0.352SS..  trans-77.6164.7-176.3-59.3-175.9000111.9G168 D232L100-G168 WeakPolarHBondContact O-CA 3.2Å; L100-D232 WeakPolarHBondContact CD2-O 3.26Å
101C89.8Confident92.6Very high7 Ų763.2 Ų63.25%0.04736%0.356CS..  trans-72130.3170.7-63.20000111.6F103 V166 Y233 Q234C101-F103 HydrophobicContact CB-CD2 4.2Å; C101-F103 HydrophobicContact CB-CE2 3.45Å; C101-F103 VanDerWaalsContact CB-CE2 3.45Å; C101-F103 HydrophobicContact CB-CZ 3.71Å; C101-V166 WeakPolarHBondContact CA-O 3.28Å; C101-V166 WeakPolarHBondContact CB-O 3.37Å; C101-Y233 PolarHBondContact SG-OH 3.48Å; C101-Q234 PolarHBondContact O-NE2 3.46Å
102D89.5Confident92.5Very high59 Ų5960.7 Ų60.732%0.31633%0.33SS..  trans-101.4107.1174.3-174.2-1.4000111.3R23 S104 S106 A109 V166R23-D102 PolarHBondContact NH1-O 3.02Å; R23-D102 PolarHBondContact NH2-O 2.79Å; D102-S104 VanDerWaalsContact C-N 3.35Å; D102-S104 VanDerWaalsContact CG-OG 3.25Å; D102-S104 WeakPolarHBondContact OD1-CA 3.3Å; D102-S104 WeakPolarHBondContact OD1-CB 3.28Å; D102-S104 PolarHBondContact OD1-N 2.87Å; D102-S104 PolarHBondContact OD1-OG 3.18Å; D102-S104 PolarHBondContact OD2-OG 2.96Å; D102-S104 VanDerWaalsContact OD2-OG 3.13Å; D102-S106 PolarHBondContact OD2-OG 2.84Å; D102-A109 HydrophobicContact CB-CB 4.28Å; D102-V166 HydrophobicContact CB-CG1 3.89Å; D102-V166 VanDerWaalsContact O-CB 3.23Å; D102-V166 WeakPolarHBondContact O-CB 3.29Å; D102-V166 WeakPolarHBondContact O-CG2 3.36Å
103F87.8Confident92.5Very high100 Ų10056.5 Ų56.544%0.43930%0.304SS..  trans-913.8178.4-61.7-81.3000113.5C101 P165 Q234C101-F103 HydrophobicContact CB-CD2 4.2Å; C101-F103 HydrophobicContact CB-CE2 3.45Å; C101-F103 VanDerWaalsContact CB-CE2 3.45Å; C101-F103 HydrophobicContact CB-CZ 3.71Å; F103-P165 HydrophobicContact CE1-CG 4.33Å; F103-Q234 HydrophobicContact CE2-CB 4.43Å; F103-Q234 HydrophobicContact CE2-CG 4.46Å
104S90.8Very high92.7Very high49 Ų4958.6 Ų58.634%0.34330%0.302SS..SBendtrans-70.1166.4177.775.20000112.3R23 D102 S106 A109R23-S104 PolarHBondContact NH1-O 3.22Å; D102-S104 VanDerWaalsContact C-N 3.35Å; D102-S104 VanDerWaalsContact CG-OG 3.25Å; D102-S104 WeakPolarHBondContact OD1-CA 3.3Å; D102-S104 WeakPolarHBondContact OD1-CB 3.28Å; D102-S104 PolarHBondContact OD1-N 2.87Å; D102-S104 PolarHBondContact OD1-OG 3.18Å; D102-S104 PolarHBondContact OD2-OG 2.96Å; D102-S104 VanDerWaalsContact OD2-OG 3.13Å; S104-S106 VanDerWaalsContact C-N 3.25Å; S104-S106 WeakPolarHBondContact OG-CB 3.39Å; S104-S106 PolarHBondContact OG-N 3.29Å; S104-S106 PolarHBondContact OG-OG 3.1Å; S104-A109 WeakPolarHBondContact O-CB 3.38Å
105S90.9Very high92.7Very high96 Ų9657 Ų5767%0.67130%0.296SS*.  trans-94.227.4169.4-61.90000111.9
106S92.9Very high92.7Very high44 Ų4454.1 Ų54.131%0.30828%0.276SS..  trans-63.7152.5175.674.90000110.6D102 S104 Q108 A109 L110D102-S106 PolarHBondContact OD2-OG 2.84Å; S104-S106 VanDerWaalsContact C-N 3.25Å; S104-S106 WeakPolarHBondContact OG-CB 3.39Å; S104-S106 PolarHBondContact OG-N 3.29Å; S104-S106 PolarHBondContact OG-OG 3.1Å; S106-Q108 PolarHBondContact O-N 2.56Å; S106-A109 PolarHBondContact O-N 3.34Å; S106-A109 VanDerWaalsContact OG-CB 3.3Å; S106-A109 WeakPolarHBondContact OG-CB 3.26Å; S106-A109 PolarHBondContact OG-N 3.43Å; S106-L110 WeakPolarHBondContact O-CG 3.5Å; S106-L110 PolarHBondContact O-N 3.43Å
107T93.3Very high92.8Very high109 Ų10951.1 Ų51.167%0.66926%0.264SS*.Hα-helixtrans-54.9-38.2175.8-52.10000111.4W88 G111W88-T107 HydrophobicContact CH2-CG2 4.25Å; W88-T107 HydrophobicContact CZ3-CG2 4.05Å; T107-G111 PolarHBondContact O-N 3.41Å
108Q92.2Very high92.9Very high53 Ų5344.5 Ų44.525%0.24824%0.241CC..Hα-helixtrans-63.9-50.6177.9-163.274.4300111.5V87 W88 T92 T93 S106 G111 M112V87-Q108 PolarHBondContact O-NE2 2.92Å; W88-Q108 VanDerWaalsContact CA-NE2 3.31Å; W88-Q108 WeakPolarHBondContact O-CG 3.34Å; W88-Q108 PolarHBondContact O-NE2 3.24Å; T92-Q108 PolarHBondContact OG1-NE2 2.92Å; T93-Q108 HydrophobicContact CG2-CG 4.4Å; S106-Q108 PolarHBondContact O-N 2.56Å; Q108-G111 PolarHBondContact O-N 2.97Å; Q108-M112 PolarHBondContact O-N 2.76Å
109A92.4Very high93.1Very high2 Ų243 Ų432%0.01723%0.231CC..Hα-helixtrans-61.3-47.5179.600000111.5D102 S104 S106 G111 M112 V113D102-A109 HydrophobicContact CB-CB 4.28Å; S104-A109 WeakPolarHBondContact O-CB 3.38Å; S106-A109 PolarHBondContact O-N 3.34Å; S106-A109 VanDerWaalsContact OG-CB 3.3Å; S106-A109 WeakPolarHBondContact OG-CB 3.26Å; S106-A109 PolarHBondContact OG-N 3.43Å; A109-G111 VanDerWaalsContact C-N 3.31Å; A109-G111 PolarHBondContact O-N 2.72Å; A109-M112 PolarHBondContact O-N 3.34Å; A109-M112 VanDerWaalsContact O-N 3.13Å; A109-V113 WeakPolarHBondContact O-CG2 3.38Å; A109-V113 PolarHBondContact O-N 2.9Å
110L93.1Very high93.2Very high70 Ų7042.4 Ų42.437%0.36623%0.228SC..Hα-helixtrans-63.6-37178.4-67.8174.6000112.3R23 S106 V113 R114R23-L110 HydrophobicContact CB-CD2 4.31Å; R23-L110 HydrophobicContact CG-CD2 4.09Å; S106-L110 WeakPolarHBondContact O-CG 3.5Å; S106-L110 PolarHBondContact O-N 3.43Å; L110-V113 PolarHBondContact O-N 3.44Å; L110-R114 WeakPolarHBondContact O-CB 3.36Å; L110-R114 PolarHBondContact O-N 3.26Å
111G94.4Very high93.3Very high8 Ų840.1 Ų40.18%0.08222%0.216CC..Hα-helixtrans-59.6-44.5171.500000112.4T107 Q108 A109 R114 A115T107-G111 PolarHBondContact O-N 3.41Å; Q108-G111 PolarHBondContact O-N 2.97Å; A109-G111 VanDerWaalsContact C-N 3.31Å; A109-G111 PolarHBondContact O-N 2.72Å; G111-R114 PolarHBondContact O-N 3.42Å; G111-A115 WeakPolarHBondContact O-CB 3.3Å; G111-A115 PolarHBondContact O-N 3.25Å
112M94.5Very high93.7Very high1 Ų139.8 Ų39.81%0.00521%0.213CC..Hα-helixtrans-68.2-39.7177.5-173.456.777.200113.2F85 W88 Y94 Q108 A109 R114 A115 S116 V166 N171F85-M112 HydrophobicContact CD1-CE 4.11Å; F85-M112 HydrophobicContact CD1-SD 3.46Å; F85-M112 WeakPolarHBondContact CD1-SD 3.39Å; F85-M112 HydrophobicContact CE1-SD 3.62Å; W88-M112 HydrophobicContact CB-CB 4.32Å; W88-M112 HydrophobicContact CB-CE 4.25Å; W88-M112 WeakPolarHBondContact O-CE 3.39Å; Y94-M112 HydrophobicContact CE2-CE 4.25Å; Q108-M112 PolarHBondContact O-N 2.76Å; A109-M112 PolarHBondContact O-N 3.34Å; A109-M112 VanDerWaalsContact O-N 3.13Å; M112-R114 VanDerWaalsContact C-N 3.31Å; M112-R114 PolarHBondContact O-N 3.22Å; M112-A115 PolarHBondContact O-N 2.87Å; M112-S116 WeakPolarHBondContact O-CB 3.37Å; M112-S116 PolarHBondContact O-N 3.3Å; M112-S116 PolarHBondContact O-OG 2.8Å; M112-V166 HydrophobicContact CB-CG1 4.2Å; M112-V166 HydrophobicContact CG-CG1 3.97Å; M112-N171 PolarHBondContact SD-ND2 3.4Å
113V93.9Very high94.1Very high1 Ų137 Ų371%0.00620%0.199CC..Hα-helixtrans-57.1-48.4172.1172.50000109.7L24 A109 L110 S116 W117 P165 V166L24-V113 HydrophobicContact CD1-CG1 4.48Å; L24-V113 HydrophobicContact CD2-CG1 3.4Å; L24-V113 VanDerWaalsContact CD2-CG1 3.4Å; L24-V113 HydrophobicContact CG-CG1 3.73Å; A109-V113 WeakPolarHBondContact O-CG2 3.38Å; A109-V113 PolarHBondContact O-N 2.9Å; L110-V113 PolarHBondContact O-N 3.44Å; V113-S116 PolarHBondContact O-N 3.49Å; V113-W117 PolarHBondContact O-N 3.03Å; V113-P165 HydrophobicContact CG2-CB 4.28Å; V113-V166 HydrophobicContact CG2-CG2 3.33Å
114R94.3Very high94.5Very high132 Ų13233.5 Ų33.550%0.49818%0.183SC..Hα-helixtrans-63-44.6179.1-173.2178.2-178.9-179.20.9111.6Y27 L110 G111 M112 S116 W117 I118Y27-R114 HydrophobicContact CE2-CB 4.48Å; Y27-R114 HydrophobicContact CE2-CG 4.38Å; L110-R114 WeakPolarHBondContact O-CB 3.36Å; L110-R114 PolarHBondContact O-N 3.26Å; G111-R114 PolarHBondContact O-N 3.42Å; M112-R114 VanDerWaalsContact C-N 3.31Å; M112-R114 PolarHBondContact O-N 3.22Å; R114-S116 VanDerWaalsContact C-N 3.33Å; R114-S116 PolarHBondContact O-N 3.25Å; R114-W117 PolarHBondContact O-N 3.13Å; R114-I118 HydrophobicContact CG-CD1 4.14Å; R114-I118 VanDerWaalsContact O-CG1 3.3Å; R114-I118 WeakPolarHBondContact O-CG1 3.25Å; R114-I118 PolarHBondContact O-N 3.09Å
115A95.4Very high94.8Very high1 Ų134.1 Ų34.11%0.00818%0.181CC..Hα-helixtrans-57.7-45.8176.300000111.8Q84 F85 G111 M112 W117 I118 F119Q84-A115 HydrophobicContact CB-CB 3.71Å; F85-A115 HydrophobicContact CD1-CB 4.44Å; F85-A115 HydrophobicContact CE1-CB 4.37Å; G111-A115 WeakPolarHBondContact O-CB 3.3Å; G111-A115 PolarHBondContact O-N 3.25Å; M112-A115 PolarHBondContact O-N 2.87Å; A115-W117 PolarHBondContact O-N 3.33Å; A115-I118 PolarHBondContact O-N 3.36Å; A115-F119 PolarHBondContact O-N 2.92Å
116S94.9Very high95.2Very high4 Ų429.6 Ų29.63%0.02815%0.149CC..Hα-helixtrans-63.7-39.7178.4-57.50000112.1M112 V113 R114 F119 Y120M112-S116 WeakPolarHBondContact O-CB 3.37Å; M112-S116 PolarHBondContact O-N 3.3Å; M112-S116 PolarHBondContact O-OG 2.8Å; V113-S116 PolarHBondContact O-N 3.49Å; R114-S116 VanDerWaalsContact C-N 3.33Å; R114-S116 PolarHBondContact O-N 3.25Å; S116-F119 PolarHBondContact O-N 3.44Å; S116-Y120 WeakPolarHBondContact O-CB 3.45Å; S116-Y120 PolarHBondContact O-N 2.94Å
117W95.3Very high95.4Very high51 Ų5128.3 Ų28.319%0.19314%0.139CC..Hα-helixtrans-68.2-40.7174.3172.987.2000113.1L24 Y27 L28 V113 R114 A115 F119 Y120 I121L24-W117 HydrophobicContact CD2-CB 4.27Å; Y27-W117 HydrophobicContact CD2-CB 3.79Å; Y27-W117 AromaticContact CD2-CD1 3.76Å; Y27-W117 AromaticContact CD2-CD2 3.42Å; Y27-W117 HydrophobicContact CD2-CD2 3.42Å; Y27-W117 VanDerWaalsContact CD2-CD2 3.42Å; Y27-W117 AromaticContact CD2-CE2 3.77Å; Y27-W117 AromaticContact CD2-CE3 3.82Å; Y27-W117 HydrophobicContact CD2-CE3 3.82Å; Y27-W117 AromaticContact CD2-CG 3.39Å; Y27-W117 HydrophobicContact CD2-CG 3.39Å; Y27-W117 HydrophobicContact CD2-CZ2 4.44Å; Y27-W117 AromaticContact CD2-NE1 3.99Å; Y27-W117 HydrophobicContact CE2-CB 4.13Å; Y27-W117 HydrophobicContact CE2-CD2 4.08Å; Y27-W117 HydrophobicContact CE2-CE3 4.06Å; Y27-W117 HydrophobicContact CE2-CG 4.13Å; Y27-W117 HydrophobicContact CG-CD2 4.41Å; Y27-W117 HydrophobicContact CG-CG 4.33Å; L28-W117 HydrophobicContact CB-CZ2 3.78Å; L28-W117 PolarHBondContact O-NE1 3.24Å; V113-W117 PolarHBondContact O-N 3.03Å; R114-W117 PolarHBondContact O-N 3.13Å; A115-W117 PolarHBondContact O-N 3.33Å; W117-F119 VanDerWaalsContact C-N 3.27Å; W117-F119 PolarHBondContact O-N 3.44Å; W117-Y120 WeakPolarHBondContact O-CB 3.1Å; W117-Y120 PolarHBondContact O-N 3.15Å; W117-Y120 VanDerWaalsContact O-N 3.1Å; W117-I121 HydrophobicContact CD2-CG1 3.87Å; W117-I121 HydrophobicContact CE3-CG1 4.48Å; W117-I121 HydrophobicContact CG-CG1 4.37Å; W117-I121 HydrophobicContact CH2-CG1 4.24Å; W117-I121 HydrophobicContact CZ2-CD1 4.15Å; W117-I121 HydrophobicContact CZ2-CG1 3.61Å; W117-I121 WeakPolarHBondContact O-CG1 3.49Å; W117-I121 PolarHBondContact O-N 2.98Å
118I96.3Very high95.6Very high26 Ų2626.3 Ų26.313%0.13312%0.124CC..Hα-helixtrans-61.7-41.4176.1-65.2174.3000109.7Y80 I81 R114 A115 I121 S122Y80-I118 HydrophobicContact CE1-CD1 3.77Å; I81-I118 HydrophobicContact CD1-CG2 4.06Å; I81-I118 HydrophobicContact CG1-CB 4.45Å; I81-I118 HydrophobicContact CG1-CG2 3.67Å; R114-I118 HydrophobicContact CG-CD1 4.14Å; R114-I118 VanDerWaalsContact O-CG1 3.3Å; R114-I118 WeakPolarHBondContact O-CG1 3.25Å; R114-I118 PolarHBondContact O-N 3.09Å; A115-I118 PolarHBondContact O-N 3.36Å; I118-I121 PolarHBondContact O-N 3.41Å; I118-S122 PolarHBondContact O-N 3.17Å
119F96.7Very high95.8Very high0 Ų024.4 Ų24.40%012%0.115CC..Hα-helixtrans-59.8-45.1171.8-178.2-88.1000112I81 F85 A115 S116 W117 S122 K123 W157 S174 N177 A178I81-F119 HydrophobicContact CG2-CB 4.04Å; I81-F119 HydrophobicContact CG2-CD2 3.96Å; I81-F119 HydrophobicContact CG2-CG 4.49Å; F85-F119 HydrophobicContact CE2-CB 4.05Å; F85-F119 HydrophobicContact CE2-CD2 4.36Å; F85-F119 HydrophobicContact CE2-CG 4.35Å; F85-F119 HydrophobicContact CZ-CB 4.25Å; A115-F119 PolarHBondContact O-N 2.92Å; S116-F119 PolarHBondContact O-N 3.44Å; W117-F119 VanDerWaalsContact C-N 3.27Å; W117-F119 PolarHBondContact O-N 3.44Å; F119-S122 WeakPolarHBondContact O-CB 3.38Å; F119-S122 PolarHBondContact O-N 3.33Å; F119-S122 PolarHBondContact O-OG 3.02Å; F119-K123 HydrophobicContact CE1-CD 4.11Å; F119-K123 HydrophobicContact CE1-CG 4.35Å; F119-K123 HydrophobicContact CZ-CD 4.18Å; F119-K123 PolarHBondContact O-N 3.27Å; F119-W157 AromaticContact CD1-CD2 3.93Å; F119-W157 HydrophobicContact CD1-CD2 3.93Å; F119-W157 AromaticContact CD1-CE2 3.75Å; F119-W157 HydrophobicContact CD1-CE3 4.11Å; F119-W157 HydrophobicContact CD1-CH2 4.18Å; F119-W157 AromaticContact CD1-CZ2 3.81Å; F119-W157 HydrophobicContact CD1-CZ2 3.81Å; F119-W157 HydrophobicContact CD1-CZ3 4.26Å; F119-W157 AromaticContact CE1-CD2 3.81Å; F119-W157 HydrophobicContact CE1-CD2 3.81Å; F119-W157 AromaticContact CE1-CE2 3.26Å; F119-W157 HydrophobicContact CE1-CE3 4.43Å; F119-W157 HydrophobicContact CE1-CG 4.33Å; F119-W157 HydrophobicContact CE1-CH2 4.29Å; F119-W157 AromaticContact CE1-CZ2 3.47Å; F119-W157 HydrophobicContact CE1-CZ2 3.47Å; F119-W157 VanDerWaalsContact CE1-CZ2 3.47Å; F119-W157 AromaticContact CE1-NE1 3.44Å; F119-W157 HydrophobicContact CZ-CZ2 4.31Å; F119-S174 WeakPolarHBondContact CE2-O 2.95Å; F119-N177 HydrophobicContact CE2-CB 4.25Å; F119-N177 WeakPolarHBondContact CE2-OD1 3.45Å; F119-N177 HydrophobicContact CZ-CB 4.21Å; F119-N177 VanDerWaalsContact CZ-OD1 3.3Å; F119-N177 WeakPolarHBondContact CZ-OD1 3.41Å; F119-A178 HydrophobicContact CD2-CB 4.3Å; F119-A178 HydrophobicContact CE2-CB 4.27Å
120Y95.6Very high96Very high0 Ų024.3 Ų24.30%012%0.115CC..Hα-helixtrans-59.2-48.8175.9164.6-111.6000112.7L29 M30 S116 W117 S122 K123 Y124 P154 W157 W158 I161L29-Y120 HydrophobicContact CB-CE1 3.91Å; M30-Y120 HydrophobicContact SD-CD1 4.07Å; M30-Y120 HydrophobicContact SD-CE1 3.81Å; S116-Y120 WeakPolarHBondContact O-CB 3.45Å; S116-Y120 PolarHBondContact O-N 2.94Å; W117-Y120 WeakPolarHBondContact O-CB 3.1Å; W117-Y120 PolarHBondContact O-N 3.15Å; W117-Y120 VanDerWaalsContact O-N 3.1Å; Y120-S122 VanDerWaalsContact C-N 3.26Å; Y120-S122 PolarHBondContact O-N 3.13Å; Y120-K123 WeakPolarHBondContact O-CB 3.35Å; Y120-K123 PolarHBondContact O-N 3.37Å; Y120-K123 VanDerWaalsContact O-N 3.09Å; Y120-Y124 AromaticContact CD2-CE2 3.95Å; Y120-Y124 HydrophobicContact CD2-CE2 3.95Å; Y120-Y124 HydrophobicContact CE1-CE2 4Å; Y120-Y124 HydrophobicContact CE2-CD2 4.44Å; Y120-Y124 AromaticContact CE2-CE2 3.32Å; Y120-Y124 HydrophobicContact CE2-CE2 3.32Å; Y120-Y124 AromaticContact CE2-CZ 3.88Å; Y120-Y124 WeakPolarHBondContact CE2-OH 3.35Å; Y120-Y124 AromaticContact CZ-CE2 3.3Å; Y120-Y124 AromaticContact CZ-CZ 3.78Å; Y120-Y124 WeakPolarHBondContact O-CD2 3.49Å; Y120-Y124 VanDerWaalsContact OH-CE2 3.28Å; Y120-Y124 WeakPolarHBondContact OH-CE2 3.12Å; Y120-Y124 VanDerWaalsContact OH-CZ 3.26Å; Y120-Y124 PolarHBondContact OH-OH 2.88Å; Y120-P154 WeakPolarHBondContact CE2-O 3.39Å; Y120-W157 HydrophobicContact CD2-CB 3.8Å; Y120-W158 HydrophobicContact CE2-CB 3.77Å; Y120-W158 HydrophobicContact CE2-CG 4.45Å; Y120-W158 AromaticContact CZ-CD1 3.65Å; Y120-W158 VanDerWaalsContact OH-CD1 3.27Å; Y120-I161 HydrophobicContact CD1-CD1 3.49Å; Y120-I161 VanDerWaalsContact CD1-CD1 3.49Å; Y120-I161 HydrophobicContact CD2-CD1 3.82Å; Y120-I161 HydrophobicContact CE1-CD1 4.07Å; Y120-I161 HydrophobicContact CE2-CD1 4.33Å; Y120-I161 HydrophobicContact CG-CD1 3.36Å
121I96.6Very high96.1Very high29 Ų2924.8 Ų24.815%0.14912%0.117CC..Hα-helixtrans-61.4-36.9176.8-67.8-58.5000111.4L28 L29 W117 I118 K123 Y124 I125L28-I121 HydrophobicContact CB-CD1 4.46Å; L28-I121 HydrophobicContact CD2-CD1 4.45Å; L29-I121 HydrophobicContact CD1-CD1 4.11Å; L29-I121 HydrophobicContact CG-CD1 4.49Å; W117-I121 HydrophobicContact CD2-CG1 3.87Å; W117-I121 HydrophobicContact CE3-CG1 4.48Å; W117-I121 HydrophobicContact CG-CG1 4.37Å; W117-I121 HydrophobicContact CH2-CG1 4.24Å; W117-I121 HydrophobicContact CZ2-CD1 4.15Å; W117-I121 HydrophobicContact CZ2-CG1 3.61Å; W117-I121 WeakPolarHBondContact O-CG1 3.49Å; W117-I121 PolarHBondContact O-N 2.98Å; I118-I121 PolarHBondContact O-N 3.41Å; I121-K123 PolarHBondContact O-N 2.98Å; I121-K123 VanDerWaalsContact O-N 3.15Å; I121-Y124 PolarHBondContact O-N 3.41Å; I121-I125 HydrophobicContact CG2-CD1 4.24Å; I121-I125 PolarHBondContact O-N 2.99Å
122S97.5Very high96.2Very high0 Ų025.4 Ų25.40%012%0.118CC..Hα-helixtrans-54.5-36.2176.2810000111.9I118 F119 Y120 Y124 I125 E126I118-S122 PolarHBondContact O-N 3.17Å; F119-S122 WeakPolarHBondContact O-CB 3.38Å; F119-S122 PolarHBondContact O-N 3.33Å; F119-S122 PolarHBondContact O-OG 3.02Å; Y120-S122 VanDerWaalsContact C-N 3.26Å; Y120-S122 PolarHBondContact O-N 3.13Å; S122-Y124 VanDerWaalsContact C-N 3.25Å; S122-Y124 PolarHBondContact O-N 3.2Å; S122-I125 WeakPolarHBondContact O-CB 3.2Å; S122-I125 PolarHBondContact O-N 3.2Å; S122-E126 VanDerWaalsContact O-CG 3.26Å; S122-E126 WeakPolarHBondContact O-CG 3.16Å; S122-E126 PolarHBondContact O-N 3.28Å
123K97Very high96.3Very high2 Ų226.5 Ų26.51%0.00912%0.122CC..Hα-helixtrans-63.8-29179.5-56.7-55.197.4-174.60112.9F119 Y120 I121 E126 P154 N177F119-K123 HydrophobicContact CE1-CD 4.11Å; F119-K123 HydrophobicContact CE1-CG 4.35Å; F119-K123 HydrophobicContact CZ-CD 4.18Å; F119-K123 PolarHBondContact O-N 3.27Å; Y120-K123 WeakPolarHBondContact O-CB 3.35Å; Y120-K123 PolarHBondContact O-N 3.37Å; Y120-K123 VanDerWaalsContact O-N 3.09Å; I121-K123 PolarHBondContact O-N 2.98Å; I121-K123 VanDerWaalsContact O-N 3.15Å; K123-E126 WeakPolarHBondContact CE-OE2 3.33Å; K123-E126 IonicContact NZ-OE1 3.02Å; K123-E126 PolarHBondContact NZ-OE1 3.42Å; K123-E126 IonicContact NZ-OE2 3.71Å; K123-E126 PolarHBondContact NZ-OE2 3.25Å; K123-P154 HydrophobicContact CB-CB 3.84Å; K123-P154 HydrophobicContact CB-CG 4.38Å; K123-N177 PolarHBondContact NZ-OD1 3.47Å
124Y96.6Very high96.5Very high26 Ų2626.8 Ų26.810%0.10212%0.124CC..Hα-helixtrans-75.8-36.9173.5-68.5-89.2000112.1L29 M36 I39 L40 Y120 I121 S122 E126 L127 P154L29-Y124 HydrophobicContact CD1-CD1 4.09Å; L29-Y124 HydrophobicContact CD1-CD2 3.93Å; L29-Y124 HydrophobicContact CD1-CE1 4.03Å; L29-Y124 HydrophobicContact CD1-CE2 3.91Å; L29-Y124 HydrophobicContact CD1-CG 4.04Å; M36-Y124 WeakPolarHBondContact CB-OH 3.36Å; I39-Y124 HydrophobicContact CB-CE1 4.49Å; I39-Y124 HydrophobicContact CG2-CD1 3.88Å; I39-Y124 HydrophobicContact CG2-CE1 4.07Å; L40-Y124 HydrophobicContact CD2-CE1 4.12Å; L40-Y124 HydrophobicContact CG-CE1 4.3Å; Y120-Y124 AromaticContact CD2-CE2 3.95Å; Y120-Y124 HydrophobicContact CD2-CE2 3.95Å; Y120-Y124 HydrophobicContact CE1-CE2 4Å; Y120-Y124 HydrophobicContact CE2-CD2 4.44Å; Y120-Y124 AromaticContact CE2-CE2 3.32Å; Y120-Y124 HydrophobicContact CE2-CE2 3.32Å; Y120-Y124 AromaticContact CE2-CZ 3.88Å; Y120-Y124 WeakPolarHBondContact CE2-OH 3.35Å; Y120-Y124 AromaticContact CZ-CE2 3.3Å; Y120-Y124 AromaticContact CZ-CZ 3.78Å; Y120-Y124 WeakPolarHBondContact O-CD2 3.49Å; Y120-Y124 VanDerWaalsContact OH-CE2 3.28Å; Y120-Y124 WeakPolarHBondContact OH-CE2 3.12Å; Y120-Y124 VanDerWaalsContact OH-CZ 3.26Å; Y120-Y124 PolarHBondContact OH-OH 2.88Å; I121-Y124 PolarHBondContact O-N 3.41Å; S122-Y124 VanDerWaalsContact C-N 3.25Å; S122-Y124 PolarHBondContact O-N 3.2Å; Y124-E126 PolarHBondContact O-N 3.47Å; Y124-L127 HydrophobicContact CD1-CD1 4.12Å; Y124-L127 VanDerWaalsContact O-CB 3.26Å; Y124-L127 WeakPolarHBondContact O-CB 3.47Å; Y124-L127 VanDerWaalsContact O-CG 3.3Å; Y124-L127 WeakPolarHBondContact O-CG 3.34Å; Y124-L127 PolarHBondContact O-N 3.47Å; Y124-L127 VanDerWaalsContact O-N 3.16Å; Y124-P154 HydrophobicContact CD2-CB 4.34Å; Y124-P154 HydrophobicContact CE1-CB 4.21Å; Y124-P154 HydrophobicContact CE2-CB 3.73Å
125I97.8Very high96.6Very high61 Ų6122.3 Ų22.331%0.31311%0.11SC..Hα-helixtrans-63-38174.2-60.5171.9000109.6Y70 M74 M77 I121 S122 L127 L128Y70-I125 HydrophobicContact CE2-CG2 4.06Å; Y70-I125 PolarHBondContact OH-O 2.82Å; M74-I125 HydrophobicContact SD-CB 4.42Å; M74-I125 HydrophobicContact SD-CG2 3.59Å; M74-I125 VanDerWaalsContact SD-CG2 3.59Å; M77-I125 HydrophobicContact CE-CB 4.45Å; M77-I125 HydrophobicContact CE-CD1 4.05Å; M77-I125 HydrophobicContact CE-CG2 4.41Å; M77-I125 HydrophobicContact SD-CD1 3.73Å; I121-I125 HydrophobicContact CG2-CD1 4.24Å; I121-I125 PolarHBondContact O-N 2.99Å; S122-I125 WeakPolarHBondContact O-CB 3.2Å; S122-I125 PolarHBondContact O-N 3.2Å; I125-L127 PolarHBondContact O-N 3.35Å; I125-L127 VanDerWaalsContact O-N 3.15Å; I125-L128 HydrophobicContact CG2-CD1 4.37Å; I125-L128 VanDerWaalsContact O-CB 3.26Å; I125-L128 WeakPolarHBondContact O-CB 3.08Å; I125-L128 VanDerWaalsContact O-CG 3.27Å; I125-L128 WeakPolarHBondContact O-CG 3.2Å; I125-L128 PolarHBondContact O-N 2.92Å
126E97.8Very high96.6Very high1 Ų126 Ų261%0.00512%0.124CC..THydrogen-bonded Turntrans-62.8-17.7176.5-67.3-180177.700114M74 S122 K123 Y124 L128 D129 H181 Y185M74-E126 HydrophobicContact CE-CG 3.39Å; S122-E126 VanDerWaalsContact O-CG 3.26Å; S122-E126 WeakPolarHBondContact O-CG 3.16Å; S122-E126 PolarHBondContact O-N 3.28Å; K123-E126 WeakPolarHBondContact CE-OE2 3.33Å; K123-E126 IonicContact NZ-OE1 3.02Å; K123-E126 PolarHBondContact NZ-OE1 3.42Å; K123-E126 IonicContact NZ-OE2 3.71Å; K123-E126 PolarHBondContact NZ-OE2 3.25Å; Y124-E126 PolarHBondContact O-N 3.47Å; E126-L128 PolarHBondContact O-N 3.41Å; E126-L128 VanDerWaalsContact O-N 3.16Å; E126-D129 VanDerWaalsContact O-CB 3.26Å; E126-D129 WeakPolarHBondContact O-CB 3.27Å; E126-D129 VanDerWaalsContact O-CG 3.31Å; E126-D129 PolarHBondContact O-N 2.93Å; E126-H181 IonicContact OE1-CE1 3.13Å; E126-H181 PolarHBondContact OE1-CE1 2.89Å; E126-H181 VanDerWaalsContact OE1-CE1 3.25Å; E126-H181 IonicContact OE1-ND1 3.24Å; E126-H181 PolarHBondContact OE1-ND1 3.38Å; E126-H181 IonicContact OE2-CE1 2.72Å; E126-H181 PolarHBondContact OE2-CE1 3.47Å; E126-H181 IonicContact OE2-ND1 3.25Å; E126-Y185 HydrophobicContact CG-CE2 4.35Å; E126-Y185 VanDerWaalsContact CG-OH 3.23Å; E126-Y185 WeakPolarHBondContact CG-OH 3.48Å
127L97.4Very high96.6Very high18 Ų1829.8 Ų29.89%0.09414%0.14CC..THydrogen-bonded Turntrans-62.4-21.3173-56.8-178.8000112.2I39 L40 Y43 Y124 I125 D129 T130 L131 H150I39-L127 HydrophobicContact CG2-CD1 4.33Å; L40-L127 HydrophobicContact CD2-CD1 4.09Å; Y43-L127 HydrophobicContact CD1-CD2 4.13Å; Y43-L127 HydrophobicContact CD2-CB 3.82Å; Y43-L127 HydrophobicContact CD2-CD1 4.18Å; Y43-L127 HydrophobicContact CD2-CD2 3.89Å; Y43-L127 HydrophobicContact CD2-CG 4.17Å; Y43-L127 HydrophobicContact CE1-CD2 4.06Å; Y43-L127 HydrophobicContact CE2-CB 3.94Å; Y43-L127 HydrophobicContact CE2-CD2 3.78Å; Y43-L127 HydrophobicContact CE2-CG 4.36Å; Y43-L127 HydrophobicContact CG-CD1 4.16Å; Y43-L127 HydrophobicContact CG-CD2 4.06Å; Y43-L127 HydrophobicContact CG-CG 4.5Å; Y124-L127 HydrophobicContact CD1-CD1 4.12Å; Y124-L127 VanDerWaalsContact O-CB 3.26Å; Y124-L127 WeakPolarHBondContact O-CB 3.47Å; Y124-L127 VanDerWaalsContact O-CG 3.3Å; Y124-L127 WeakPolarHBondContact O-CG 3.34Å; Y124-L127 PolarHBondContact O-N 3.47Å; Y124-L127 VanDerWaalsContact O-N 3.16Å; I125-L127 PolarHBondContact O-N 3.35Å; I125-L127 VanDerWaalsContact O-N 3.15Å; L127-D129 PolarHBondContact O-N 3.45Å; L127-T130 PolarHBondContact O-N 3.32Å; L127-L131 PolarHBondContact O-N 3.43Å; L127-H150 HydrophobicContact CD2-CB 4.01Å; L127-H150 WeakPolarHBondContact CD2-O 3.5Å
128L97.1Very high96.4Very high67 Ų6731.8 Ų31.835%0.35115%0.15SC..Hα-helixtrans-62.9-23.5173.6-64.5175.3000112.4Y70 I125 E126 T130 L131 F132Y70-L128 HydrophobicContact CD2-CB 4.44Å; Y70-L128 HydrophobicContact CD2-CD1 4.09Å; Y70-L128 HydrophobicContact CE2-CB 3.8Å; Y70-L128 HydrophobicContact CE2-CD1 3.87Å; Y70-L128 HydrophobicContact CE2-CG 4.43Å; I125-L128 HydrophobicContact CG2-CD1 4.37Å; I125-L128 VanDerWaalsContact O-CB 3.26Å; I125-L128 WeakPolarHBondContact O-CB 3.08Å; I125-L128 VanDerWaalsContact O-CG 3.27Å; I125-L128 WeakPolarHBondContact O-CG 3.2Å; I125-L128 PolarHBondContact O-N 2.92Å; E126-L128 PolarHBondContact O-N 3.41Å; E126-L128 VanDerWaalsContact O-N 3.16Å; L128-T130 VanDerWaalsContact C-N 3.28Å; L128-T130 PolarHBondContact O-N 3.27Å; L128-L131 HydrophobicContact CD2-CD2 3.72Å; L128-L131 WeakPolarHBondContact O-CB 3.38Å; L128-L131 PolarHBondContact O-N 3.29Å; L128-L131 VanDerWaalsContact O-N 3.15Å; L128-F132 HydrophobicContact CB-CE2 4.13Å; L128-F132 WeakPolarHBondContact O-CD2 3.38Å; L128-F132 PolarHBondContact O-N 3.41Å
129D96.4Very high96.1Very high12 Ų1233.9 Ų33.96%0.06416%0.159CC..Hα-helixtrans-55-47.4173.9-69.5-17.7000110.9Y70 E126 L127 F132 F133 H150 Y185Y70-D129 WeakPolarHBondContact CE1-OD1 3.25Å; Y70-D129 VanDerWaalsContact CZ-OD1 3.23Å; Y70-D129 PolarHBondContact OH-OD1 2.94Å; E126-D129 VanDerWaalsContact O-CB 3.26Å; E126-D129 WeakPolarHBondContact O-CB 3.27Å; E126-D129 VanDerWaalsContact O-CG 3.31Å; E126-D129 PolarHBondContact O-N 2.93Å; L127-D129 PolarHBondContact O-N 3.45Å; D129-F132 PolarHBondContact O-N 2.96Å; D129-F133 WeakPolarHBondContact O-CG 3.3Å; D129-F133 PolarHBondContact O-N 2.74Å; D129-F133 VanDerWaalsContact O-N 3.1Å; D129-H150 IonicContact OD2-CE1 2.73Å; D129-Y185 PolarHBondContact OD2-OH 3.21Å
130T96.9Very high95.8Very high0 Ų038 Ų380%019%0.188CC..Hα-helixtrans-70.1-36.6179.4-41.80000111.4Y43 S47 L127 L128 F132 F133 V134 I142 H146Y43-T130 HydrophobicContact CE2-CG2 4.09Å; Y43-T130 WeakPolarHBondContact CE2-OG1 3.43Å; Y43-T130 PolarHBondContact OH-OG1 2.93Å; S47-T130 VanDerWaalsContact OG-CG2 3.32Å; S47-T130 WeakPolarHBondContact OG-CG2 3.05Å; L127-T130 PolarHBondContact O-N 3.32Å; L128-T130 VanDerWaalsContact C-N 3.28Å; L128-T130 PolarHBondContact O-N 3.27Å; T130-F132 VanDerWaalsContact C-N 3.32Å; T130-F132 PolarHBondContact O-N 3.26Å; T130-F133 WeakPolarHBondContact O-CB 3.24Å; T130-F133 PolarHBondContact O-N 3.28Å; T130-F133 VanDerWaalsContact O-N 3.12Å; T130-V134 WeakPolarHBondContact O-CG2 3.32Å; T130-V134 PolarHBondContact O-N 3.39Å; T130-I142 HydrophobicContact CG2-CD1 3.89Å; T130-I142 HydrophobicContact CG2-CG1 4.24Å; T130-I142 HydrophobicContact CG2-CG2 4.18Å; T130-H146 PolarHBondContact OG1-CD2 2.93Å; T130-H146 PolarHBondContact OG1-NE2 3.39Å
131L96.6Very high95.5Very high80 Ų8041.5 Ų41.542%0.41920%0.204SC..Hα-helixtrans-58.5-45.7173.6-179.563.6000110.9L127 L128 F133 V134 L135L127-L131 PolarHBondContact O-N 3.43Å; L128-L131 HydrophobicContact CD2-CD2 3.72Å; L128-L131 WeakPolarHBondContact O-CB 3.38Å; L128-L131 PolarHBondContact O-N 3.29Å; L128-L131 VanDerWaalsContact O-N 3.15Å; L131-F133 VanDerWaalsContact C-N 3.31Å; L131-F133 PolarHBondContact O-N 2.9Å; L131-V134 PolarHBondContact O-N 3.48Å; L131-L135 HydrophobicContact CD1-CD1 3.89Å; L131-L135 HydrophobicContact CD1-CG 4.03Å; L131-L135 HydrophobicContact CG-CD1 3.89Å; L131-L135 HydrophobicContact CG-CG 4.37Å; L131-L135 WeakPolarHBondContact O-CB 3.42Å; L131-L135 WeakPolarHBondContact O-CG 3.45Å; L131-L135 PolarHBondContact O-N 3.33Å
132F96.7Very high95.3Very high22 Ų2241.4 Ų41.410%0.09620%0.204CC..Hα-helixtrans-60.9-39174.9-68.5-57.6000112L63 P66 M67 Y70 L128 D129 T130 R136L63-F132 HydrophobicContact CB-CD1 4.29Å; L63-F132 HydrophobicContact CD1-CD1 3.87Å; L63-F132 HydrophobicContact CD1-CE1 4.4Å; P66-F132 HydrophobicContact CB-CE1 4.34Å; M67-F132 HydrophobicContact CE-CB 4.34Å; M67-F132 HydrophobicContact CG-CB 4.34Å; M67-F132 HydrophobicContact CG-CD1 3.56Å; M67-F132 HydrophobicContact CG-CD2 4.19Å; M67-F132 HydrophobicContact CG-CE1 3.82Å; M67-F132 HydrophobicContact CG-CE2 4.43Å; M67-F132 HydrophobicContact CG-CG 3.78Å; M67-F132 HydrophobicContact CG-CZ 4.25Å; M67-F132 HydrophobicContact SD-CB 4.23Å; M67-F132 HydrophobicContact SD-CD1 4.35Å; M67-F132 HydrophobicContact SD-CG 4.32Å; Y70-F132 HydrophobicContact CD1-CD2 4.19Å; Y70-F132 AromaticContact CD1-CE2 3.49Å; Y70-F132 HydrophobicContact CD1-CE2 3.49Å; Y70-F132 VanDerWaalsContact CD1-CE2 3.49Å; Y70-F132 HydrophobicContact CD1-CZ 4.33Å; Y70-F132 HydrophobicContact CD2-CE2 4.06Å; Y70-F132 HydrophobicContact CE1-CD2 4.3Å; Y70-F132 AromaticContact CE1-CE2 3.89Å; Y70-F132 HydrophobicContact CE1-CE2 3.89Å; Y70-F132 HydrophobicContact CE2-CE2 4.41Å; Y70-F132 AromaticContact CG-CE2 3.57Å; Y70-F132 HydrophobicContact CG-CE2 3.57Å; Y70-F132 HydrophobicContact CG-CZ 4.07Å; L128-F132 HydrophobicContact CB-CE2 4.13Å; L128-F132 WeakPolarHBondContact O-CD2 3.38Å; L128-F132 PolarHBondContact O-N 3.41Å; D129-F132 PolarHBondContact O-N 2.96Å; T130-F132 VanDerWaalsContact C-N 3.32Å; T130-F132 PolarHBondContact O-N 3.26Å; F132-R136 VanDerWaalsContact O-CB 3.25Å; F132-R136 WeakPolarHBondContact O-CB 3.35Å; F132-R136 VanDerWaalsContact O-CG 3.23Å; F132-R136 WeakPolarHBondContact O-CG 3.29Å; F132-R136 PolarHBondContact O-N 3.43Å
133F95.9Very high95.1Very high23 Ų2343.5 Ų43.510%0.10122%0.216CC..Hα-helixtrans-64.1-44176.1-60.3-24.3000112.5D129 T130 L131 K137 K138 Q141 I142 H146D129-F133 WeakPolarHBondContact O-CG 3.3Å; D129-F133 PolarHBondContact O-N 2.74Å; D129-F133 VanDerWaalsContact O-N 3.1Å; T130-F133 WeakPolarHBondContact O-CB 3.24Å; T130-F133 PolarHBondContact O-N 3.28Å; T130-F133 VanDerWaalsContact O-N 3.12Å; L131-F133 VanDerWaalsContact C-N 3.31Å; L131-F133 PolarHBondContact O-N 2.9Å; F133-K137 PolarHBondContact O-N 3.4Å; F133-K138 PolarHBondContact O-N 2.89Å; F133-Q141 HydrophobicContact CD1-CB 4.05Å; F133-Q141 HydrophobicContact CD1-CG 4.49Å; F133-Q141 HydrophobicContact CD2-CB 3.75Å; F133-Q141 HydrophobicContact CE1-CB 4.18Å; F133-Q141 HydrophobicContact CE2-CB 3.86Å; F133-Q141 HydrophobicContact CG-CB 3.85Å; F133-Q141 HydrophobicContact CZ-CB 4.1Å; F133-I142 HydrophobicContact CB-CD1 3.99Å; F133-I142 HydrophobicContact CB-CG1 3.74Å; F133-I142 HydrophobicContact CD2-CG1 4.18Å; F133-I142 HydrophobicContact CG-CG1 4.45Å; F133-H146 AromaticContact CE2-CE1 3.57Å; F133-H146 AromaticContact CE2-ND1 3.94Å; F133-H146 AromaticContact CE2-NE2 3.8Å
134V96.9Very high94.8Very high8 Ų850.3 Ų50.35%0.04825%0.246CC..Hα-helixtrans-61.4-53.7177.4171.30000110.7M55 T130 L131 R136 K137 I142M55-V134 HydrophobicContact CG-CG1 4.27Å; T130-V134 WeakPolarHBondContact O-CG2 3.32Å; T130-V134 PolarHBondContact O-N 3.39Å; L131-V134 PolarHBondContact O-N 3.48Å; V134-R136 VanDerWaalsContact C-N 3.26Å; V134-R136 PolarHBondContact O-N 3.01Å; V134-K137 PolarHBondContact O-N 3.17Å; V134-I142 HydrophobicContact CG2-CD1 3.46Å; V134-I142 VanDerWaalsContact CG2-CD1 3.46Å
135L96.7Very high94.5Very high38 Ų3850.3 Ų50.320%0.19925%0.248CC..Hα-helixtrans-66.8-26.3-175-66.2179.3000113.1M55 L61 L63 L131M55-L135 WeakPolarHBondContact CE-O 3.45Å; M55-L135 HydrophobicContact SD-CD2 4.12Å; L61-L135 HydrophobicContact CD1-CB 4.22Å; L61-L135 HydrophobicContact CD1-CD1 4.41Å; L61-L135 HydrophobicContact CD1-CD2 4.17Å; L61-L135 PolarHBondContact N-O 3.22Å; L63-L135 HydrophobicContact CD1-CB 3.66Å; L63-L135 HydrophobicContact CD1-CD1 3.84Å; L63-L135 HydrophobicContact CD1-CG 4.42Å; L131-L135 HydrophobicContact CD1-CD1 3.89Å; L131-L135 HydrophobicContact CD1-CG 4.03Å; L131-L135 HydrophobicContact CG-CD1 3.89Å; L131-L135 HydrophobicContact CG-CG 4.37Å; L131-L135 WeakPolarHBondContact O-CB 3.42Å; L131-L135 WeakPolarHBondContact O-CG 3.45Å; L131-L135 PolarHBondContact O-N 3.33Å
136R95.5Very high94.3Very high78 Ų7848.8 Ų48.829%0.29424%0.239SC..THydrogen-bonded Turntrans-91.33.7174.8-64.8-179.665.4-154.70.4113.8P60 L63 M67 F132 V134 K138P60-R136 WeakPolarHBondContact CB-O 3.29Å; L63-R136 HydrophobicContact CD1-CG 4.33Å; M67-R136 WeakPolarHBondContact SD-CD 3.48Å; M67-R136 PolarHBondContact SD-NH1 3.26Å; F132-R136 VanDerWaalsContact O-CB 3.25Å; F132-R136 WeakPolarHBondContact O-CB 3.35Å; F132-R136 VanDerWaalsContact O-CG 3.23Å; F132-R136 WeakPolarHBondContact O-CG 3.29Å; F132-R136 PolarHBondContact O-N 3.43Å; V134-R136 VanDerWaalsContact C-N 3.26Å; V134-R136 PolarHBondContact O-N 3.01Å; R136-K138 HydrophobicContact CB-CG 3.98Å; R136-K138 PolarHBondContact O-N 3.47Å
137K94.9Very high94.2Very high84 Ų8449.6 Ų49.637%0.36525%0.245SC..THydrogen-bonded Turntrans5438.4-175.1-55.4-176.578.1160.20113M55 A56 R58 P60 F133 V134 Q139M55-K137 HydrophobicContact CB-CG 4.28Å; M55-K137 HydrophobicContact CE-CG 4.22Å; M55-K137 WeakPolarHBondContact O-CE 3.33Å; M55-K137 PolarHBondContact O-NZ 3Å; A56-K137 PolarHBondContact O-NZ 3.47Å; R58-K137 WeakPolarHBondContact O-CD 3.3Å; R58-K137 PolarHBondContact O-NZ 2.9Å; P60-K137 HydrophobicContact CB-CB 4.31Å; P60-K137 HydrophobicContact CB-CD 4.26Å; P60-K137 HydrophobicContact CB-CG 4.12Å; F133-K137 PolarHBondContact O-N 3.4Å; V134-K137 PolarHBondContact O-N 3.17Å; K137-Q139 VanDerWaalsContact C-N 3.34Å; K137-Q139 PolarHBondContact O-N 3.34Å
138K92.3Very high94Very high93 Ų9350.9 Ų50.940%0.40425%0.249SC..  trans-9653.5176.7-62.1-60-176-175.10111.7F133 R136 S140 Q141F133-K138 PolarHBondContact O-N 2.89Å; R136-K138 HydrophobicContact CB-CG 3.98Å; R136-K138 PolarHBondContact O-N 3.47Å; K138-S140 PolarHBondContact O-N 3.28Å; K138-S140 VanDerWaalsContact O-N 3.13Å; K138-Q141 HydrophobicContact CB-CG 4.18Å; K138-Q141 WeakPolarHBondContact O-CB 3.37Å; K138-Q141 PolarHBondContact O-N 3.41Å
139Q90.1Very high93.9Very high70 Ų7048.8 Ų48.833%0.32724%0.238SC..G310 helixtrans-61.7-25.6-173.9-58.8-58.1-5.400114.1K137 Q141 I142K137-Q139 VanDerWaalsContact C-N 3.34Å; K137-Q139 PolarHBondContact O-N 3.34Å; Q139-Q141 PolarHBondContact O-N 3.34Å; Q139-Q141 VanDerWaalsContact O-N 3.12Å; Q139-I142 PolarHBondContact O-N 2.96Å
140S88.7Confident93.8Very high86 Ų8648.8 Ų48.860%0.60124%0.237SC*.G310 helixtrans-62-18.2172.460.60000113.7K138 R266K138-S140 PolarHBondContact O-N 3.28Å; K138-S140 VanDerWaalsContact O-N 3.13Å; S140-R266 PolarHBondContact O-NH2 3.46Å
141Q89.6Confident93.7Very high74 Ų7449.7 Ų49.735%0.34624%0.244SC..G310 helixtrans-85.1-23.7174.4-58.5-170.9-97.900112.7F133 K138 Q139 T143F133-Q141 HydrophobicContact CD1-CB 4.05Å; F133-Q141 HydrophobicContact CD1-CG 4.49Å; F133-Q141 HydrophobicContact CD2-CB 3.75Å; F133-Q141 HydrophobicContact CE1-CB 4.18Å; F133-Q141 HydrophobicContact CE2-CB 3.86Å; F133-Q141 HydrophobicContact CG-CB 3.85Å; F133-Q141 HydrophobicContact CZ-CB 4.1Å; K138-Q141 HydrophobicContact CB-CG 4.18Å; K138-Q141 WeakPolarHBondContact O-CB 3.37Å; K138-Q141 PolarHBondContact O-N 3.41Å; Q139-Q141 PolarHBondContact O-N 3.34Å; Q139-Q141 VanDerWaalsContact O-N 3.12Å; Q141-T143 PolarHBondContact O-N 2.94Å
142I93.1Very high93.5Very high27 Ų2749.3 Ų49.314%0.13824%0.239CC..  trans-81.573.5176.8-47.8-168.6000108.9T130 F133 V134 Q139 V147T130-I142 HydrophobicContact CG2-CD1 3.89Å; T130-I142 HydrophobicContact CG2-CG1 4.24Å; T130-I142 HydrophobicContact CG2-CG2 4.18Å; F133-I142 HydrophobicContact CB-CD1 3.99Å; F133-I142 HydrophobicContact CB-CG1 3.74Å; F133-I142 HydrophobicContact CD2-CG1 4.18Å; F133-I142 HydrophobicContact CG-CG1 4.45Å; V134-I142 HydrophobicContact CG2-CD1 3.46Å; V134-I142 VanDerWaalsContact CG2-CD1 3.46Å; Q139-I142 PolarHBondContact O-N 2.96Å; I142-V147 HydrophobicContact CG2-CG2 3.4Å; I142-V147 VanDerWaalsContact CG2-CG2 3.4Å
143T92.9Very high93.3Very high43 Ų4349.2 Ų49.226%0.26424%0.239SC..  trans-87.3165.1178.866.80000111.3Q141 L145 H146 V147Q141-T143 PolarHBondContact O-N 2.94Å; T143-L145 VanDerWaalsContact C-N 3.25Å; T143-L145 PolarHBondContact O-N 3.23Å; T143-H146 PolarHBondContact O-N 2.98Å; T143-H146 VanDerWaalsContact O-N 3.13Å; T143-H146 PolarHBondContact OG1-N 3.2Å; T143-H146 VanDerWaalsContact OG1-N 3.17Å; T143-V147 PolarHBondContact O-N 3.13Å
144F91.7Very high93.2Very high145 Ų14548.1 Ų48.164%0.63623%0.234SC*.Hα-helixtrans-51.8-47169173.5-99.6000111.4H146 V147 F148 L252F144-H146 VanDerWaalsContact C-N 3.3Å; F144-H146 PolarHBondContact O-N 3.42Å; F144-V147 PolarHBondContact O-N 2.8Å; F144-F148 HydrophobicContact CE1-CB 4.25Å; F144-F148 HydrophobicContact CE1-CG 4.35Å; F144-F148 HydrophobicContact CE2-CB 4.29Å; F144-F148 HydrophobicContact CZ-CB 4.11Å; F144-F148 HydrophobicContact CZ-CD2 4.11Å; F144-F148 HydrophobicContact CZ-CG 4.08Å; F144-F148 WeakPolarHBondContact O-CB 3.46Å; F144-F148 PolarHBondContact O-N 3.45Å; F144-L252 HydrophobicContact CE1-CD2 4.49Å
145L90.3Very high93.1Very high27 Ų2751.8 Ų51.814%0.14125%0.247CC..Hα-helixtrans-54.7-46.7177.5175.656.5000111.9T143 H149 F249 L252 F253 F256T143-L145 VanDerWaalsContact C-N 3.25Å; T143-L145 PolarHBondContact O-N 3.23Å; L145-H149 WeakPolarHBondContact O-CB 3.48Å; L145-H149 PolarHBondContact O-N 2.93Å; L145-F249 HydrophobicContact CD1-CD1 4.5Å; L145-L252 HydrophobicContact CD1-CB 3.62Å; L145-L252 HydrophobicContact CD1-CD1 3.9Å; L145-L252 HydrophobicContact CD1-CG 4.28Å; L145-F253 HydrophobicContact CD1-CD2 4.2Å; L145-F253 HydrophobicContact CD1-CE2 4Å; L145-F253 HydrophobicContact CD2-CD2 4.24Å; L145-F253 HydrophobicContact CD2-CE2 4.2Å; L145-F253 HydrophobicContact CG-CE2 4.43Å; L145-F256 HydrophobicContact CD2-CB 4.14Å
146H93.6Very high92.8Very high28 Ų2850.6 Ų50.613%0.1324%0.241CC..Hα-helixtrans-64.2-54.4-179.2-175.380.4000111.7T130 F133 T143 F144 H149 H150T130-H146 PolarHBondContact OG1-CD2 2.93Å; T130-H146 PolarHBondContact OG1-NE2 3.39Å; F133-H146 AromaticContact CE2-CE1 3.57Å; F133-H146 AromaticContact CE2-ND1 3.94Å; F133-H146 AromaticContact CE2-NE2 3.8Å; T143-H146 PolarHBondContact O-N 2.98Å; T143-H146 VanDerWaalsContact O-N 3.13Å; T143-H146 PolarHBondContact OG1-N 3.2Å; T143-H146 VanDerWaalsContact OG1-N 3.17Å; F144-H146 VanDerWaalsContact C-N 3.3Å; F144-H146 PolarHBondContact O-N 3.42Å; H146-H149 PolarHBondContact O-N 3.25Å; H146-H150 AromaticContact CD2-CD2 3.98Å; H146-H150 AromaticContact CE1-CD2 3.17Å; H146-H150 PolarHBondContact CE1-CD2 3.11Å; H146-H150 AromaticContact CE1-NE2 3.24Å; H146-H150 PolarHBondContact CE1-NE2 3.45Å; H146-H150 AromaticContact CG-CD2 3.99Å; H146-H150 AromaticContact ND1-CD2 3.55Å; H146-H150 AromaticContact ND1-NE2 3.72Å; H146-H150 AromaticContact NE2-CD2 3.48Å; H146-H150 PolarHBondContact NE2-CD2 2.95Å; H146-H150 AromaticContact NE2-NE2 3.96Å; H146-H150 PolarHBondContact O-CD2 3.09Å; H146-H150 VanDerWaalsContact O-CD2 3.27Å; H146-H150 PolarHBondContact O-N 2.91Å
147V95Very high92.6Very high19 Ų1947.3 Ų47.312%0.11523%0.229CC..Hα-helixtrans-67-41.5-176.8179.10000111.1Y43 V44 V48 I142 T143 F144 S151Y43-V147 HydrophobicContact CE1-CG1 4.43Å; V44-V147 HydrophobicContact CG2-CG1 4.28Å; V48-V147 HydrophobicContact CG2-CG1 4.25Å; V48-V147 HydrophobicContact CG2-CG2 4.22Å; I142-V147 HydrophobicContact CG2-CG2 3.4Å; I142-V147 VanDerWaalsContact CG2-CG2 3.4Å; T143-V147 PolarHBondContact O-N 3.13Å; F144-V147 PolarHBondContact O-N 2.8Å; V147-S151 VanDerWaalsContact O-CB 3.27Å; V147-S151 WeakPolarHBondContact O-CB 3.11Å; V147-S151 PolarHBondContact O-N 3.22Å; V147-S151 PolarHBondContact O-OG 3.48Å
148F93.2Very high92.5Very high45 Ų4543.3 Ų43.320%0.19721%0.212CC..Hα-helixtrans-59.5-51.5175.9179.5-104.5000110.7F144 S151 F152 L248 F249 L252F144-F148 HydrophobicContact CE1-CB 4.25Å; F144-F148 HydrophobicContact CE1-CG 4.35Å; F144-F148 HydrophobicContact CE2-CB 4.29Å; F144-F148 HydrophobicContact CZ-CB 4.11Å; F144-F148 HydrophobicContact CZ-CD2 4.11Å; F144-F148 HydrophobicContact CZ-CG 4.08Å; F144-F148 WeakPolarHBondContact O-CB 3.46Å; F144-F148 PolarHBondContact O-N 3.45Å; F148-S151 PolarHBondContact O-N 2.93Å; F148-F152 HydrophobicContact CE2-CB 4.33Å; F148-F152 HydrophobicContact CE2-CD1 4.16Å; F148-F152 HydrophobicContact CE2-CD2 4.29Å; F148-F152 HydrophobicContact CE2-CG 4.04Å; F148-F152 HydrophobicContact CZ-CB 4.41Å; F148-F152 AromaticContact CZ-CD1 3.95Å; F148-F152 HydrophobicContact CZ-CD1 3.95Å; F148-F152 HydrophobicContact CZ-CE1 4.39Å; F148-F152 HydrophobicContact CZ-CG 4.21Å; F148-F152 VanDerWaalsContact O-CB 3.25Å; F148-F152 WeakPolarHBondContact O-CB 3.42Å; F148-F152 PolarHBondContact O-N 2.93Å; F148-L248 HydrophobicContact CE1-CD2 3.81Å; F148-L248 HydrophobicContact CZ-CD2 3.94Å; F148-F249 HydrophobicContact CD1-CE1 4.12Å; F148-F249 HydrophobicContact CD1-CZ 4.38Å; F148-F249 HydrophobicContact CE1-CE1 4.2Å; F148-F249 HydrophobicContact CE1-CZ 4.16Å; F148-L252 HydrophobicContact CD1-CD1 4.23Å; F148-L252 HydrophobicContact CE1-CD1 4.39Å
149H94.1Very high92.3Very high22 Ų2242 Ų4210%0.10220%0.204CC..Hα-helixtrans-56.7-55.6176.8176.1-93.1000112L145 H146 S151 F152 M153 F249L145-H149 WeakPolarHBondContact O-CB 3.48Å; L145-H149 PolarHBondContact O-N 2.93Å; H146-H149 PolarHBondContact O-N 3.25Å; H149-S151 PolarHBondContact O-N 3.31Å; H149-F152 PolarHBondContact O-N 3.26Å; H149-M153 WeakPolarHBondContact O-CB 3.5Å; H149-M153 WeakPolarHBondContact O-CG 3.46Å; H149-M153 PolarHBondContact O-N 2.87Å; H149-F249 HydrophobicContact CB-CE1 3.91Å; H149-F249 HydrophobicContact CB-CZ 4.37Å; H149-F249 AromaticContact CD2-CE1 3.68Å; H149-F249 AromaticContact CD2-CZ 3.82Å
150H95.6Very high92.2Very high13 Ų1338.8 Ų38.86%0.0619%0.189CC..Hα-helixtrans-70.2-17.1-175.7-77.1-81.3000114.2Y43 L127 D129 H146 P154Y43-H150 HydrophobicContact CE1-CB 4.39Å; Y43-H150 WeakPolarHBondContact OH-CB 3.19Å; L127-H150 HydrophobicContact CD2-CB 4.01Å; L127-H150 WeakPolarHBondContact CD2-O 3.5Å; D129-H150 IonicContact OD2-CE1 2.73Å; H146-H150 AromaticContact CD2-CD2 3.98Å; H146-H150 AromaticContact CE1-CD2 3.17Å; H146-H150 PolarHBondContact CE1-CD2 3.11Å; H146-H150 AromaticContact CE1-NE2 3.24Å; H146-H150 PolarHBondContact CE1-NE2 3.45Å; H146-H150 AromaticContact CG-CD2 3.99Å; H146-H150 AromaticContact ND1-CD2 3.55Å; H146-H150 AromaticContact ND1-NE2 3.72Å; H146-H150 AromaticContact NE2-CD2 3.48Å; H146-H150 PolarHBondContact NE2-CD2 2.95Å; H146-H150 AromaticContact NE2-NE2 3.96Å; H146-H150 PolarHBondContact O-CD2 3.09Å; H146-H150 VanDerWaalsContact O-CD2 3.27Å; H146-H150 PolarHBondContact O-N 2.91Å; H150-P154 WeakPolarHBondContact O-CD 3.07Å; H150-P154 WeakPolarHBondContact O-CG 3.3Å
151S94.4Very high92.1Very high19 Ų1934.8 Ų34.813%0.13316%0.161CC..Hα-helixtrans-88.4-47.7172.9-48.70000111.6Y43 V44 V147 F148 H149 P154 W155Y43-S151 WeakPolarHBondContact CE1-OG 3.33Å; V44-S151 VanDerWaalsContact CG2-OG 3.27Å; V44-S151 WeakPolarHBondContact CG2-OG 3.49Å; V147-S151 VanDerWaalsContact O-CB 3.27Å; V147-S151 WeakPolarHBondContact O-CB 3.11Å; V147-S151 PolarHBondContact O-N 3.22Å; V147-S151 PolarHBondContact O-OG 3.48Å; F148-S151 PolarHBondContact O-N 2.93Å; H149-S151 PolarHBondContact O-N 3.31Å; S151-P154 WeakPolarHBondContact O-CG 3.46Å; S151-W155 WeakPolarHBondContact O-CB 3.36Å
152F92.1Very high91.8Very high71 Ų7131.3 Ų31.331%0.31115%0.145SC..Hα-helixtrans-79-33.7-170.1-132.1-123.5000112.3F148 H149 W155 T156 Y245F148-F152 HydrophobicContact CE2-CB 4.33Å; F148-F152 HydrophobicContact CE2-CD1 4.16Å; F148-F152 HydrophobicContact CE2-CD2 4.29Å; F148-F152 HydrophobicContact CE2-CG 4.04Å; F148-F152 HydrophobicContact CZ-CB 4.41Å; F148-F152 AromaticContact CZ-CD1 3.95Å; F148-F152 HydrophobicContact CZ-CD1 3.95Å; F148-F152 HydrophobicContact CZ-CE1 4.39Å; F148-F152 HydrophobicContact CZ-CG 4.21Å; F148-F152 VanDerWaalsContact O-CB 3.25Å; F148-F152 WeakPolarHBondContact O-CB 3.42Å; F148-F152 PolarHBondContact O-N 2.93Å; H149-F152 PolarHBondContact O-N 3.26Å; F152-W155 HydrophobicContact CD2-CE3 4.46Å; F152-W155 HydrophobicContact CE1-CZ3 4.5Å; F152-W155 HydrophobicContact CE2-CE3 4.23Å; F152-W155 HydrophobicContact CE2-CZ3 4.44Å; F152-W155 HydrophobicContact CZ-CE3 4.29Å; F152-W155 HydrophobicContact CZ-CZ3 4.13Å; F152-W155 PolarHBondContact O-N 3.37Å; F152-T156 HydrophobicContact CD1-CG2 4.27Å; F152-T156 PolarHBondContact O-N 3.29Å; F152-T156 PolarHBondContact O-OG1 3.41Å; F152-T156 VanDerWaalsContact O-OG1 3.06Å; F152-Y245 AromaticContact CD1-CE2 3.72Å; F152-Y245 HydrophobicContact CD1-CE2 3.72Å; F152-Y245 AromaticContact CD1-CZ 3.8Å; F152-Y245 VanDerWaalsContact CD1-OH 3.32Å; F152-Y245 WeakPolarHBondContact CD1-OH 3.48Å; F152-Y245 HydrophobicContact CE1-CE2 4.19Å; F152-Y245 AromaticContact CE1-CZ 3.77Å; F152-Y245 WeakPolarHBondContact CE1-OH 3.41Å
153M92.7Very high91.1Very high20 Ų2033.7 Ų33.710%0.09916%0.158CC..Hα-helixtrans-59.4-57.9178.1-67.9-62.2-72.500112.7H149 W155 T156 W157 F249H149-M153 WeakPolarHBondContact O-CB 3.5Å; H149-M153 WeakPolarHBondContact O-CG 3.46Å; H149-M153 PolarHBondContact O-N 2.87Å; M153-W155 PolarHBondContact O-N 3.08Å; M153-T156 PolarHBondContact O-N 3.2Å; M153-T156 PolarHBondContact O-OG1 3.49Å; M153-T156 VanDerWaalsContact O-OG1 3.11Å; M153-W157 VanDerWaalsContact O-CB 3.27Å; M153-W157 WeakPolarHBondContact O-CB 3.05Å; M153-W157 PolarHBondContact O-N 3.24Å; M153-F249 HydrophobicContact CG-CZ 4.25Å; M153-F249 HydrophobicContact SD-CE2 3.58Å; M153-F249 VanDerWaalsContact SD-CE2 3.58Å; M153-F249 HydrophobicContact SD-CZ 3.88Å
154P94.1Very high90.3Very high1 Ų131.9 Ų31.91%0.00615%0.146CC..Hα-helixtrans-59.5-36.5176.620.6-31.1000112.5L40 Y120 K123 Y124 H150 S151 W157 W158L40-P154 HydrophobicContact CD1-CB 4.39Å; L40-P154 HydrophobicContact CD1-CG 4.15Å; L40-P154 HydrophobicContact CD2-CB 4.17Å; L40-P154 HydrophobicContact CD2-CG 3.51Å; L40-P154 HydrophobicContact CG-CG 4.48Å; Y120-P154 WeakPolarHBondContact CE2-O 3.39Å; K123-P154 HydrophobicContact CB-CB 3.84Å; K123-P154 HydrophobicContact CB-CG 4.38Å; Y124-P154 HydrophobicContact CD2-CB 4.34Å; Y124-P154 HydrophobicContact CE1-CB 4.21Å; Y124-P154 HydrophobicContact CE2-CB 3.73Å; H150-P154 WeakPolarHBondContact O-CD 3.07Å; H150-P154 WeakPolarHBondContact O-CG 3.3Å; S151-P154 WeakPolarHBondContact O-CG 3.46Å; P154-W157 PolarHBondContact O-N 2.84Å; P154-W158 PolarHBondContact O-N 3.49Å; P154-W158 VanDerWaalsContact O-N 3.15Å
155W94.1Very high88.8Confident85 Ų8525 Ų2532%0.32212%0.117SC..Hα-helixtrans-62.4-50.3178.6-177.579.3000112.5L40 S151 F152 M153 W157 W158 W159L40-W155 HydrophobicContact CD1-CB 3.66Å; L40-W155 HydrophobicContact CD1-CG 4.47Å; S151-W155 WeakPolarHBondContact O-CB 3.36Å; F152-W155 HydrophobicContact CD2-CE3 4.46Å; F152-W155 HydrophobicContact CE1-CZ3 4.5Å; F152-W155 HydrophobicContact CE2-CE3 4.23Å; F152-W155 HydrophobicContact CE2-CZ3 4.44Å; F152-W155 HydrophobicContact CZ-CE3 4.29Å; F152-W155 HydrophobicContact CZ-CZ3 4.13Å; F152-W155 PolarHBondContact O-N 3.37Å; M153-W155 PolarHBondContact O-N 3.08Å; W155-W157 VanDerWaalsContact C-N 3.34Å; W155-W158 PolarHBondContact O-N 3.48Å; W155-W159 AromaticContact CE2-NE1 3.49Å; W155-W159 AromaticContact CZ2-NE1 3.44Å; W155-W159 AromaticContact NE1-NE1 3.78Å; W155-W159 VanDerWaalsContact O-CD1 3.22Å
156T91.2Very high87.5Confident12 Ų1223.8 Ų23.87%0.07411%0.11CC..Hα-helixtrans-68.2-36.3177.851.30000112.4F152 M153 W158 W159 G160 W238 Y245F152-T156 HydrophobicContact CD1-CG2 4.27Å; F152-T156 PolarHBondContact O-N 3.29Å; F152-T156 PolarHBondContact O-OG1 3.41Å; F152-T156 VanDerWaalsContact O-OG1 3.06Å; M153-T156 PolarHBondContact O-N 3.2Å; M153-T156 PolarHBondContact O-OG1 3.49Å; M153-T156 VanDerWaalsContact O-OG1 3.11Å; T156-W158 PolarHBondContact O-N 3.32Å; T156-W159 PolarHBondContact O-N 3.4Å; T156-W159 VanDerWaalsContact O-N 3.08Å; T156-G160 PolarHBondContact O-N 3.34Å; T156-W238 WeakPolarHBondContact O-CH2 3.45Å; T156-Y245 HydrophobicContact CG2-CE2 3.48Å; T156-Y245 VanDerWaalsContact CG2-CE2 3.48Å; T156-Y245 WeakPolarHBondContact CG2-OH 3.41Å
157W91.6Very high86.4Confident10 Ų1022.8 Ų22.84%0.03811%0.107CC..Hα-helixtrans-59.9-35.6178.4-94.896.1000112.9F119 Y120 M153 P154 W155 W159 G160 I161 H173 S174F119-W157 AromaticContact CD1-CD2 3.93Å; F119-W157 HydrophobicContact CD1-CD2 3.93Å; F119-W157 AromaticContact CD1-CE2 3.75Å; F119-W157 HydrophobicContact CD1-CE3 4.11Å; F119-W157 HydrophobicContact CD1-CH2 4.18Å; F119-W157 AromaticContact CD1-CZ2 3.81Å; F119-W157 HydrophobicContact CD1-CZ2 3.81Å; F119-W157 HydrophobicContact CD1-CZ3 4.26Å; F119-W157 AromaticContact CE1-CD2 3.81Å; F119-W157 HydrophobicContact CE1-CD2 3.81Å; F119-W157 AromaticContact CE1-CE2 3.26Å; F119-W157 HydrophobicContact CE1-CE3 4.43Å; F119-W157 HydrophobicContact CE1-CG 4.33Å; F119-W157 HydrophobicContact CE1-CH2 4.29Å; F119-W157 AromaticContact CE1-CZ2 3.47Å; F119-W157 HydrophobicContact CE1-CZ2 3.47Å; F119-W157 VanDerWaalsContact CE1-CZ2 3.47Å; F119-W157 AromaticContact CE1-NE1 3.44Å; F119-W157 HydrophobicContact CZ-CZ2 4.31Å; Y120-W157 HydrophobicContact CD2-CB 3.8Å; M153-W157 VanDerWaalsContact O-CB 3.27Å; M153-W157 WeakPolarHBondContact O-CB 3.05Å; M153-W157 PolarHBondContact O-N 3.24Å; P154-W157 PolarHBondContact O-N 2.84Å; W155-W157 VanDerWaalsContact C-N 3.34Å; W157-W159 VanDerWaalsContact C-N 3.34Å; W157-W159 PolarHBondContact O-N 3.12Å; W157-G160 PolarHBondContact O-N 3.39Å; W157-I161 HydrophobicContact CE3-CG2 3.81Å; W157-I161 HydrophobicContact CZ3-CG2 3.89Å; W157-I161 VanDerWaalsContact O-CG1 3.27Å; W157-I161 WeakPolarHBondContact O-CG1 3.13Å; W157-I161 PolarHBondContact O-N 2.86Å; W157-H173 AromaticContact CE2-CE1 3.65Å; W157-H173 AromaticContact CH2-CE1 3.91Å; W157-H173 AromaticContact CH2-NE2 3.98Å; W157-H173 AromaticContact CZ2-CE1 3.07Å; W157-H173 WeakPolarHBondContact CZ2-CE1 3.33Å; W157-H173 AromaticContact CZ2-ND1 3.75Å; W157-H173 AromaticContact CZ2-NE2 3.59Å; W157-H173 AromaticContact NE1-CE1 3.83Å; W157-S174 WeakPolarHBondContact CH2-OG 3.32Å; W157-S174 WeakPolarHBondContact CZ2-OG 3.43Å
158W92Very high86Confident0 Ų021.9 Ų21.90%010%0.101CC..Hα-helixtrans-59.1-45.7173.6-171.587.9000111.7V16 L29 P33 M36 Y120 P154 W155 T156 I161 T162V16-W158 HydrophobicContact CG1-CH2 3.57Å; V16-W158 HydrophobicContact CG1-CZ3 3.85Å; L29-W158 PolarHBondContact O-NE1 3.16Å; P33-W158 HydrophobicContact CB-CD2 4.23Å; P33-W158 HydrophobicContact CB-CE3 3.95Å; P33-W158 HydrophobicContact CB-CH2 3.8Å; P33-W158 HydrophobicContact CB-CZ2 4.03Å; P33-W158 HydrophobicContact CB-CZ3 3.73Å; P33-W158 VanDerWaalsContact CD-CH2 3.45Å; P33-W158 HydrophobicContact CG-CH2 3.9Å; P33-W158 HydrophobicContact CG-CZ2 4.35Å; P33-W158 HydrophobicContact CG-CZ3 4.12Å; M36-W158 HydrophobicContact CE-CB 3.84Å; M36-W158 HydrophobicContact CE-CD2 3.79Å; M36-W158 HydrophobicContact CE-CE3 3.84Å; M36-W158 HydrophobicContact CE-CG 3.79Å; M36-W158 HydrophobicContact CG-CB 4.26Å; M36-W158 HydrophobicContact CG-CD2 4.24Å; M36-W158 HydrophobicContact CG-CG 3.79Å; M36-W158 HydrophobicContact SD-CB 3.74Å; M36-W158 HydrophobicContact SD-CD2 4.45Å; M36-W158 HydrophobicContact SD-CG 3.87Å; Y120-W158 HydrophobicContact CE2-CB 3.77Å; Y120-W158 HydrophobicContact CE2-CG 4.45Å; Y120-W158 AromaticContact CZ-CD1 3.65Å; Y120-W158 VanDerWaalsContact OH-CD1 3.27Å; P154-W158 PolarHBondContact O-N 3.49Å; P154-W158 VanDerWaalsContact O-N 3.15Å; W155-W158 PolarHBondContact O-N 3.48Å; T156-W158 PolarHBondContact O-N 3.32Å; W158-I161 WeakPolarHBondContact O-CG1 3.46Å; W158-T162 HydrophobicContact CH2-CG2 3.89Å; W158-T162 HydrophobicContact CZ2-CG2 4.48Å; W158-T162 HydrophobicContact CZ3-CG2 4.07Å; W158-T162 WeakPolarHBondContact O-CB 3.22Å; W158-T162 PolarHBondContact O-N 3.02Å; W158-T162 PolarHBondContact O-OG1 2.8Å
159W88.4Confident85.9Confident66 Ų6619.8 Ų19.825%0.259%0.092CC..Hα-helixtrans-66.5-40.2176.4-65.8105.4000112V16 P33 W155 T156 W157 T162 L163V16-W159 HydrophobicContact CB-CZ3 4.45Å; V16-W159 HydrophobicContact CG1-CH2 4.05Å; V16-W159 HydrophobicContact CG1-CZ3 3.78Å; V16-W159 HydrophobicContact CG2-CH2 3.85Å; V16-W159 HydrophobicContact CG2-CZ3 3.74Å; P33-W159 HydrophobicContact CB-CZ2 4.34Å; W155-W159 AromaticContact CE2-NE1 3.49Å; W155-W159 AromaticContact CZ2-NE1 3.44Å; W155-W159 AromaticContact NE1-NE1 3.78Å; W155-W159 VanDerWaalsContact O-CD1 3.22Å; T156-W159 PolarHBondContact O-N 3.4Å; T156-W159 VanDerWaalsContact O-N 3.08Å; W157-W159 VanDerWaalsContact C-N 3.34Å; W157-W159 PolarHBondContact O-N 3.12Å; W159-T162 PolarHBondContact O-N 3.13Å; W159-L163 HydrophobicContact CE3-CD1 4.13Å; W159-L163 VanDerWaalsContact O-CB 3.28Å; W159-L163 WeakPolarHBondContact O-CB 3.15Å; W159-L163 VanDerWaalsContact O-CG 3.29Å; W159-L163 WeakPolarHBondContact O-CG 3.06Å; W159-L163 PolarHBondContact O-N 3.4Å
160G87.1Confident85.8Confident1 Ų118.8 Ų18.81%0.019%0.088CC..Hα-helixtrans-57-60.1175.400000111.6T156 W157 T162 L163 T164T156-G160 PolarHBondContact O-N 3.34Å; W157-G160 PolarHBondContact O-N 3.39Å; G160-T162 VanDerWaalsContact C-N 3.27Å; G160-T162 PolarHBondContact O-N 3Å; G160-L163 PolarHBondContact O-N 3.15Å; G160-T164 CarbonylContact O-C 3.26Å; G160-T164 VanDerWaalsContact O-C 3.26Å; G160-T164 VanDerWaalsContact O-CA 3.24Å; G160-T164 WeakPolarHBondContact O-CA 3.34Å; G160-T164 PolarHBondContact O-N 3.3Å; G160-T164 PolarHBondContact O-OG1 2.91Å
161I87.2Confident85.6Confident3 Ų318.2 Ų18.22%0.0159%0.085CC..Hα-helixtrans-65.5-29.8-179.563.9-164.1000113L24 M30 Y120 W157 W158 P165L24-I161 HydrophobicContact CD1-CB 4.08Å; L24-I161 HydrophobicContact CD1-CG1 4.38Å; L24-I161 WeakPolarHBondContact CD1-O 3.41Å; M30-I161 HydrophobicContact CE-CD1 3.71Å; M30-I161 HydrophobicContact CE-CG1 3.55Å; M30-I161 HydrophobicContact SD-CD1 3.35Å; M30-I161 WeakPolarHBondContact SD-CD1 3.36Å; M30-I161 HydrophobicContact SD-CG1 3.94Å; Y120-I161 HydrophobicContact CD1-CD1 3.49Å; Y120-I161 VanDerWaalsContact CD1-CD1 3.49Å; Y120-I161 HydrophobicContact CD2-CD1 3.82Å; Y120-I161 HydrophobicContact CE1-CD1 4.07Å; Y120-I161 HydrophobicContact CE2-CD1 4.33Å; Y120-I161 HydrophobicContact CG-CD1 3.36Å; W157-I161 HydrophobicContact CE3-CG2 3.81Å; W157-I161 HydrophobicContact CZ3-CG2 3.89Å; W157-I161 VanDerWaalsContact O-CG1 3.27Å; W157-I161 WeakPolarHBondContact O-CG1 3.13Å; W157-I161 PolarHBondContact O-N 2.86Å; W158-I161 WeakPolarHBondContact O-CG1 3.46Å; I161-P165 WeakPolarHBondContact O-CA 3.27Å; I161-P165 WeakPolarHBondContact O-CB 3.07Å; I161-P165 WeakPolarHBondContact O-CD 3.27Å
162T83.9Confident85.7Confident1 Ų117.8 Ų17.81%0.0068%0.081CC..Hα-helixtrans-71.5-39.6179.6-62.80000112.2T20 M30 W158 W159 G160T20-T162 HydrophobicContact CG2-CG2 3.91Å; T20-T162 WeakPolarHBondContact OG1-CG2 3.31Å; M30-T162 VanDerWaalsContact CE-OG1 3.25Å; M30-T162 WeakPolarHBondContact CE-OG1 3.45Å; W158-T162 HydrophobicContact CH2-CG2 3.89Å; W158-T162 HydrophobicContact CZ2-CG2 4.48Å; W158-T162 HydrophobicContact CZ3-CG2 4.07Å; W158-T162 WeakPolarHBondContact O-CB 3.22Å; W158-T162 PolarHBondContact O-N 3.02Å; W158-T162 PolarHBondContact O-OG1 2.8Å; W159-T162 PolarHBondContact O-N 3.13Å; G160-T162 VanDerWaalsContact C-N 3.27Å; G160-T162 PolarHBondContact O-N 3Å
163L77.9Confident85.8Confident77 Ų7715.7 Ų15.740%0.4037%0.072SC..Hα-helixtrans-99.9-22.9-174.1-57.7175.7000112.9R19 W159 G160R19-L163 HydrophobicContact CB-CD2 4.3Å; W159-L163 HydrophobicContact CE3-CD1 4.13Å; W159-L163 VanDerWaalsContact O-CB 3.28Å; W159-L163 WeakPolarHBondContact O-CB 3.15Å; W159-L163 VanDerWaalsContact O-CG 3.29Å; W159-L163 WeakPolarHBondContact O-CG 3.06Å; W159-L163 PolarHBondContact O-N 3.4Å; G160-L163 PolarHBondContact O-N 3.15Å
164T76.3Confident85.9Confident4 Ų414.7 Ų14.73%0.0257%0.067CC..  trans-138.257.317956.90000112G160 V166 A167 V235 W238G160-T164 CarbonylContact O-C 3.26Å; G160-T164 VanDerWaalsContact O-C 3.26Å; G160-T164 VanDerWaalsContact O-CA 3.24Å; G160-T164 WeakPolarHBondContact O-CA 3.34Å; G160-T164 PolarHBondContact O-N 3.3Å; G160-T164 PolarHBondContact O-OG1 2.91Å; T164-V166 PolarHBondContact O-N 2.81Å; T164-A167 WeakPolarHBondContact O-CB 3.15Å; T164-A167 PolarHBondContact O-N 3.07Å; T164-A167 VanDerWaalsContact O-N 3.17Å; T164-V235 HydrophobicContact CG2-CB 3.51Å; T164-V235 HydrophobicContact CG2-CG1 3.71Å; T164-V235 HydrophobicContact CG2-CG2 3.52Å; T164-W238 HydrophobicContact CG2-CB 4.28Å; T164-W238 HydrophobicContact CG2-CG 4.32Å
165P59.9Low86Confident2 Ų215.1 Ų15.11%0.0137%0.069CC..THydrogen-bonded Turntrans-58.1-21.8-172.518.9-32.1000115.8D21 L24 F103 V113 I161D21-P165 HydrophobicContact CB-CB 4.15Å; D21-P165 HydrophobicContact CB-CG 3.59Å; D21-P165 WeakPolarHBondContact OD2-CG 3.41Å; L24-P165 HydrophobicContact CD1-CB 3.75Å; F103-P165 HydrophobicContact CE1-CG 4.33Å; V113-P165 HydrophobicContact CG2-CB 4.28Å; I161-P165 WeakPolarHBondContact O-CA 3.27Å; I161-P165 WeakPolarHBondContact O-CB 3.07Å; I161-P165 WeakPolarHBondContact O-CD 3.27Å
166V63.7Low86.2Confident1 Ų112.7 Ų12.71%0.0066%0.062CC..THydrogen-bonded Turntrans-128.165.1175.8-173.90000107.1C101 D102 M112 V113 T164 G168C101-V166 WeakPolarHBondContact CA-O 3.28Å; C101-V166 WeakPolarHBondContact CB-O 3.37Å; D102-V166 HydrophobicContact CB-CG1 3.89Å; D102-V166 VanDerWaalsContact O-CB 3.23Å; D102-V166 WeakPolarHBondContact O-CB 3.29Å; D102-V166 WeakPolarHBondContact O-CG2 3.36Å; M112-V166 HydrophobicContact CB-CG1 4.2Å; M112-V166 HydrophobicContact CG-CG1 3.97Å; V113-V166 HydrophobicContact CG2-CG2 3.33Å; T164-V166 PolarHBondContact O-N 2.81Å; V166-G168 PolarHBondContact O-N 2.91Å
167A69.4Low86.5Confident7 Ų712.4 Ų12.46%0.0586%0.06CC..  trans-66.319-164.800000115.8T164 M169 G170 N171 Y233T164-A167 WeakPolarHBondContact O-CB 3.15Å; T164-A167 PolarHBondContact O-N 3.07Å; T164-A167 VanDerWaalsContact O-N 3.17Å; A167-M169 PolarHBondContact O-N 3.23Å; A167-M169 VanDerWaalsContact O-N 3.1Å; A167-G170 WeakPolarHBondContact O-CA 3.44Å; A167-G170 PolarHBondContact O-N 3.32Å; A167-N171 HydrophobicContact CB-CB 4.22Å; A167-N171 PolarHBondContact O-N 3.41Å; A167-Y233 PolarHBondContact O-OH 3.22Å
168G87Confident86.8Confident0 Ų012 Ų120%06%0.058CC..G310 helixtrans45-121.4174.700000112.1Y94 D99 L100 V166 G170 N171Y94-G168 WeakPolarHBondContact CE2-O 3.45Å; D99-G168 CarbonylContact O-C 3.49Å; D99-G168 VanDerWaalsContact O-CA 3.26Å; D99-G168 WeakPolarHBondContact O-CA 3.3Å; L100-G168 WeakPolarHBondContact O-CA 3.2Å; V166-G168 PolarHBondContact O-N 2.91Å; G168-G170 PolarHBondContact O-N 3.42Å; G168-N171 VanDerWaalsContact O-CG 3.22Å; G168-N171 PolarHBondContact O-N 3.43Å; G168-N171 PolarHBondContact O-OD1 3.28Å
169M92.2Very high87.1Confident0 Ų013.2 Ų13.20%07%0.072CC..G310 helixtrans-60-28175.472.8178.4-61.200114.4R97 D99 A167 N171 F172 H221 I222 Y225 M228 Y233 I239R97-M169 WeakPolarHBondContact O-CB 3.41Å; D99-M169 HydrophobicContact CB-CB 4.35Å; D99-M169 PolarHBondContact O-N 2.78Å; A167-M169 PolarHBondContact O-N 3.23Å; A167-M169 VanDerWaalsContact O-N 3.1Å; M169-N171 VanDerWaalsContact C-N 3.31Å; M169-N171 PolarHBondContact O-N 2.65Å; M169-F172 VanDerWaalsContact O-CB 3.24Å; M169-F172 WeakPolarHBondContact O-CB 3.38Å; M169-F172 PolarHBondContact O-N 2.9Å; M169-H221 PolarHBondContact O-CE1 3Å; M169-H221 VanDerWaalsContact O-CE1 3.27Å; M169-I222 HydrophobicContact CE-CD1 4.33Å; M169-Y225 HydrophobicContact SD-CD2 4.29Å; M169-M228 HydrophobicContact CE-CE 4.28Å; M169-Y233 HydrophobicContact CG-CD2 3.93Å; M169-Y233 HydrophobicContact CG-CE2 3.91Å; M169-Y233 HydrophobicContact SD-CD2 4.26Å; M169-I239 HydrophobicContact CE-CD1 4.46Å; M169-I239 HydrophobicContact CG-CD1 3.8Å; M169-I239 HydrophobicContact SD-CD1 3.88Å
170G90.7Very high87.5Confident1 Ų110.6 Ų10.61%0.016%0.063CC..G310 helixtrans-71.7-10.7178.100000115.5A167 G168 H173 I242A167-G170 WeakPolarHBondContact O-CA 3.44Å; A167-G170 PolarHBondContact O-N 3.32Å; G168-G170 PolarHBondContact O-N 3.42Å; G170-H173 PolarHBondContact O-CD2 2.95Å; G170-H173 PolarHBondContact O-NE2 3.49Å; G170-I242 WeakPolarHBondContact O-CD1 3.38Å
171N92.4Very high88.1Confident1 Ų110.9 Ų10.91%0.0056%0.064CC..G310 helixtrans-96.52.1171.769.722.2000113.5F85 W90 M112 A167 G168 M169 H173 S174 M175F85-N171 HydrophobicContact CE1-CB 4.02Å; W90-N171 VanDerWaalsContact CE2-OD1 3.28Å; W90-N171 WeakPolarHBondContact CZ2-OD1 3.23Å; W90-N171 PolarHBondContact NE1-OD1 3.19Å; M112-N171 PolarHBondContact SD-ND2 3.4Å; A167-N171 HydrophobicContact CB-CB 4.22Å; A167-N171 PolarHBondContact O-N 3.41Å; G168-N171 VanDerWaalsContact O-CG 3.22Å; G168-N171 PolarHBondContact O-N 3.43Å; G168-N171 PolarHBondContact O-OD1 3.28Å; M169-N171 VanDerWaalsContact C-N 3.31Å; M169-N171 PolarHBondContact O-N 2.65Å; N171-H173 VanDerWaalsContact C-N 3.26Å; N171-H173 PolarHBondContact O-N 3.26Å; N171-S174 WeakPolarHBondContact O-CB 3.09Å; N171-S174 PolarHBondContact O-N 3.41Å; N171-S174 VanDerWaalsContact O-N 3.11Å; N171-S174 PolarHBondContact O-OG 3.44Å; N171-S174 VanDerWaalsContact O-OG 3.12Å; N171-M175 PolarHBondContact O-N 3.02Å
172F95.1Very high88.6Confident10 Ų1012.7 Ų12.74%0.0448%0.075CC..Hα-helixtrans-53.8-44.9176.3178.7-108.4000112W90 W96 M169 S174 M175 I176 M217 V218 H221W90-F172 HydrophobicContact CD2-CD2 4.38Å; W90-F172 HydrophobicContact CE3-CD2 4.06Å; W90-F172 HydrophobicContact CH2-CB 3.6Å; W90-F172 AromaticContact CH2-CD2 3.68Å; W90-F172 HydrophobicContact CH2-CD2 3.68Å; W90-F172 HydrophobicContact CH2-CG 4.05Å; W90-F172 VanDerWaalsContact CZ2-CA 3.44Å; W90-F172 HydrophobicContact CZ2-CB 3.47Å; W90-F172 VanDerWaalsContact CZ2-CB 3.47Å; W90-F172 HydrophobicContact CZ2-CD2 4.01Å; W90-F172 HydrophobicContact CZ2-CG 4.24Å; W90-F172 HydrophobicContact CZ3-CB 4.44Å; W90-F172 AromaticContact CZ3-CD2 3.65Å; W90-F172 HydrophobicContact CZ3-CD2 3.65Å; W90-F172 HydrophobicContact CZ3-CE2 4.41Å; W90-F172 HydrophobicContact CZ3-CG 4.45Å; W96-F172 HydrophobicContact CE3-CD2 4.45Å; W96-F172 AromaticContact CE3-CE2 3.88Å; W96-F172 HydrophobicContact CE3-CE2 3.88Å; W96-F172 HydrophobicContact CZ3-CD2 4.42Å; W96-F172 AromaticContact CZ3-CE2 3.71Å; W96-F172 HydrophobicContact CZ3-CE2 3.71Å; M169-F172 VanDerWaalsContact O-CB 3.24Å; M169-F172 WeakPolarHBondContact O-CB 3.38Å; M169-F172 PolarHBondContact O-N 2.9Å; F172-S174 PolarHBondContact O-N 3.08Å; F172-M175 HydrophobicContact CD2-CE 3.99Å; F172-M175 HydrophobicContact CE2-CE 4.03Å; F172-M175 PolarHBondContact O-N 2.96Å; F172-I176 HydrophobicContact CD1-CG1 4.17Å; F172-I176 HydrophobicContact CD2-CG1 4.36Å; F172-I176 HydrophobicContact CE1-CD1 4.45Å; F172-I176 HydrophobicContact CE1-CG1 3.68Å; F172-I176 HydrophobicContact CE2-CD1 3.95Å; F172-I176 HydrophobicContact CE2-CG1 3.89Å; F172-I176 HydrophobicContact CG-CG1 4.49Å; F172-I176 HydrophobicContact CZ-CD1 3.8Å; F172-I176 HydrophobicContact CZ-CG1 3.53Å; F172-I176 PolarHBondContact O-N 3.4Å; F172-I176 VanDerWaalsContact O-N 3.07Å; F172-M217 HydrophobicContact CE1-CG 3.99Å; F172-M217 HydrophobicContact CE1-SD 4.46Å; F172-M217 HydrophobicContact CZ-CG 3.91Å; F172-M217 HydrophobicContact CZ-SD 3.98Å; F172-V218 HydrophobicContact CD1-CG2 4.28Å; F172-V218 HydrophobicContact CE1-CG2 4.33Å; F172-H221 VanDerWaalsContact CB-CE1 3.48Å; F172-H221 WeakPolarHBondContact CB-CE1 3.27Å; F172-H221 HydrophobicContact CD1-CB 3.61Å; F172-H221 AromaticContact CD1-CG 3.44Å; F172-H221 VanDerWaalsContact CD1-CG 3.44Å; F172-H221 AromaticContact CD1-ND1 3.52Å; F172-H221 AromaticContact CD2-CD2 3.99Å; F172-H221 AromaticContact CD2-NE2 3.96Å; F172-H221 HydrophobicContact CE1-CB 3.53Å; F172-H221 AromaticContact CE1-CG 3.73Å; F172-H221 HydrophobicContact CG-CB 4.35Å; F172-H221 AromaticContact CG-CD2 3.93Å; F172-H221 AromaticContact CG-CE1 3.67Å; F172-H221 AromaticContact CG-CG 3.68Å; F172-H221 AromaticContact CG-ND1 3.52Å; F172-H221 AromaticContact CG-NE2 3.91Å; F172-H221 HydrophobicContact CZ-CB 4.22Å
173H94.8Very high89.3Confident27 Ų2715.9 Ų15.913%0.1259%0.091CC..Hα-helixtrans-65.1-26.9-177.474.595.8000113.2W157 G170 N171 N177 V218W157-H173 AromaticContact CE2-CE1 3.65Å; W157-H173 AromaticContact CH2-CE1 3.91Å; W157-H173 AromaticContact CH2-NE2 3.98Å; W157-H173 AromaticContact CZ2-CE1 3.07Å; W157-H173 WeakPolarHBondContact CZ2-CE1 3.33Å; W157-H173 AromaticContact CZ2-ND1 3.75Å; W157-H173 AromaticContact CZ2-NE2 3.59Å; W157-H173 AromaticContact NE1-CE1 3.83Å; G170-H173 PolarHBondContact O-CD2 2.95Å; G170-H173 PolarHBondContact O-NE2 3.49Å; N171-H173 VanDerWaalsContact C-N 3.26Å; N171-H173 PolarHBondContact O-N 3.26Å; H173-N177 WeakPolarHBondContact O-CB 3.29Å; H173-N177 PolarHBondContact O-N 2.9Å; H173-V218 HydrophobicContact CB-CB 4.22Å; H173-V218 HydrophobicContact CB-CG1 3.5Å; H173-V218 HydrophobicContact CB-CG2 3.6Å
174S95.1Very high90.2Very high0 Ų012.7 Ų12.70%08%0.075CC..Hα-helixtrans-68.2-45.8174.8-33.50000111.1F119 W157 N171 F172 N177 A178F119-S174 WeakPolarHBondContact CE2-O 2.95Å; W157-S174 WeakPolarHBondContact CH2-OG 3.32Å; W157-S174 WeakPolarHBondContact CZ2-OG 3.43Å; N171-S174 WeakPolarHBondContact O-CB 3.09Å; N171-S174 PolarHBondContact O-N 3.41Å; N171-S174 VanDerWaalsContact O-N 3.11Å; N171-S174 PolarHBondContact O-OG 3.44Å; N171-S174 VanDerWaalsContact O-OG 3.12Å; F172-S174 PolarHBondContact O-N 3.08Å; S174-N177 PolarHBondContact O-N 3.31Å; S174-A178 WeakPolarHBondContact O-CB 3.4Å; S174-A178 PolarHBondContact O-N 3.46Å
175M96.5Very high91.2Very high9 Ų912.5 Ų12.54%0.0447%0.073CC..Hα-helixtrans-61.9-49.7178.5-179.2-176.363.700110.4F85 L86 W90 W96 N171 F172 N177 A178 G179F85-M175 HydrophobicContact CB-CB 3.92Å; F85-M175 HydrophobicContact CB-CG 3.91Å; F85-M175 HydrophobicContact CB-SD 4.24Å; F85-M175 HydrophobicContact CD2-CB 4.22Å; F85-M175 HydrophobicContact CG-CB 4.07Å; L86-M175 HydrophobicContact CD2-SD 3.78Å; L86-M175 HydrophobicContact CG-SD 4.18Å; W90-M175 HydrophobicContact CB-CE 3.96Å; W90-M175 HydrophobicContact CB-SD 3.51Å; W90-M175 VanDerWaalsContact CB-SD 3.51Å; W90-M175 HydrophobicContact CD2-CE 3.87Å; W90-M175 HydrophobicContact CD2-SD 4.34Å; W90-M175 HydrophobicContact CE3-CE 4.26Å; W90-M175 HydrophobicContact CG-CE 3.69Å; W90-M175 HydrophobicContact CG-SD 3.53Å; W90-M175 VanDerWaalsContact CG-SD 3.53Å; W96-M175 HydrophobicContact CH2-CE 3.73Å; W96-M175 HydrophobicContact CZ3-CE 3.86Å; N171-M175 PolarHBondContact O-N 3.02Å; F172-M175 HydrophobicContact CD2-CE 3.99Å; F172-M175 HydrophobicContact CE2-CE 4.03Å; F172-M175 PolarHBondContact O-N 2.96Å; M175-N177 PolarHBondContact O-N 3.11Å; M175-A178 PolarHBondContact O-N 3.06Å; M175-G179 PolarHBondContact O-N 2.8Å
176I97.6Very high93Very high34 Ų3416.6 Ų16.617%0.1749%0.091CC..Hα-helixtrans-64.1-42.1178.1-56.7-56000110.7F172 A178 G179 V180 Q214 M217 V218F172-I176 HydrophobicContact CD1-CG1 4.17Å; F172-I176 HydrophobicContact CD2-CG1 4.36Å; F172-I176 HydrophobicContact CE1-CD1 4.45Å; F172-I176 HydrophobicContact CE1-CG1 3.68Å; F172-I176 HydrophobicContact CE2-CD1 3.95Å; F172-I176 HydrophobicContact CE2-CG1 3.89Å; F172-I176 HydrophobicContact CG-CG1 4.49Å; F172-I176 HydrophobicContact CZ-CD1 3.8Å; F172-I176 HydrophobicContact CZ-CG1 3.53Å; F172-I176 PolarHBondContact O-N 3.4Å; F172-I176 VanDerWaalsContact O-N 3.07Å; I176-A178 PolarHBondContact O-N 3.26Å; I176-G179 PolarHBondContact O-N 3.45Å; I176-V180 WeakPolarHBondContact O-CG2 3.3Å; I176-V180 PolarHBondContact O-N 3.04Å; I176-Q214 HydrophobicContact CG2-CB 3.99Å; I176-Q214 HydrophobicContact CG2-CG 3.74Å; I176-M217 HydrophobicContact CD1-SD 3.77Å; I176-M217 HydrophobicContact CG1-SD 4.07Å; I176-M217 HydrophobicContact CG2-SD 4.23Å; I176-V218 HydrophobicContact CB-CG2 4.47Å
177N97.6Very high94.5Very high7 Ų717.7 Ų17.74%0.03710%0.095CC..Hα-helixtrans-61.1-45.8177.5178.4-112.1000112.1F119 K123 H173 S174 M175 G179 V180 H181 Q214F119-N177 HydrophobicContact CE2-CB 4.25Å; F119-N177 WeakPolarHBondContact CE2-OD1 3.45Å; F119-N177 HydrophobicContact CZ-CB 4.21Å; F119-N177 VanDerWaalsContact CZ-OD1 3.3Å; F119-N177 WeakPolarHBondContact CZ-OD1 3.41Å; K123-N177 PolarHBondContact NZ-OD1 3.47Å; H173-N177 WeakPolarHBondContact O-CB 3.29Å; H173-N177 PolarHBondContact O-N 2.9Å; S174-N177 PolarHBondContact O-N 3.31Å; M175-N177 PolarHBondContact O-N 3.11Å; N177-G179 VanDerWaalsContact C-N 3.29Å; N177-G179 PolarHBondContact O-N 3.27Å; N177-V180 PolarHBondContact O-N 3.44Å; N177-H181 PolarHBondContact ND2-CD2 2.95Å; N177-H181 VanDerWaalsContact ND2-CD2 3.29Å; N177-H181 PolarHBondContact ND2-NE2 3.37Å; N177-H181 WeakPolarHBondContact O-CB 3.4Å; N177-H181 PolarHBondContact O-CD2 2.87Å; N177-H181 PolarHBondContact O-N 3.21Å; N177-Q214 PolarHBondContact ND2-NE2 2.96Å
178A97.9Very high95.7Very high0 Ų021 Ų210%011%0.107CC..Hα-helixtrans-59.7-42.6175.800000110.7I81 V82 F119 S174 M175 I176 V180 H181 V182I81-A178 HydrophobicContact CB-CB 4.24Å; I81-A178 HydrophobicContact CG2-CB 3.86Å; V82-A178 HydrophobicContact CG2-CB 3.64Å; F119-A178 HydrophobicContact CD2-CB 4.3Å; F119-A178 HydrophobicContact CE2-CB 4.27Å; S174-A178 WeakPolarHBondContact O-CB 3.4Å; S174-A178 PolarHBondContact O-N 3.46Å; M175-A178 PolarHBondContact O-N 3.06Å; I176-A178 PolarHBondContact O-N 3.26Å; A178-V180 PolarHBondContact O-N 3.46Å; A178-H181 PolarHBondContact O-N 2.82Å; A178-H181 VanDerWaalsContact O-N 3.13Å; A178-V182 WeakPolarHBondContact O-CG2 3.46Å; A178-V182 PolarHBondContact O-N 3.46Å
179G98.2Very high96Very high27 Ų2721 Ų2128%0.27811%0.107SC..Hα-helixtrans-59.5-44.3175.200000113.4V82 M175 I176 N177 H181 V182V82-G179 VanDerWaalsContact CG2-N 3.29Å; M175-G179 PolarHBondContact O-N 2.8Å; I176-G179 PolarHBondContact O-N 3.45Å; N177-G179 VanDerWaalsContact C-N 3.29Å; N177-G179 PolarHBondContact O-N 3.27Å; G179-H181 VanDerWaalsContact C-N 3.34Å; G179-V182 WeakPolarHBondContact O-CB 3.35Å; G179-V182 PolarHBondContact O-N 3.28Å
180V98.1Very high96.1Very high10 Ų1022.6 Ų22.66%0.06112%0.115CC..Hα-helixtrans-68.5-34.9174.3174.40000111.7I176 N177 A178 V182 I183 M184 V210 Q211 Q214I176-V180 WeakPolarHBondContact O-CG2 3.3Å; I176-V180 PolarHBondContact O-N 3.04Å; N177-V180 PolarHBondContact O-N 3.44Å; A178-V180 PolarHBondContact O-N 3.46Å; V180-V182 VanDerWaalsContact C-N 3.31Å; V180-V182 PolarHBondContact O-N 2.95Å; V180-I183 WeakPolarHBondContact O-CB 3.27Å; V180-I183 PolarHBondContact O-N 3.22Å; V180-I183 VanDerWaalsContact O-N 3.11Å; V180-M184 WeakPolarHBondContact O-CB 3.37Å; V180-M184 PolarHBondContact O-N 3.25Å; V180-V210 HydrophobicContact CB-CG1 4.5Å; V180-V210 HydrophobicContact CG1-CG1 4.14Å; V180-V210 HydrophobicContact CG2-CG1 3.75Å; V180-Q211 HydrophobicContact CG1-CG 3.74Å; V180-Q214 HydrophobicContact CG2-CB 3.94Å; V180-Q214 HydrophobicContact CG2-CG 4.43Å; V180-Q214 VanDerWaalsContact CG2-OE1 3.23Å
181H97.9Very high96.1Very high7 Ų724 Ų243%0.03212%0.124CC..Hα-helixtrans-65.9-31.8176.7-83.6-140.9000112.3N78 E126 N177 A178 G179 I183 M184 Y185N78-H181 HydrophobicContact CB-CB 4.24Å; N78-H181 WeakPolarHBondContact OD1-CB 3.26Å; E126-H181 IonicContact OE1-CE1 3.13Å; E126-H181 PolarHBondContact OE1-CE1 2.89Å; E126-H181 VanDerWaalsContact OE1-CE1 3.25Å; E126-H181 IonicContact OE1-ND1 3.24Å; E126-H181 PolarHBondContact OE1-ND1 3.38Å; E126-H181 IonicContact OE2-CE1 2.72Å; E126-H181 PolarHBondContact OE2-CE1 3.47Å; E126-H181 IonicContact OE2-ND1 3.25Å; N177-H181 PolarHBondContact ND2-CD2 2.95Å; N177-H181 VanDerWaalsContact ND2-CD2 3.29Å; N177-H181 PolarHBondContact ND2-NE2 3.37Å; N177-H181 WeakPolarHBondContact O-CB 3.4Å; N177-H181 PolarHBondContact O-CD2 2.87Å; N177-H181 PolarHBondContact O-N 3.21Å; A178-H181 PolarHBondContact O-N 2.82Å; A178-H181 VanDerWaalsContact O-N 3.13Å; G179-H181 VanDerWaalsContact C-N 3.34Å; H181-I183 VanDerWaalsContact C-N 3.32Å; H181-I183 PolarHBondContact O-N 3.46Å; H181-M184 PolarHBondContact O-N 3.37Å; H181-Y185 HydrophobicContact CB-CD2 4.06Å; H181-Y185 HydrophobicContact CB-CE2 4.2Å; H181-Y185 AromaticContact ND1-CE2 3.61Å; H181-Y185 WeakPolarHBondContact O-CB 3.13Å; H181-Y185 VanDerWaalsContact O-CD2 3.26Å; H181-Y185 WeakPolarHBondContact O-CD2 3.37Å; H181-Y185 PolarHBondContact O-N 3.49Å
182V98.4Very high96Very high41 Ų4124.5 Ų24.525%0.24813%0.128CC..Hα-helixtrans-54.8-49.9168.3173.60000110.2V75 N78 A178 G179 V180 F186V75-V182 HydrophobicContact CG1-CG1 4.1Å; N78-V182 HydrophobicContact CB-CG2 3.7Å; A178-V182 WeakPolarHBondContact O-CG2 3.46Å; A178-V182 PolarHBondContact O-N 3.46Å; G179-V182 WeakPolarHBondContact O-CB 3.35Å; G179-V182 PolarHBondContact O-N 3.28Å; V180-V182 VanDerWaalsContact C-N 3.31Å; V180-V182 PolarHBondContact O-N 2.95Å; V182-F186 WeakPolarHBondContact O-CB 2.75Å; V182-F186 PolarHBondContact O-N 2.92Å
183I97.9Very high95.7Very high68 Ų6825 Ų2535%0.34913%0.134SC..Hα-helixtrans-67.1-43.5-179-56170.7000110.9V180 H181 F186 Y187 W203 L207 V210V180-I183 WeakPolarHBondContact O-CB 3.27Å; V180-I183 PolarHBondContact O-N 3.22Å; V180-I183 VanDerWaalsContact O-N 3.11Å; H181-I183 VanDerWaalsContact C-N 3.32Å; H181-I183 PolarHBondContact O-N 3.46Å; I183-F186 PolarHBondContact O-N 2.95Å; I183-Y187 PolarHBondContact O-N 2.88Å; I183-W203 HydrophobicContact CG2-CH2 4.46Å; I183-W203 HydrophobicContact CG2-CZ3 4.06Å; I183-L207 HydrophobicContact CG2-CD1 3.96Å; I183-V210 HydrophobicContact CD1-CG1 4.21Å
184M96.9Very high95.2Very high11 Ų1124 Ų245%0.05413%0.131CC..Hα-helixtrans-64.7-50.2-178.6-172.4-172.773.900112.3V180 H181 F186 Y187 Y188 L207 Q211V180-M184 WeakPolarHBondContact O-CB 3.37Å; V180-M184 PolarHBondContact O-N 3.25Å; H181-M184 PolarHBondContact O-N 3.37Å; M184-F186 VanDerWaalsContact C-N 3.3Å; M184-F186 PolarHBondContact O-N 3.44Å; M184-Y187 WeakPolarHBondContact O-CB 3.36Å; M184-Y187 PolarHBondContact O-N 3.47Å; M184-Y188 HydrophobicContact CE-CD2 4.43Å; M184-Y188 HydrophobicContact CE-CE2 3.88Å; M184-Y188 HydrophobicContact CG-CD2 4.08Å; M184-Y188 HydrophobicContact CG-CE2 3.54Å; M184-Y188 PolarHBondContact O-N 3.27Å; M184-Y188 HydrophobicContact SD-CE2 3.79Å; M184-L207 HydrophobicContact CB-CD1 4Å; M184-L207 HydrophobicContact CG-CD1 4.41Å; M184-L207 HydrophobicContact CG-CD2 4.31Å; M184-Q211 PolarHBondContact SD-NE2 2.99Å
185Y97.9Very high94.8Very high0 Ų029 Ų290%016%0.164CC..Hα-helixtrans-69.6-30.2179.4-77.9-66000112Y70 N71 M74 E126 D129 H181 Y188 G189Y70-Y185 HydrophobicContact CE1-CE1 4.08Å; N71-Y185 WeakPolarHBondContact OD1-CD1 3.23Å; M74-Y185 HydrophobicContact CB-CD1 3.69Å; M74-Y185 HydrophobicContact CB-CD2 3.63Å; M74-Y185 HydrophobicContact CB-CE1 4.17Å; M74-Y185 HydrophobicContact CB-CE2 4.09Å; M74-Y185 HydrophobicContact CB-CG 3.44Å; M74-Y185 VanDerWaalsContact CB-CG 3.44Å; M74-Y185 HydrophobicContact CE-CD2 4.2Å; M74-Y185 HydrophobicContact CE-CE2 3.61Å; M74-Y185 HydrophobicContact CG-CD1 3.98Å; M74-Y185 HydrophobicContact CG-CD2 4.38Å; M74-Y185 HydrophobicContact CG-CE1 4.02Å; M74-Y185 HydrophobicContact CG-CE2 4.38Å; M74-Y185 HydrophobicContact CG-CG 4.21Å; E126-Y185 HydrophobicContact CG-CE2 4.35Å; E126-Y185 VanDerWaalsContact CG-OH 3.23Å; E126-Y185 WeakPolarHBondContact CG-OH 3.48Å; D129-Y185 PolarHBondContact OD2-OH 3.21Å; H181-Y185 HydrophobicContact CB-CD2 4.06Å; H181-Y185 HydrophobicContact CB-CE2 4.2Å; H181-Y185 AromaticContact ND1-CE2 3.61Å; H181-Y185 WeakPolarHBondContact O-CB 3.13Å; H181-Y185 VanDerWaalsContact O-CD2 3.26Å; H181-Y185 WeakPolarHBondContact O-CD2 3.37Å; H181-Y185 PolarHBondContact O-N 3.49Å; Y185-Y188 HydrophobicContact CD1-CD2 4.2Å; Y185-Y188 HydrophobicContact CE1-CD2 4.35Å; Y185-Y188 PolarHBondContact O-N 3.45Å; Y185-G189 PolarHBondContact O-N 3.46Å
186F96.8Very high94.3Very high87 Ų8737.9 Ų37.938%0.38220%0.197SC..Hα-helixtrans-62.7-45.8170.9-175-104.6000111.2F72 V75 V182 I183 M184 Y188 G189 L190F72-F186 AromaticContact CE1-CD2 3.88Å; F72-F186 HydrophobicContact CE1-CD2 3.88Å; F72-F186 AromaticContact CE1-CE2 3.97Å; F72-F186 HydrophobicContact CE1-CE2 3.97Å; V75-F186 HydrophobicContact CG2-CB 3.9Å; V75-F186 VanDerWaalsContact CG2-N 3.27Å; V182-F186 WeakPolarHBondContact O-CB 2.75Å; V182-F186 PolarHBondContact O-N 2.92Å; I183-F186 PolarHBondContact O-N 2.95Å; M184-F186 VanDerWaalsContact C-N 3.3Å; M184-F186 PolarHBondContact O-N 3.44Å; F186-Y188 PolarHBondContact O-N 2.94Å; F186-G189 PolarHBondContact O-N 2.78Å; F186-L190 HydrophobicContact CD1-CD1 3.99Å; F186-L190 HydrophobicContact CE1-CD1 3.48Å; F186-L190 VanDerWaalsContact CE1-CD1 3.48Å; F186-L190 HydrophobicContact CE1-CG 4.25Å; F186-L190 HydrophobicContact CZ-CD1 3.86Å; F186-L190 HydrophobicContact CZ-CG 4.3Å; F186-L190 WeakPolarHBondContact O-CG 3.43Å; F186-L190 PolarHBondContact O-N 2.99Å
187Y95.8Very high93.8Very high24 Ų2440.6 Ų40.69%0.09421%0.208CC..Hα-helixtrans-57.7-46.3172.3178.2-84.2000111.6I183 M184 L190 S191 L201 W203 K204 L207I183-Y187 PolarHBondContact O-N 2.88Å; M184-Y187 WeakPolarHBondContact O-CB 3.36Å; M184-Y187 PolarHBondContact O-N 3.47Å; Y187-L190 PolarHBondContact O-N 3.3Å; Y187-S191 WeakPolarHBondContact O-CB 3.5Å; Y187-S191 PolarHBondContact O-N 3.01Å; Y187-L201 HydrophobicContact CD2-CD1 4.49Å; Y187-L201 HydrophobicContact CD2-CD2 4.01Å; Y187-L201 HydrophobicContact CE2-CB 3.75Å; Y187-L201 HydrophobicContact CE2-CD1 4.1Å; Y187-L201 HydrophobicContact CE2-CD2 4.09Å; Y187-L201 HydrophobicContact CE2-CG 4.2Å; Y187-W203 HydrophobicContact CD2-CD2 4.29Å; Y187-W203 HydrophobicContact CD2-CE3 4.11Å; Y187-W203 AromaticContact CD2-CH2 3.71Å; Y187-W203 HydrophobicContact CD2-CH2 3.71Å; Y187-W203 AromaticContact CD2-CZ2 3.86Å; Y187-W203 HydrophobicContact CD2-CZ2 3.86Å; Y187-W203 AromaticContact CD2-CZ3 3.82Å; Y187-W203 HydrophobicContact CD2-CZ3 3.82Å; Y187-W203 HydrophobicContact CG-CH2 4.15Å; Y187-W203 HydrophobicContact CG-CZ3 4.37Å; Y187-K204 HydrophobicContact CE2-CB 3.89Å; Y187-K204 HydrophobicContact CE2-CG 4.3Å; Y187-K204 WeakPolarHBondContact OH-CB 3.49Å; Y187-K204 WeakPolarHBondContact OH-CG 3.4Å; Y187-L207 HydrophobicContact CD1-CD2 3.86Å; Y187-L207 HydrophobicContact CD2-CD2 4.35Å; Y187-L207 HydrophobicContact CG-CD2 3.81Å
188Y94.1Very high93.3Very high76 Ų7644 Ų4430%0.29822%0.223SC..Hα-helixtrans-66.4-37.5179.6-67.8-25.5000113.2N71 M184 Y185 F186 S191 S192N71-Y188 WeakPolarHBondContact OD1-CB 3.33Å; M184-Y188 HydrophobicContact CE-CD2 4.43Å; M184-Y188 HydrophobicContact CE-CE2 3.88Å; M184-Y188 HydrophobicContact CG-CD2 4.08Å; M184-Y188 HydrophobicContact CG-CE2 3.54Å; M184-Y188 PolarHBondContact O-N 3.27Å; M184-Y188 HydrophobicContact SD-CE2 3.79Å; Y185-Y188 HydrophobicContact CD1-CD2 4.2Å; Y185-Y188 HydrophobicContact CE1-CD2 4.35Å; Y185-Y188 PolarHBondContact O-N 3.45Å; F186-Y188 PolarHBondContact O-N 2.94Å; Y188-S191 WeakPolarHBondContact CA-OG 2.93Å; Y188-S191 PolarHBondContact O-N 3.25Å; Y188-S191 PolarHBondContact O-OG 3.17Å; Y188-S192 WeakPolarHBondContact O-CB 3.31Å; Y188-S192 PolarHBondContact O-N 3.07Å; Y188-S192 PolarHBondContact O-OG 2.99Å
189G94.6Very high92.7Very high0 Ų049 Ų490%025%0.245CC..Hα-helixtrans-60.1-50.3173.600000111.8N71 Y185 F186 S191 S192 A193N71-G189 VanDerWaalsContact CB-CA 3.48Å; Y185-G189 PolarHBondContact O-N 3.46Å; F186-G189 PolarHBondContact O-N 2.78Å; G189-S191 VanDerWaalsContact C-N 3.34Å; G189-S191 PolarHBondContact O-N 3.4Å; G189-S192 PolarHBondContact O-N 3.29Å; G189-S192 VanDerWaalsContact O-N 3.16Å; G189-A193 PolarHBondContact O-N 2.88Å
190L93.7Very high92.2Very high35 Ų3554.3 Ų54.318%0.18326%0.258CS..Hα-helixtrans-61.8-40.7174.9-68.3-179.9000112.2F186 Y187 S192 A193 F197 L201F186-L190 HydrophobicContact CD1-CD1 3.99Å; F186-L190 HydrophobicContact CE1-CD1 3.48Å; F186-L190 VanDerWaalsContact CE1-CD1 3.48Å; F186-L190 HydrophobicContact CE1-CG 4.25Å; F186-L190 HydrophobicContact CZ-CD1 3.86Å; F186-L190 HydrophobicContact CZ-CG 4.3Å; F186-L190 WeakPolarHBondContact O-CG 3.43Å; F186-L190 PolarHBondContact O-N 2.99Å; Y187-L190 PolarHBondContact O-N 3.3Å; L190-S192 PolarHBondContact O-N 3.13Å; L190-A193 PolarHBondContact O-N 3.14Å; L190-F197 HydrophobicContact CD2-CD1 4.34Å; L190-F197 WeakPolarHBondContact O-CB 3.24Å; L190-L201 HydrophobicContact CB-CD1 4.35Å; L190-L201 HydrophobicContact CB-CD2 3.95Å; L190-L201 HydrophobicContact CD1-CD2 4.03Å
191S90.6Very high91.9Very high29 Ų2954.3 Ų54.320%0.20326%0.257CS..Hα-helixtrans-64.6-30.7177.982.60000112.4Y187 Y188 G189 Q198Y187-S191 WeakPolarHBondContact O-CB 3.5Å; Y187-S191 PolarHBondContact O-N 3.01Å; Y188-S191 WeakPolarHBondContact CA-OG 2.93Å; Y188-S191 PolarHBondContact O-N 3.25Å; Y188-S191 PolarHBondContact O-OG 3.17Å; G189-S191 VanDerWaalsContact C-N 3.34Å; G189-S191 PolarHBondContact O-N 3.4Å; S191-Q198 PolarHBondContact O-NE2 2.95Å
192S90.2Very high91.5Very high12 Ų1262 Ų628%0.08429%0.286CS..Hα-helixtrans-81.7-24.8179-57.30000112.4K64 Y188 G189 L190 G194K64-S192 VanDerWaalsContact CE-O 3.22Å; K64-S192 WeakPolarHBondContact CE-O 3.4Å; K64-S192 WeakPolarHBondContact CG-O 3.36Å; Y188-S192 WeakPolarHBondContact O-CB 3.31Å; Y188-S192 PolarHBondContact O-N 3.07Å; Y188-S192 PolarHBondContact O-OG 2.99Å; G189-S192 PolarHBondContact O-N 3.29Å; G189-S192 VanDerWaalsContact O-N 3.16Å; L190-S192 PolarHBondContact O-N 3.13Å; S192-G194 PolarHBondContact O-N 3.01Å
193A89.5Confident91.1Very high21 Ų2162.8 Ų62.817%0.17429%0.285CS..THydrogen-bonded Turntrans-66.1-7.7177.600000114.1K64 V68 G189 L190 F197K64-A193 WeakPolarHBondContact CE-O 3.45Å; K64-A193 PolarHBondContact NZ-O 2.79Å; V68-A193 HydrophobicContact CG2-CB 4.27Å; G189-A193 PolarHBondContact O-N 2.88Å; L190-A193 PolarHBondContact O-N 3.14Å; A193-F197 HydrophobicContact CB-CB 4.41Å; A193-F197 HydrophobicContact CB-CD2 3.39Å; A193-F197 HydrophobicContact CB-CE2 3.82Å; A193-F197 HydrophobicContact CB-CG 4.03Å
194G84.7Confident90.6Very high6 Ų662 Ų626%0.06228%0.278CS..  trans110-176.8165.700000114.4S192 R196 F197 Q198S192-G194 PolarHBondContact O-N 3.01Å; G194-R196 PolarHBondContact O-N 2.77Å; G194-R196 VanDerWaalsContact O-N 3.11Å; G194-F197 PolarHBondContact O-N 3.38Å; G194-Q198 WeakPolarHBondContact O-CG 3.21Å; G194-Q198 PolarHBondContact O-N 3.01Å; G194-Q198 VanDerWaalsContact O-N 3.14Å
195P84.9Confident90.1Very high105 Ų10565.4 Ų65.468%0.68229%0.293SS*.Hα-helixtrans-57.5-31.2-172.3-26.835.4000114.1F197 Q198 K199P195-F197 PolarHBondContact O-N 2.67Å; P195-Q198 PolarHBondContact O-N 3.49Å; P195-K199 PolarHBondContact O-N 3.39Å
196R86.9Confident89.8Confident196 Ų19672.4 Ų72.474%0.7432%0.32SS*.Hα-helixtrans-56.7-34.4176.8-175.5176.3178171.10.2113G194 K199 Y200G194-R196 PolarHBondContact O-N 2.77Å; G194-R196 VanDerWaalsContact O-N 3.11Å; R196-K199 VanDerWaalsContact O-CE 3.3Å; R196-K199 WeakPolarHBondContact O-CE 3.35Å; R196-K199 WeakPolarHBondContact O-CG 2.98Å; R196-Y200 WeakPolarHBondContact O-CE2 3.08Å
197F87.1Confident89.5Confident91 Ų9168.5 Ų68.540%0.39930%0.304SS..Hα-helixtrans-97-33.2-179.9-66.2-80.9000112.4L190 A193 G194 P195 K199 Y200L190-F197 HydrophobicContact CD2-CD1 4.34Å; L190-F197 WeakPolarHBondContact O-CB 3.24Å; A193-F197 HydrophobicContact CB-CB 4.41Å; A193-F197 HydrophobicContact CB-CD2 3.39Å; A193-F197 HydrophobicContact CB-CE2 3.82Å; A193-F197 HydrophobicContact CB-CG 4.03Å; G194-F197 PolarHBondContact O-N 3.38Å; P195-F197 PolarHBondContact O-N 2.67Å; F197-K199 PolarHBondContact O-N 2.97Å; F197-K199 VanDerWaalsContact O-N 3.14Å; F197-Y200 PolarHBondContact O-N 3.01Å
198Q86.4Confident89.2Confident78 Ų7867.6 Ų67.636%0.36430%0.301SS..Hα-helixtrans-56.3-32.6-179.4-72.5174.58.500113.3S191 G194 P195 Y200 L201S191-Q198 PolarHBondContact O-NE2 2.95Å; G194-Q198 WeakPolarHBondContact O-CG 3.21Å; G194-Q198 PolarHBondContact O-N 3.01Å; G194-Q198 VanDerWaalsContact O-N 3.14Å; P195-Q198 PolarHBondContact O-N 3.49Å; Q198-Y200 PolarHBondContact O-N 3.12Å; Q198-L201 WeakPolarHBondContact O-CB 3.44Å; Q198-L201 PolarHBondContact O-N 3.41Å
199K85.4Confident89.1Confident104 Ų10465.3 Ų65.345%0.45230%0.297SS..THydrogen-bonded Turntrans-61.4-22176.769.8-176.9-173.81690114.2P195 R196 F197 H271P195-K199 PolarHBondContact O-N 3.39Å; R196-K199 VanDerWaalsContact O-CE 3.3Å; R196-K199 WeakPolarHBondContact O-CE 3.35Å; R196-K199 WeakPolarHBondContact O-CG 2.98Å; F197-K199 PolarHBondContact O-N 2.97Å; F197-K199 VanDerWaalsContact O-N 3.14Å; K199-H271 PolarHBondContact O-CE1 3Å; K199-H271 PolarHBondContact O-NE2 3.17Å
200Y88.3Confident89.2Confident140 Ų14067.6 Ų67.655%0.54931%0.311SS..THydrogen-bonded Turntrans-93.3-1.5178-58.1-73.1000113R196 F197 Q198 W202R196-Y200 WeakPolarHBondContact O-CE2 3.08Å; F197-Y200 PolarHBondContact O-N 3.01Å; Q198-Y200 PolarHBondContact O-N 3.12Å; Y200-W202 PolarHBondContact O-N 3.29Å; Y200-W202 VanDerWaalsContact O-N 3.15Å
201L91.1Very high89.2Confident10 Ų1066.9 Ų66.95%0.05231%0.307CS..  trans-8941.5-176.1-61.5-178.4000113.1Y187 L190 Q198 W203Y187-L201 HydrophobicContact CD2-CD1 4.49Å; Y187-L201 HydrophobicContact CD2-CD2 4.01Å; Y187-L201 HydrophobicContact CE2-CB 3.75Å; Y187-L201 HydrophobicContact CE2-CD1 4.1Å; Y187-L201 HydrophobicContact CE2-CD2 4.09Å; Y187-L201 HydrophobicContact CE2-CG 4.2Å; L190-L201 HydrophobicContact CB-CD1 4.35Å; L190-L201 HydrophobicContact CB-CD2 3.95Å; L190-L201 HydrophobicContact CD1-CD2 4.03Å; Q198-L201 WeakPolarHBondContact O-CB 3.44Å; Q198-L201 PolarHBondContact O-N 3.41Å; L201-W203 HydrophobicContact CD2-CZ2 4.15Å; L201-W203 PolarHBondContact O-N 3.11Å
202W89.9Confident89.3Confident169 Ų16966.7 Ų66.764%0.6430%0.304SS*.THydrogen-bonded Turntrans-62.3-23.817758.6-94.2000112.5Y200 K204 Y206Y200-W202 PolarHBondContact O-N 3.29Å; Y200-W202 VanDerWaalsContact O-N 3.15Å; W202-K204 VanDerWaalsContact C-N 3.27Å; W202-K204 PolarHBondContact O-N 3.25Å; W202-Y206 HydrophobicContact CE3-CE2 4.14Å; W202-Y206 HydrophobicContact CZ3-CD2 4.15Å; W202-Y206 AromaticContact CZ3-CE2 3.59Å; W202-Y206 HydrophobicContact CZ3-CE2 3.59Å
203W90.3Very high89.6Confident57 Ų5770.8 Ų70.822%0.21632%0.323CS..THydrogen-bonded Turntrans-84.713.3-174.257-89.2000115I183 Y187 L201 K205 Y206 L207I183-W203 HydrophobicContact CG2-CH2 4.46Å; I183-W203 HydrophobicContact CG2-CZ3 4.06Å; Y187-W203 HydrophobicContact CD2-CD2 4.29Å; Y187-W203 HydrophobicContact CD2-CE3 4.11Å; Y187-W203 AromaticContact CD2-CH2 3.71Å; Y187-W203 HydrophobicContact CD2-CH2 3.71Å; Y187-W203 AromaticContact CD2-CZ2 3.86Å; Y187-W203 HydrophobicContact CD2-CZ2 3.86Å; Y187-W203 AromaticContact CD2-CZ3 3.82Å; Y187-W203 HydrophobicContact CD2-CZ3 3.82Å; Y187-W203 HydrophobicContact CG-CH2 4.15Å; Y187-W203 HydrophobicContact CG-CZ3 4.37Å; L201-W203 HydrophobicContact CD2-CZ2 4.15Å; L201-W203 PolarHBondContact O-N 3.11Å; W203-K205 PolarHBondContact O-N 2.88Å; W203-K205 VanDerWaalsContact O-N 3.09Å; W203-Y206 HydrophobicContact CB-CD2 3.85Å; W203-Y206 WeakPolarHBondContact O-CB 3.41Å; W203-Y206 PolarHBondContact O-N 3.07Å; W203-L207 HydrophobicContact CE3-CB 4.48Å; W203-L207 HydrophobicContact CZ3-CB 4.37Å; W203-L207 PolarHBondContact O-N 3.18Å
204K87.8Confident89.9Confident50 Ų5070.5 Ų70.522%0.21732%0.319CS..Hα-helixtrans-48.6-38.3175.1-175.2-173.7177.3-172.10113.3Y187 W202 L207 T208 Y261 R266 P268Y187-K204 HydrophobicContact CE2-CB 3.89Å; Y187-K204 HydrophobicContact CE2-CG 4.3Å; Y187-K204 WeakPolarHBondContact OH-CB 3.49Å; Y187-K204 WeakPolarHBondContact OH-CG 3.4Å; W202-K204 VanDerWaalsContact C-N 3.27Å; W202-K204 PolarHBondContact O-N 3.25Å; K204-L207 WeakPolarHBondContact O-CB 3.44Å; K204-L207 PolarHBondContact O-N 3.39Å; K204-T208 PolarHBondContact O-N 2.89Å; K204-Y261 PolarHBondContact O-OH 3.43Å; K204-R266 PolarHBondContact NZ-O 3.42Å; K204-P268 HydrophobicContact CB-CB 4.33Å; K204-P268 HydrophobicContact CD-CB 4.37Å
205K86.9Confident90.3Very high84 Ų8471 Ų7137%0.36532%0.319SS..Hα-helixtrans-64.1-41177.5-67-173.5176.8-178.10111.7W203 L207 T208 A209 W257 Y261W203-K205 PolarHBondContact O-N 2.88Å; W203-K205 VanDerWaalsContact O-N 3.09Å; K205-L207 VanDerWaalsContact C-N 3.28Å; K205-L207 PolarHBondContact O-N 2.91Å; K205-T208 PolarHBondContact O-N 3.17Å; K205-A209 PolarHBondContact O-N 2.77Å; K205-W257 HydrophobicContact CB-CH2 4.41Å; K205-W257 WeakPolarHBondContact O-CZ3 3.25Å; K205-Y261 HydrophobicContact CD-CD1 4.27Å; K205-Y261 HydrophobicContact CG-CD1 3.73Å; K205-Y261 HydrophobicContact CG-CE1 3.72Å; K205-Y261 HydrophobicContact CG-CG 4.23Å
206Y91.6Very high90.8Very high146 Ų14670.1 Ų70.157%0.57331%0.307SS*.Hα-helixtrans-66.9-30.5178.3-60.4-83.4000112.1W202 W203 T208 A209 V210W202-Y206 HydrophobicContact CE3-CE2 4.14Å; W202-Y206 HydrophobicContact CZ3-CD2 4.15Å; W202-Y206 AromaticContact CZ3-CE2 3.59Å; W202-Y206 HydrophobicContact CZ3-CE2 3.59Å; W203-Y206 HydrophobicContact CB-CD2 3.85Å; W203-Y206 WeakPolarHBondContact O-CB 3.41Å; W203-Y206 PolarHBondContact O-N 3.07Å; Y206-T208 PolarHBondContact O-N 3.16Å; Y206-A209 WeakPolarHBondContact O-CB 3.24Å; Y206-A209 PolarHBondContact O-N 3.23Å; Y206-A209 VanDerWaalsContact O-N 3.16Å; Y206-V210 WeakPolarHBondContact O-CG2 3.39Å; Y206-V210 PolarHBondContact O-N 2.71Å
207L90.7Very high91.2Very high6 Ų664.9 Ų64.93%0.03129%0.292CS..Hα-helixtrans-58.5-49172.1177.965.7000111.4I183 M184 Y187 W203 K204 K205 A209 V210 Q211I183-L207 HydrophobicContact CG2-CD1 3.96Å; M184-L207 HydrophobicContact CB-CD1 4Å; M184-L207 HydrophobicContact CG-CD1 4.41Å; M184-L207 HydrophobicContact CG-CD2 4.31Å; Y187-L207 HydrophobicContact CD1-CD2 3.86Å; Y187-L207 HydrophobicContact CD2-CD2 4.35Å; Y187-L207 HydrophobicContact CG-CD2 3.81Å; W203-L207 HydrophobicContact CE3-CB 4.48Å; W203-L207 HydrophobicContact CZ3-CB 4.37Å; W203-L207 PolarHBondContact O-N 3.18Å; K204-L207 WeakPolarHBondContact O-CB 3.44Å; K204-L207 PolarHBondContact O-N 3.39Å; K205-L207 VanDerWaalsContact C-N 3.28Å; K205-L207 PolarHBondContact O-N 2.91Å; L207-A209 VanDerWaalsContact C-N 3.27Å; L207-A209 PolarHBondContact O-N 3.34Å; L207-V210 PolarHBondContact O-N 3.49Å; L207-Q211 WeakPolarHBondContact O-CG 3.4Å; L207-Q211 PolarHBondContact O-N 2.87Å; L207-Q211 VanDerWaalsContact O-N 3.12Å
208T89.4Confident91.6Very high5 Ų560.9 Ų60.93%0.03128%0.276CS..Hα-helixtrans-66.8-30.9177-46.90000111.9K204 K205 Y206 Q211 L212 F253 F256 W257 Y261K204-T208 PolarHBondContact O-N 2.89Å; K205-T208 PolarHBondContact O-N 3.17Å; Y206-T208 PolarHBondContact O-N 3.16Å; T208-Q211 PolarHBondContact O-N 3.37Å; T208-L212 PolarHBondContact O-N 3.05Å; T208-F253 HydrophobicContact CG2-CD1 4.44Å; T208-F256 HydrophobicContact CG2-CD1 3.99Å; T208-F256 HydrophobicContact CG2-CE1 4.11Å; T208-W257 HydrophobicContact CG2-CE3 3.71Å; T208-W257 HydrophobicContact CG2-CZ3 4.26Å; T208-Y261 HydrophobicContact CG2-CE2 4.07Å; T208-Y261 PolarHBondContact OG1-OH 3.05Å
209A91.9Very high92Very high27 Ų2758.1 Ų58.122%0.22327%0.265CS..Hα-helixtrans-66.3-43.2175.700000111.3K205 Y206 L207 Q211 L212 I213 W257K205-A209 PolarHBondContact O-N 2.77Å; Y206-A209 WeakPolarHBondContact O-CB 3.24Å; Y206-A209 PolarHBondContact O-N 3.23Å; Y206-A209 VanDerWaalsContact O-N 3.16Å; L207-A209 VanDerWaalsContact C-N 3.27Å; L207-A209 PolarHBondContact O-N 3.34Å; A209-Q211 VanDerWaalsContact C-N 3.31Å; A209-Q211 PolarHBondContact O-N 3.26Å; A209-L212 PolarHBondContact O-N 2.97Å; A209-I213 VanDerWaalsContact O-CG1 3.31Å; A209-I213 WeakPolarHBondContact O-CG1 3.35Å; A209-I213 PolarHBondContact O-N 3.34Å; A209-W257 HydrophobicContact CB-CH2 4.11Å; A209-W257 HydrophobicContact CB-CZ3 3.95Å
210V95.5Very high92.4Very high49 Ų4957.7 Ų57.730%0.29727%0.271SS..Hα-helixtrans-60.8-40.5174.81700000111.3V180 I183 Y206 L207 L212 I213 Q214V180-V210 HydrophobicContact CB-CG1 4.5Å; V180-V210 HydrophobicContact CG1-CG1 4.14Å; V180-V210 HydrophobicContact CG2-CG1 3.75Å; I183-V210 HydrophobicContact CD1-CG1 4.21Å; Y206-V210 WeakPolarHBondContact O-CG2 3.39Å; Y206-V210 PolarHBondContact O-N 2.71Å; L207-V210 PolarHBondContact O-N 3.49Å; V210-L212 PolarHBondContact O-N 3.35Å; V210-I213 PolarHBondContact O-N 2.88Å; V210-Q214 PolarHBondContact O-N 3.49Å
211Q93.6Very high92.8Very high20 Ų2051.5 Ų51.59%0.09325%0.247CC..Hα-helixtrans-62.4-40.6174.5-68.7173.8-50.100112.4V180 M184 L207 T208 A209 Q214 F215 F253V180-Q211 HydrophobicContact CG1-CG 3.74Å; M184-Q211 PolarHBondContact SD-NE2 2.99Å; L207-Q211 WeakPolarHBondContact O-CG 3.4Å; L207-Q211 PolarHBondContact O-N 2.87Å; L207-Q211 VanDerWaalsContact O-N 3.12Å; T208-Q211 PolarHBondContact O-N 3.37Å; A209-Q211 VanDerWaalsContact C-N 3.31Å; A209-Q211 PolarHBondContact O-N 3.26Å; Q211-Q214 WeakPolarHBondContact O-CB 3.38Å; Q211-Q214 PolarHBondContact O-N 3.12Å; Q211-F215 WeakPolarHBondContact O-CD2 3.1Å; Q211-F215 WeakPolarHBondContact O-CE2 3.35Å; Q211-F215 PolarHBondContact O-N 3.35Å; Q211-F253 HydrophobicContact CB-CD1 4.23Å; Q211-F253 HydrophobicContact CB-CE1 4.14Å; Q211-F253 HydrophobicContact CG-CE1 4.47Å
212L93.3Very high92.9Very high25 Ų2551.1 Ų51.113%0.13125%0.245CC..Hα-helixtrans-66.2-42.9175.1-74.9168.8000112.2T208 A209 V210 Q214 F215 I216 F250 F253 A254 W257T208-L212 PolarHBondContact O-N 3.05Å; A209-L212 PolarHBondContact O-N 2.97Å; V210-L212 PolarHBondContact O-N 3.35Å; L212-Q214 VanDerWaalsContact C-N 3.29Å; L212-Q214 PolarHBondContact O-N 3.3Å; L212-F215 PolarHBondContact O-N 2.8Å; L212-I216 PolarHBondContact O-N 3.5Å; L212-I216 VanDerWaalsContact O-N 3.16Å; L212-F250 HydrophobicContact CD2-CD2 4.05Å; L212-F250 HydrophobicContact CD2-CE2 4.1Å; L212-F253 HydrophobicContact CD2-CB 3.62Å; L212-F253 HydrophobicContact CG-CB 4.37Å; L212-A254 HydrophobicContact CD2-CB 4.49Å; L212-W257 HydrophobicContact CD1-CB 4.41Å; L212-W257 HydrophobicContact CD1-CD2 4.28Å; L212-W257 HydrophobicContact CD1-CE3 3.9Å
213I95.6Very high93.1Very high97 Ų9744.2 Ų44.250%0.49722%0.222SC..Hα-helixtrans-61.4-38.7176.1-69165.3000110.7A209 V210 F215 I216 M217A209-I213 VanDerWaalsContact O-CG1 3.31Å; A209-I213 WeakPolarHBondContact O-CG1 3.35Å; A209-I213 PolarHBondContact O-N 3.34Å; V210-I213 PolarHBondContact O-N 2.88Å; I213-F215 VanDerWaalsContact C-N 3.35Å; I213-F215 PolarHBondContact O-N 2.89Å; I213-I216 PolarHBondContact O-N 3.44Å; I213-M217 WeakPolarHBondContact O-CB 3.41Å; I213-M217 PolarHBondContact O-N 2.95Å
214Q96.4Very high93.3Very high16 Ų1644.2 Ų44.28%0.07523%0.225CC..Hα-helixtrans-54.8-49.3172.9160.2-167.4-33.700111.3I176 N177 V180 V210 Q211 L212 I216 M217 V218I176-Q214 HydrophobicContact CG2-CB 3.99Å; I176-Q214 HydrophobicContact CG2-CG 3.74Å; N177-Q214 PolarHBondContact ND2-NE2 2.96Å; V180-Q214 HydrophobicContact CG2-CB 3.94Å; V180-Q214 HydrophobicContact CG2-CG 4.43Å; V180-Q214 VanDerWaalsContact CG2-OE1 3.23Å; V210-Q214 PolarHBondContact O-N 3.49Å; Q211-Q214 WeakPolarHBondContact O-CB 3.38Å; Q211-Q214 PolarHBondContact O-N 3.12Å; L212-Q214 VanDerWaalsContact C-N 3.29Å; L212-Q214 PolarHBondContact O-N 3.3Å; Q214-I216 VanDerWaalsContact C-N 3.3Å; Q214-I216 PolarHBondContact O-N 3.46Å; Q214-M217 PolarHBondContact O-N 3.29Å; Q214-V218 HydrophobicContact CG-CG2 4.39Å; Q214-V218 WeakPolarHBondContact O-CB 3.36Å; Q214-V218 VanDerWaalsContact O-CG2 3.32Å; Q214-V218 WeakPolarHBondContact O-CG2 3.5Å; Q214-V218 PolarHBondContact O-N 3.44Å
215F93.6Very high93.6Very high17 Ų1744.2 Ų44.28%0.07522%0.224CC..Hα-helixtrans-63.5-38.7-178.8-63.4-57.5000111.7Q211 L212 I213 S219 F249 F250 F253Q211-F215 WeakPolarHBondContact O-CD2 3.1Å; Q211-F215 WeakPolarHBondContact O-CE2 3.35Å; Q211-F215 PolarHBondContact O-N 3.35Å; L212-F215 PolarHBondContact O-N 2.8Å; I213-F215 VanDerWaalsContact C-N 3.35Å; I213-F215 PolarHBondContact O-N 2.89Å; F215-S219 VanDerWaalsContact O-CB 3.3Å; F215-S219 WeakPolarHBondContact O-CB 3.14Å; F215-S219 PolarHBondContact O-N 2.97Å; F215-S219 PolarHBondContact O-OG 3.33Å; F215-F249 HydrophobicContact CD1-CB 3.92Å; F215-F249 HydrophobicContact CE1-CB 3.45Å; F215-F249 VanDerWaalsContact CE1-CB 3.45Å; F215-F249 HydrophobicContact CE1-CD2 4.49Å; F215-F249 HydrophobicContact CE1-CG 4.15Å; F215-F249 HydrophobicContact CE2-CB 4.16Å; F215-F249 HydrophobicContact CG-CB 4.46Å; F215-F249 HydrophobicContact CZ-CB 3.6Å; F215-F249 HydrophobicContact CZ-CG 4.31Å; F215-F250 HydrophobicContact CB-CB 4.06Å; F215-F250 HydrophobicContact CB-CD2 4.22Å; F215-F253 HydrophobicContact CE2-CB 4.17Å; F215-F253 HydrophobicContact CE2-CD1 4.27Å; F215-F253 AromaticContact CE2-CD2 3.54Å; F215-F253 HydrophobicContact CE2-CD2 3.54Å; F215-F253 AromaticContact CE2-CE2 3.92Å; F215-F253 HydrophobicContact CE2-CE2 3.92Å; F215-F253 AromaticContact CE2-CG 3.73Å; F215-F253 HydrophobicContact CE2-CG 3.73Å; F215-F253 HydrophobicContact CE2-CZ 4.43Å; F215-F253 AromaticContact CZ-CD2 3.94Å; F215-F253 HydrophobicContact CZ-CD2 3.94Å; F215-F253 AromaticContact CZ-CE2 3.91Å; F215-F253 HydrophobicContact CZ-CE2 3.91Å; F215-F253 HydrophobicContact CZ-CZ 4.49Å
216I94.8Very high93.9Very high85 Ų8545.6 Ų45.644%0.43623%0.227SC..Hα-helixtrans-61.6-50.2174.1-64.3168000110.4L212 I213 Q214 V218 S219 V220 F250L212-I216 PolarHBondContact O-N 3.5Å; L212-I216 VanDerWaalsContact O-N 3.16Å; I213-I216 PolarHBondContact O-N 3.44Å; Q214-I216 VanDerWaalsContact C-N 3.3Å; Q214-I216 PolarHBondContact O-N 3.46Å; I216-V218 VanDerWaalsContact C-N 3.35Å; I216-V218 PolarHBondContact O-N 3.48Å; I216-S219 PolarHBondContact O-N 3.05Å; I216-V220 HydrophobicContact CG2-CG2 4.25Å; I216-V220 WeakPolarHBondContact O-CB 3.43Å; I216-V220 VanDerWaalsContact O-CG2 3.3Å; I216-V220 WeakPolarHBondContact O-CG2 3.45Å; I216-V220 PolarHBondContact O-N 3.44Å; I216-F250 HydrophobicContact CD1-CE2 3.93Å; I216-F250 HydrophobicContact CG1-CD2 4.11Å; I216-F250 HydrophobicContact CG1-CE2 3.76Å
217M95.8Very high94Very high86 Ų8646.8 Ų46.842%0.42424%0.236SC..Hα-helixtrans-59.9-45-178.6-173.2-174.9-67.800111.7F172 I176 I213 Q214 V220 H221F172-M217 HydrophobicContact CE1-CG 3.99Å; F172-M217 HydrophobicContact CE1-SD 4.46Å; F172-M217 HydrophobicContact CZ-CG 3.91Å; F172-M217 HydrophobicContact CZ-SD 3.98Å; I176-M217 HydrophobicContact CD1-SD 3.77Å; I176-M217 HydrophobicContact CG1-SD 4.07Å; I176-M217 HydrophobicContact CG2-SD 4.23Å; I213-M217 WeakPolarHBondContact O-CB 3.41Å; I213-M217 PolarHBondContact O-N 2.95Å; Q214-M217 PolarHBondContact O-N 3.29Å; M217-V220 PolarHBondContact O-N 2.89Å; M217-H221 VanDerWaalsContact O-CB 3.32Å; M217-H221 WeakPolarHBondContact O-CB 3.32Å; M217-H221 PolarHBondContact O-N 3.01Å
218V95.3Very high94.1Very high8 Ų848.9 Ų48.95%0.04825%0.246CC..Hα-helixtrans-63.1-45.9176.4167.80000111.4F172 H173 I176 Q214 I216 H221 I222 I242F172-V218 HydrophobicContact CD1-CG2 4.28Å; F172-V218 HydrophobicContact CE1-CG2 4.33Å; H173-V218 HydrophobicContact CB-CB 4.22Å; H173-V218 HydrophobicContact CB-CG1 3.5Å; H173-V218 HydrophobicContact CB-CG2 3.6Å; I176-V218 HydrophobicContact CB-CG2 4.47Å; Q214-V218 HydrophobicContact CG-CG2 4.39Å; Q214-V218 WeakPolarHBondContact O-CB 3.36Å; Q214-V218 VanDerWaalsContact O-CG2 3.32Å; Q214-V218 WeakPolarHBondContact O-CG2 3.5Å; Q214-V218 PolarHBondContact O-N 3.44Å; I216-V218 VanDerWaalsContact C-N 3.35Å; I216-V218 PolarHBondContact O-N 3.48Å; V218-H221 PolarHBondContact O-N 3.27Å; V218-I222 WeakPolarHBondContact O-CB 3.49Å; V218-I222 PolarHBondContact O-N 3.05Å; V218-I242 HydrophobicContact CG1-CG2 4.02Å
219S94.1Very high94Very high20 Ų2058.1 Ų58.114%0.1429%0.286CS..Hα-helixtrans-65-40.4179.2-68.60000112.1F215 I216 S223F215-S219 VanDerWaalsContact O-CB 3.3Å; F215-S219 WeakPolarHBondContact O-CB 3.14Å; F215-S219 PolarHBondContact O-N 2.97Å; F215-S219 PolarHBondContact O-OG 3.33Å; I216-S219 PolarHBondContact O-N 3.05Å; S219-S223 VanDerWaalsContact O-CB 3.25Å; S219-S223 WeakPolarHBondContact O-CB 3.13Å; S219-S223 PolarHBondContact O-N 3.17Å; S219-S223 PolarHBondContact O-OG 2.93Å
220V94.9Very high93.9Very high95 Ų9564.1 Ų64.158%0.57631%0.314SS*.Hα-helixtrans-64.6-48.6176.1169.80000110.4I216 M217 I222 S223 Q224I216-V220 HydrophobicContact CG2-CG2 4.25Å; I216-V220 WeakPolarHBondContact O-CB 3.43Å; I216-V220 VanDerWaalsContact O-CG2 3.3Å; I216-V220 WeakPolarHBondContact O-CG2 3.45Å; I216-V220 PolarHBondContact O-N 3.44Å; M217-V220 PolarHBondContact O-N 2.89Å; V220-I222 PolarHBondContact O-N 3.19Å; V220-S223 PolarHBondContact O-N 3.47Å; V220-Q224 PolarHBondContact O-N 3.04Å
221H95.6Very high93.7Very high10 Ų1062.3 Ų62.35%0.04630%0.303CS..Hα-helixtrans-58.5-50.7179.8176.3-88.6000111.9W90 M169 F172 M217 V218 S223 Q224W90-H221 AromaticContact CH2-CE1 3.6Å; W90-H221 AromaticContact CH2-NE2 3.46Å; W90-H221 WeakPolarHBondContact CH2-NE2 3.41Å; W90-H221 AromaticContact CZ3-NE2 3.69Å; M169-H221 PolarHBondContact O-CE1 3Å; M169-H221 VanDerWaalsContact O-CE1 3.27Å; F172-H221 VanDerWaalsContact CB-CE1 3.48Å; F172-H221 WeakPolarHBondContact CB-CE1 3.27Å; F172-H221 HydrophobicContact CD1-CB 3.61Å; F172-H221 AromaticContact CD1-CG 3.44Å; F172-H221 VanDerWaalsContact CD1-CG 3.44Å; F172-H221 AromaticContact CD1-ND1 3.52Å; F172-H221 AromaticContact CD2-CD2 3.99Å; F172-H221 AromaticContact CD2-NE2 3.96Å; F172-H221 HydrophobicContact CE1-CB 3.53Å; F172-H221 AromaticContact CE1-CG 3.73Å; F172-H221 HydrophobicContact CG-CB 4.35Å; F172-H221 AromaticContact CG-CD2 3.93Å; F172-H221 AromaticContact CG-CE1 3.67Å; F172-H221 AromaticContact CG-CG 3.68Å; F172-H221 AromaticContact CG-ND1 3.52Å; F172-H221 AromaticContact CG-NE2 3.91Å; F172-H221 HydrophobicContact CZ-CB 4.22Å; M217-H221 VanDerWaalsContact O-CB 3.32Å; M217-H221 WeakPolarHBondContact O-CB 3.32Å; M217-H221 PolarHBondContact O-N 3.01Å; V218-H221 PolarHBondContact O-N 3.27Å; H221-S223 VanDerWaalsContact C-N 3.27Å; H221-S223 PolarHBondContact O-N 3.13Å; H221-Q224 VanDerWaalsContact O-CB 3.29Å; H221-Q224 WeakPolarHBondContact O-CB 3.26Å; H221-Q224 WeakPolarHBondContact O-CG 3.39Å; H221-Q224 PolarHBondContact O-N 2.95Å; H221-Q224 PolarHBondContact O-OE1 2.8Å
222I94.3Very high93.5Very high2 Ų267.8 Ų67.81%0.0133%0.333CS..Hα-helixtrans-68-29.5-178.1-151.273.1000112M169 V218 V220 Q224 Y225 I239 I242 W243M169-I222 HydrophobicContact CE-CD1 4.33Å; V218-I222 WeakPolarHBondContact O-CB 3.49Å; V218-I222 PolarHBondContact O-N 3.05Å; V220-I222 PolarHBondContact O-N 3.19Å; I222-Q224 PolarHBondContact O-N 3.3Å; I222-Y225 WeakPolarHBondContact O-CB 3.24Å; I222-Y225 PolarHBondContact O-N 3Å; I222-I239 HydrophobicContact CD1-CD1 3.56Å; I222-I239 HydrophobicContact CD1-CG2 4.28Å; I222-I239 HydrophobicContact CG1-CB 4.33Å; I222-I239 HydrophobicContact CG1-CD1 4.2Å; I222-I239 HydrophobicContact CG1-CG2 3.68Å; I222-I242 HydrophobicContact CB-CG2 4.21Å; I222-I242 HydrophobicContact CD1-CB 4.34Å; I222-I242 HydrophobicContact CD1-CD1 3.95Å; I222-I242 HydrophobicContact CD1-CG2 4.08Å; I222-I242 HydrophobicContact CG1-CB 4.09Å; I222-I242 HydrophobicContact CG1-CG2 3.87Å; I222-I242 HydrophobicContact CG2-CG2 4.33Å; I222-W243 HydrophobicContact CG2-CB 3.8Å; I222-W243 HydrophobicContact CG2-CG 4.25Å
223S93.9Very high93.4Very high24 Ų2466.8 Ų66.817%0.16833%0.328CS..Hα-helixtrans-66.1-21.8177.5-62.10000113S219 V220 H221 Y225 Y226 F227 W243S219-S223 VanDerWaalsContact O-CB 3.25Å; S219-S223 WeakPolarHBondContact O-CB 3.13Å; S219-S223 PolarHBondContact O-N 3.17Å; S219-S223 PolarHBondContact O-OG 2.93Å; V220-S223 PolarHBondContact O-N 3.47Å; H221-S223 VanDerWaalsContact C-N 3.27Å; H221-S223 PolarHBondContact O-N 3.13Å; S223-Y225 PolarHBondContact O-N 2.83Å; S223-Y225 VanDerWaalsContact O-N 3.13Å; S223-Y226 PolarHBondContact O-N 2.65Å; S223-F227 WeakPolarHBondContact O-CD2 3.48Å; S223-W243 PolarHBondContact OG-NE1 2.98Å
224Q94.9Very high93.1Very high57 Ų5766.3 Ų66.327%0.26632%0.324SS..G310 helixtrans-53.8-33.6175.7-66.3174.4-113.100111.8V220 H221 I222 Y226 F227 M228V220-Q224 PolarHBondContact O-N 3.04Å; H221-Q224 VanDerWaalsContact O-CB 3.29Å; H221-Q224 WeakPolarHBondContact O-CB 3.26Å; H221-Q224 WeakPolarHBondContact O-CG 3.39Å; H221-Q224 PolarHBondContact O-N 2.95Å; H221-Q224 PolarHBondContact O-OE1 2.8Å; I222-Q224 PolarHBondContact O-N 3.3Å; Q224-Y226 PolarHBondContact O-N 2.71Å; Q224-F227 PolarHBondContact O-N 2.82Å; Q224-M228 HydrophobicContact CB-CE 3.9Å; Q224-M228 WeakPolarHBondContact O-CG 3.46Å; Q224-M228 PolarHBondContact O-N 2.74Å
225Y93.6Very high92.7Very high50 Ų5067.5 Ų67.520%0.19633%0.332CS..G310 helixtrans-49.8-42175.3178.7-99.7000112.7M169 I222 S223 F227 P236 I239M169-Y225 HydrophobicContact SD-CD2 4.29Å; I222-Y225 WeakPolarHBondContact O-CB 3.24Å; I222-Y225 PolarHBondContact O-N 3Å; S223-Y225 PolarHBondContact O-N 2.83Å; S223-Y225 VanDerWaalsContact O-N 3.13Å; Y225-F227 VanDerWaalsContact C-N 3.26Å; Y225-F227 PolarHBondContact O-N 2.84Å; Y225-P236 HydrophobicContact CE1-CB 4.21Å; Y225-P236 WeakPolarHBondContact OH-CB 3.46Å; Y225-P236 VanDerWaalsContact OH-CG 3.26Å; Y225-P236 WeakPolarHBondContact OH-CG 3.43Å; Y225-I239 HydrophobicContact CD1-CB 4.36Å; Y225-I239 HydrophobicContact CD1-CG1 4.49Å; Y225-I239 HydrophobicContact CD1-CG2 3.72Å; Y225-I239 HydrophobicContact CD2-CG1 4.31Å; Y225-I239 HydrophobicContact CG-CB 4.44Å; Y225-I239 HydrophobicContact CG-CG1 4.21Å; Y225-I239 HydrophobicContact CG-CG2 3.74Å
226Y92.3Very high92.4Very high112 Ų11269.4 Ų69.444%0.43935%0.346SS..G310 helixtrans-75.7-12.5-177.1-60.1-67.2000114.2S223 Q224 I239 L240S223-Y226 PolarHBondContact O-N 2.65Å; Q224-Y226 PolarHBondContact O-N 2.71Å; Y226-I239 HydrophobicContact CE2-CG2 4.39Å; Y226-L240 WeakPolarHBondContact OH-CA 3.16Å
227F93.8Very high92.1Very high172 Ų17271 Ų7175%0.75436%0.355SS*.THydrogen-bonded Turntrans-112.3-9.1-178.1-58.3-74.4000113.1S223 Q224 Y225S223-F227 WeakPolarHBondContact O-CD2 3.48Å; Q224-F227 PolarHBondContact O-N 2.82Å; Y225-F227 VanDerWaalsContact C-N 3.26Å; Y225-F227 PolarHBondContact O-N 2.84Å
228M93.4Very high91.7Very high50 Ų5068.2 Ų68.225%0.24634%0.34CS..  trans-86.5119.6174.9-70.2-177-67.100109.6R97 C98 M169 Q224 C231R97-M228 HydrophobicContact CB-SD 4Å; C98-M228 HydrophobicContact CB-CE 3.81Å; C98-M228 HydrophobicContact CB-SD 3.82Å; M169-M228 HydrophobicContact CE-CE 4.28Å; Q224-M228 HydrophobicContact CB-CE 3.9Å; Q224-M228 WeakPolarHBondContact O-CG 3.46Å; Q224-M228 PolarHBondContact O-N 2.74Å; M228-C231 HydrophobicContact CB-CB 3.83Å; M228-C231 HydrophobicContact CE-CB 4.26Å
229K87.6Confident91.5Very high198 Ų19867.9 Ų67.986%0.86134%0.337SS*.THydrogen-bonded Turntrans-68.9-36.5-179.7-66.6-176.3178.9-178.70112.6
230D88.9Confident91.4Very high154 Ų15470.1 Ų70.182%0.82435%0.348SS*.THydrogen-bonded Turntrans-114.957.9-171.9-51-52.7000110.8
231C91.2Very high91.2Very high10 Ų1067.9 Ų67.97%0.06833%0.332CS..  trans-123.395178.7-174.50000112.5C98 M228 Y233C98-C231 HydrophobicContact CB-CB 3.75Å; C98-C231 WeakPolarHBondContact CB-SG 3.49Å; C98-C231 WeakPolarHBondContact SG-CA 3.32Å; C98-C231 WeakPolarHBondContact SG-CB 3.44Å; C98-C231 CovalentContact SG-SG 2.03Å; C98-C231 PolarHBondContact SG-SG 3.1Å; M228-C231 HydrophobicContact CB-CB 3.83Å; M228-C231 HydrophobicContact CE-CB 4.26Å; C231-Y233 PolarHBondContact O-N 3.21Å
232D90.8Very high91Very high135 Ų13567.9 Ų67.972%0.72233%0.332SS*.  trans-85.948-177.9-63.5-33.5000112.7L100 Q234L100-D232 WeakPolarHBondContact CD2-O 3.26Å; D232-Q234 PolarHBondContact O-N 3.33Å
233Y89.8Confident90.9Very high5 Ų572.5 Ų72.52%0.0235%0.35CS..  trans-60.7122.8177.1-172-95.9000110.2C101 A167 M169 C231 V235 P236 I239C101-Y233 PolarHBondContact SG-OH 3.48Å; A167-Y233 PolarHBondContact O-OH 3.22Å; M169-Y233 HydrophobicContact CG-CD2 3.93Å; M169-Y233 HydrophobicContact CG-CE2 3.91Å; M169-Y233 HydrophobicContact SD-CD2 4.26Å; C231-Y233 PolarHBondContact O-N 3.21Å; Y233-V235 HydrophobicContact CE1-CB 4.18Å; Y233-V235 VanDerWaalsContact CE1-O 3.26Å; Y233-V235 WeakPolarHBondContact CE1-O 3.36Å; Y233-V235 PolarHBondContact O-N 3.41Å; Y233-V235 VanDerWaalsContact O-N 3.11Å; Y233-P236 WeakPolarHBondContact O-CD 3.29Å; Y233-P236 WeakPolarHBondContact O-CG 3.14Å; Y233-I239 HydrophobicContact CD1-CD1 3.85Å; Y233-I239 HydrophobicContact CD1-CG1 3.68Å; Y233-I239 HydrophobicContact CE1-CD1 3.68Å; Y233-I239 HydrophobicContact CE1-CG1 3.83Å; Y233-I239 HydrophobicContact CE2-CD1 4.4Å; Y233-I239 HydrophobicContact CG-CD1 4.28Å; Y233-I239 HydrophobicContact CG-CG1 4.35Å
234Q90.1Very high90.9Very high87 Ų8775.3 Ų75.341%0.40736%0.361SS..SBendtrans-71.2-16.4-162.7-57.996.4-40.900113.9C101 F103 D232C101-Q234 PolarHBondContact O-NE2 3.46Å; F103-Q234 HydrophobicContact CE2-CB 4.43Å; F103-Q234 HydrophobicContact CE2-CG 4.46Å; D232-Q234 PolarHBondContact O-N 3.33Å
235V87.6Confident90.7Very high40 Ų4074.9 Ų74.924%0.24236%0.358CS..  trans-133.570.9-179.2-166.70000111.9T164 Y233 L237 W238T164-V235 HydrophobicContact CG2-CB 3.51Å; T164-V235 HydrophobicContact CG2-CG1 3.71Å; T164-V235 HydrophobicContact CG2-CG2 3.52Å; Y233-V235 HydrophobicContact CE1-CB 4.18Å; Y233-V235 VanDerWaalsContact CE1-O 3.26Å; Y233-V235 WeakPolarHBondContact CE1-O 3.36Å; Y233-V235 PolarHBondContact O-N 3.41Å; Y233-V235 VanDerWaalsContact O-N 3.11Å; V235-L237 PolarHBondContact O-N 3.48Å; V235-L237 VanDerWaalsContact O-N 3.11Å; V235-W238 HydrophobicContact CG1-CB 4.21Å; V235-W238 WeakPolarHBondContact O-CB 3.44Å; V235-W238 PolarHBondContact O-N 2.89Å
236P88.4Confident90.5Very high58 Ų5872.8 Ų72.838%0.37735%0.351SS..Hα-helixtrans-58.9-28.5-175-26.736.9000114.5Y225 Y233 W238 I239 L240Y225-P236 HydrophobicContact CE1-CB 4.21Å; Y225-P236 WeakPolarHBondContact OH-CB 3.46Å; Y225-P236 VanDerWaalsContact OH-CG 3.26Å; Y225-P236 WeakPolarHBondContact OH-CG 3.43Å; Y233-P236 WeakPolarHBondContact O-CD 3.29Å; Y233-P236 WeakPolarHBondContact O-CG 3.14Å; P236-W238 PolarHBondContact O-N 3.42Å; P236-I239 WeakPolarHBondContact O-CB 3.3Å; P236-I239 PolarHBondContact O-N 3.41Å; P236-I239 VanDerWaalsContact O-N 3.15Å; P236-L240 PolarHBondContact O-N 3.27Å
237L88.3Confident90.5Very high117 Ų11769.4 Ų69.461%0.61334%0.342SS*.Hα-helixtrans-56.5-34.8175.4-178.964.2000111.9V235 L240 L241V235-L237 PolarHBondContact O-N 3.48Å; V235-L237 VanDerWaalsContact O-N 3.11Å; L237-L240 PolarHBondContact O-N 3.25Å; L237-L241 HydrophobicContact CG-CD1 4.2Å; L237-L241 WeakPolarHBondContact O-CG 3.47Å; L237-L241 PolarHBondContact O-N 3.43Å
238W87.9Confident90.4Very high29 Ų2964.7 Ų64.711%0.1132%0.324CS..Hα-helixtrans-70.1-36.9-179.8-160.4-118000112.2T156 T164 V235 P236 L240 L241 I242T156-W238 WeakPolarHBondContact O-CH2 3.45Å; T164-W238 HydrophobicContact CG2-CB 4.28Å; T164-W238 HydrophobicContact CG2-CG 4.32Å; V235-W238 HydrophobicContact CG1-CB 4.21Å; V235-W238 WeakPolarHBondContact O-CB 3.44Å; V235-W238 PolarHBondContact O-N 2.89Å; P236-W238 PolarHBondContact O-N 3.42Å; W238-L240 VanDerWaalsContact C-N 3.34Å; W238-L240 PolarHBondContact O-N 3.25Å; W238-L241 HydrophobicContact CE3-CB 4.33Å; W238-L241 HydrophobicContact CE3-CD1 3.61Å; W238-L241 HydrophobicContact CZ3-CD1 3.72Å; W238-L241 PolarHBondContact O-N 2.85Å; W238-I242 HydrophobicContact CG-CD1 4.36Å; W238-I242 VanDerWaalsContact O-CG1 3.29Å; W238-I242 WeakPolarHBondContact O-CG1 3.16Å; W238-I242 PolarHBondContact O-N 2.63Å
239I90.4Very high90.3Very high0 Ų062.6 Ų62.60%031%0.314CS..Hα-helixtrans-58.7-48.1172.9-56.6-56.1000110M169 I222 Y225 Y226 Y233 P236 L241 I242 W243M169-I239 HydrophobicContact CE-CD1 4.46Å; M169-I239 HydrophobicContact CG-CD1 3.8Å; M169-I239 HydrophobicContact SD-CD1 3.88Å; I222-I239 HydrophobicContact CD1-CD1 3.56Å; I222-I239 HydrophobicContact CD1-CG2 4.28Å; I222-I239 HydrophobicContact CG1-CB 4.33Å; I222-I239 HydrophobicContact CG1-CD1 4.2Å; I222-I239 HydrophobicContact CG1-CG2 3.68Å; Y225-I239 HydrophobicContact CD1-CB 4.36Å; Y225-I239 HydrophobicContact CD1-CG1 4.49Å; Y225-I239 HydrophobicContact CD1-CG2 3.72Å; Y225-I239 HydrophobicContact CD2-CG1 4.31Å; Y225-I239 HydrophobicContact CG-CB 4.44Å; Y225-I239 HydrophobicContact CG-CG1 4.21Å; Y225-I239 HydrophobicContact CG-CG2 3.74Å; Y226-I239 HydrophobicContact CE2-CG2 4.39Å; Y233-I239 HydrophobicContact CD1-CD1 3.85Å; Y233-I239 HydrophobicContact CD1-CG1 3.68Å; Y233-I239 HydrophobicContact CE1-CD1 3.68Å; Y233-I239 HydrophobicContact CE1-CG1 3.83Å; Y233-I239 HydrophobicContact CE2-CD1 4.4Å; Y233-I239 HydrophobicContact CG-CD1 4.28Å; Y233-I239 HydrophobicContact CG-CG1 4.35Å; P236-I239 WeakPolarHBondContact O-CB 3.3Å; P236-I239 PolarHBondContact O-N 3.41Å; P236-I239 VanDerWaalsContact O-N 3.15Å; I239-L241 VanDerWaalsContact C-N 3.34Å; I239-L241 PolarHBondContact O-N 3.43Å; I239-I242 PolarHBondContact O-N 2.96Å; I239-W243 PolarHBondContact O-N 3.42Å
240L91.1Very high90.5Very high68 Ų6856.3 Ų56.336%0.35629%0.287SS..Hα-helixtrans-60.3-44177.817963.9000111.6Y226 P236 L237 W238 W243 M244Y226-L240 WeakPolarHBondContact OH-CA 3.16Å; P236-L240 PolarHBondContact O-N 3.27Å; L237-L240 PolarHBondContact O-N 3.25Å; W238-L240 VanDerWaalsContact C-N 3.34Å; W238-L240 PolarHBondContact O-N 3.25Å; L240-W243 PolarHBondContact O-N 2.93Å; L240-M244 HydrophobicContact CD1-CG 4.29Å; L240-M244 HydrophobicContact CG-CE 4.26Å; L240-M244 HydrophobicContact CG-CG 4.49Å; L240-M244 HydrophobicContact CG-SD 4.47Å; L240-M244 WeakPolarHBondContact O-CG 3.44Å; L240-M244 PolarHBondContact O-N 3.22Å
241L91.1Very high90.7Very high47 Ų4755.4 Ų55.425%0.24628%0.276CS..Hα-helixtrans-62.9-45.1178.3-73.7168.3000112.1L237 W238 I239 W243 M244 Y245L237-L241 HydrophobicContact CG-CD1 4.2Å; L237-L241 WeakPolarHBondContact O-CG 3.47Å; L237-L241 PolarHBondContact O-N 3.43Å; W238-L241 HydrophobicContact CE3-CB 4.33Å; W238-L241 HydrophobicContact CE3-CD1 3.61Å; W238-L241 HydrophobicContact CZ3-CD1 3.72Å; W238-L241 PolarHBondContact O-N 2.85Å; I239-L241 VanDerWaalsContact C-N 3.34Å; I239-L241 PolarHBondContact O-N 3.43Å; L241-W243 VanDerWaalsContact C-N 3.31Å; L241-W243 PolarHBondContact O-N 3.25Å; L241-M244 HydrophobicContact CD2-CE 3.68Å; L241-M244 HydrophobicContact CG-CE 4.46Å; L241-M244 PolarHBondContact O-N 3.49Å; L241-Y245 HydrophobicContact CD2-CE1 4.45Å; L241-Y245 WeakPolarHBondContact O-CB 3.47Å; L241-Y245 WeakPolarHBondContact O-CD1 3.29Å; L241-Y245 PolarHBondContact O-N 3.02Å
242I92Very high90.6Very high11 Ų1156.6 Ų56.66%0.05628%0.281CS..Hα-helixtrans-58.7-45175.7-68.4164.3000110.3G170 V218 I222 W238 I239 Y245 G246G170-I242 WeakPolarHBondContact O-CD1 3.38Å; V218-I242 HydrophobicContact CG1-CG2 4.02Å; I222-I242 HydrophobicContact CB-CG2 4.21Å; I222-I242 HydrophobicContact CD1-CB 4.34Å; I222-I242 HydrophobicContact CD1-CD1 3.95Å; I222-I242 HydrophobicContact CD1-CG2 4.08Å; I222-I242 HydrophobicContact CG1-CB 4.09Å; I222-I242 HydrophobicContact CG1-CG2 3.87Å; I222-I242 HydrophobicContact CG2-CG2 4.33Å; W238-I242 HydrophobicContact CG-CD1 4.36Å; W238-I242 VanDerWaalsContact O-CG1 3.29Å; W238-I242 WeakPolarHBondContact O-CG1 3.16Å; W238-I242 PolarHBondContact O-N 2.63Å; I239-I242 PolarHBondContact O-N 2.96Å; I242-Y245 PolarHBondContact O-N 3.43Å; I242-G246 PolarHBondContact O-N 2.93Å
243W92.7Very high90.5Very high98 Ų9851.3 Ų51.337%0.37125%0.252SS..Hα-helixtrans-63.8-45.7179.3-174.886.3000112.6I222 S223 I239 L240 L241 Y245 G246 T247I222-W243 HydrophobicContact CG2-CB 3.8Å; I222-W243 HydrophobicContact CG2-CG 4.25Å; S223-W243 PolarHBondContact OG-NE1 2.98Å; I239-W243 PolarHBondContact O-N 3.42Å; L240-W243 PolarHBondContact O-N 2.93Å; L241-W243 VanDerWaalsContact C-N 3.31Å; L241-W243 PolarHBondContact O-N 3.25Å; W243-Y245 VanDerWaalsContact C-N 3.33Å; W243-Y245 PolarHBondContact O-N 3.16Å; W243-G246 PolarHBondContact O-N 3.44Å; W243-T247 WeakPolarHBondContact O-CB 3.34Å; W243-T247 PolarHBondContact O-N 3.03Å; W243-T247 PolarHBondContact O-OG1 3.17Å
244M92.4Very high90.5Very high84 Ų8452.4 Ų52.441%0.41426%0.262SS..Hα-helixtrans-61.5-41.8176.3-72.1-166.1-57.800111.6L240 L241 T247 L248L240-M244 HydrophobicContact CD1-CG 4.29Å; L240-M244 HydrophobicContact CG-CE 4.26Å; L240-M244 HydrophobicContact CG-CG 4.49Å; L240-M244 HydrophobicContact CG-SD 4.47Å; L240-M244 WeakPolarHBondContact O-CG 3.44Å; L240-M244 PolarHBondContact O-N 3.22Å; L241-M244 HydrophobicContact CD2-CE 3.68Å; L241-M244 HydrophobicContact CG-CE 4.46Å; L241-M244 PolarHBondContact O-N 3.49Å; M244-T247 PolarHBondContact O-N 2.99Å; M244-L248 WeakPolarHBondContact O-CB 3.44Å; M244-L248 PolarHBondContact O-N 3.15Å
245Y91.1Very high90.5Very high48 Ų4853.6 Ų53.619%0.18827%0.267CS..Hα-helixtrans-69.8-43.5179.7-85.149.7000111.6F152 T156 L241 I242 W243 T247 L248 F249F152-Y245 AromaticContact CD1-CE2 3.72Å; F152-Y245 HydrophobicContact CD1-CE2 3.72Å; F152-Y245 AromaticContact CD1-CZ 3.8Å; F152-Y245 VanDerWaalsContact CD1-OH 3.32Å; F152-Y245 WeakPolarHBondContact CD1-OH 3.48Å; F152-Y245 HydrophobicContact CE1-CE2 4.19Å; F152-Y245 AromaticContact CE1-CZ 3.77Å; F152-Y245 WeakPolarHBondContact CE1-OH 3.41Å; T156-Y245 HydrophobicContact CG2-CE2 3.48Å; T156-Y245 VanDerWaalsContact CG2-CE2 3.48Å; T156-Y245 WeakPolarHBondContact CG2-OH 3.41Å; L241-Y245 HydrophobicContact CD2-CE1 4.45Å; L241-Y245 WeakPolarHBondContact O-CB 3.47Å; L241-Y245 WeakPolarHBondContact O-CD1 3.29Å; L241-Y245 PolarHBondContact O-N 3.02Å; I242-Y245 PolarHBondContact O-N 3.43Å; W243-Y245 VanDerWaalsContact C-N 3.33Å; W243-Y245 PolarHBondContact O-N 3.16Å; Y245-T247 VanDerWaalsContact C-N 3.25Å; Y245-T247 PolarHBondContact O-N 3.11Å; Y245-L248 PolarHBondContact O-N 3.34Å; Y245-F249 HydrophobicContact CD2-CE2 4.1Å; Y245-F249 VanDerWaalsContact O-CD2 3.25Å; Y245-F249 WeakPolarHBondContact O-CD2 3.38Å; Y245-F249 PolarHBondContact O-N 3.49Å
246G90.3Very high90.5Very high6 Ų654.1 Ų54.16%0.06227%0.266CS..Hα-helixtrans-55.7-44174.400000111.4I242 W243 F250I242-G246 PolarHBondContact O-N 2.93Å; W243-G246 PolarHBondContact O-N 3.44Å; G246-F250 VanDerWaalsContact O-CB 3.29Å; G246-F250 WeakPolarHBondContact O-CB 3.4Å; G246-F250 PolarHBondContact O-N 2.84Å
247T91.4Very high90.5Very high40 Ų4054.7 Ų54.725%0.24526%0.261CS..Hα-helixtrans-65.9-47.1176.6-56.90000112.2W243 M244 Y245 F249 F250 F251W243-T247 WeakPolarHBondContact O-CB 3.34Å; W243-T247 PolarHBondContact O-N 3.03Å; W243-T247 PolarHBondContact O-OG1 3.17Å; M244-T247 PolarHBondContact O-N 2.99Å; Y245-T247 VanDerWaalsContact C-N 3.25Å; Y245-T247 PolarHBondContact O-N 3.11Å; T247-F249 PolarHBondContact O-N 3.28Å; T247-F250 WeakPolarHBondContact O-CB 3.29Å; T247-F250 PolarHBondContact O-N 3.44Å; T247-F251 HydrophobicContact CG2-CD2 3.91Å; T247-F251 HydrophobicContact CG2-CE2 3.56Å; T247-F251 WeakPolarHBondContact O-CD2 3.32Å; T247-F251 PolarHBondContact O-N 3.32Å; T247-F251 VanDerWaalsContact O-N 3.12Å
248L92.6Very high90.6Very high73 Ų7351.7 Ų51.738%0.38225%0.247SC..Hα-helixtrans-58.4-49.8177.4176.164.3000111.8F148 M244 Y245 F250 F251 L252F148-L248 HydrophobicContact CE1-CD2 3.81Å; F148-L248 HydrophobicContact CZ-CD2 3.94Å; M244-L248 WeakPolarHBondContact O-CB 3.44Å; M244-L248 PolarHBondContact O-N 3.15Å; Y245-L248 PolarHBondContact O-N 3.34Å; L248-F250 VanDerWaalsContact C-N 3.35Å; L248-F250 PolarHBondContact O-N 2.89Å; L248-F251 PolarHBondContact O-N 3.37Å; L248-L252 HydrophobicContact CD1-CD1 4.33Å; L248-L252 HydrophobicContact CG-CD1 4.16Å; L248-L252 WeakPolarHBondContact O-CG 3.3Å; L248-L252 PolarHBondContact O-N 3.36Å
249F89.9Confident90.6Very high6 Ų652.2 Ų52.23%0.02625%0.251CS..Hα-helixtrans-67.7-35.3179.9-77.8-61.4000112.4L145 F148 H149 M153 F215 Y245 T247 F251 L252 F253L145-F249 HydrophobicContact CD1-CD1 4.5Å; F148-F249 HydrophobicContact CD1-CE1 4.12Å; F148-F249 HydrophobicContact CD1-CZ 4.38Å; F148-F249 HydrophobicContact CE1-CE1 4.2Å; F148-F249 HydrophobicContact CE1-CZ 4.16Å; H149-F249 HydrophobicContact CB-CE1 3.91Å; H149-F249 HydrophobicContact CB-CZ 4.37Å; H149-F249 AromaticContact CD2-CE1 3.68Å; H149-F249 AromaticContact CD2-CZ 3.82Å; M153-F249 HydrophobicContact CG-CZ 4.25Å; M153-F249 HydrophobicContact SD-CE2 3.58Å; M153-F249 VanDerWaalsContact SD-CE2 3.58Å; M153-F249 HydrophobicContact SD-CZ 3.88Å; F215-F249 HydrophobicContact CD1-CB 3.92Å; F215-F249 HydrophobicContact CE1-CB 3.45Å; F215-F249 VanDerWaalsContact CE1-CB 3.45Å; F215-F249 HydrophobicContact CE1-CD2 4.49Å; F215-F249 HydrophobicContact CE1-CG 4.15Å; F215-F249 HydrophobicContact CE2-CB 4.16Å; F215-F249 HydrophobicContact CG-CB 4.46Å; F215-F249 HydrophobicContact CZ-CB 3.6Å; F215-F249 HydrophobicContact CZ-CG 4.31Å; Y245-F249 HydrophobicContact CD2-CE2 4.1Å; Y245-F249 VanDerWaalsContact O-CD2 3.25Å; Y245-F249 WeakPolarHBondContact O-CD2 3.38Å; Y245-F249 PolarHBondContact O-N 3.49Å; T247-F249 PolarHBondContact O-N 3.28Å; F249-F251 VanDerWaalsContact C-N 3.34Å; F249-F251 PolarHBondContact O-N 2.93Å; F249-L252 HydrophobicContact CD1-CD1 4.18Å; F249-L252 HydrophobicContact CE1-CD1 4.48Å; F249-L252 PolarHBondContact O-N 3.43Å; F249-F253 WeakPolarHBondContact O-CB 3.47Å; F249-F253 WeakPolarHBondContact O-CD2 3.35Å; F249-F253 PolarHBondContact O-N 3.44Å
250F92.3Very high90.2Very high67 Ų6752.3 Ų52.329%0.29425%0.252SS..Hα-helixtrans-55.4-49.9171.9179.1-94.8000111.2L212 F215 I216 G246 T247 L248 L252 F253 A254L212-F250 HydrophobicContact CD2-CD2 4.05Å; L212-F250 HydrophobicContact CD2-CE2 4.1Å; F215-F250 HydrophobicContact CB-CB 4.06Å; F215-F250 HydrophobicContact CB-CD2 4.22Å; I216-F250 HydrophobicContact CD1-CE2 3.93Å; I216-F250 HydrophobicContact CG1-CD2 4.11Å; I216-F250 HydrophobicContact CG1-CE2 3.76Å; G246-F250 VanDerWaalsContact O-CB 3.29Å; G246-F250 WeakPolarHBondContact O-CB 3.4Å; G246-F250 PolarHBondContact O-N 2.84Å; T247-F250 WeakPolarHBondContact O-CB 3.29Å; T247-F250 PolarHBondContact O-N 3.44Å; L248-F250 VanDerWaalsContact C-N 3.35Å; L248-F250 PolarHBondContact O-N 2.89Å; F250-L252 PolarHBondContact O-N 3.01Å; F250-F253 PolarHBondContact O-N 3.04Å; F250-A254 VanDerWaalsContact O-CB 3.24Å; F250-A254 WeakPolarHBondContact O-CB 3.25Å; F250-A254 PolarHBondContact O-N 3.42Å
251F93.6Very high90Very high135 Ų13549.9 Ų49.959%0.59224%0.238SC*.Hα-helixtrans-64.8-39.4179-75.8-63.2000113.1T247 L248 F249 A254 H255T247-F251 HydrophobicContact CG2-CD2 3.91Å; T247-F251 HydrophobicContact CG2-CE2 3.56Å; T247-F251 WeakPolarHBondContact O-CD2 3.32Å; T247-F251 PolarHBondContact O-N 3.32Å; T247-F251 VanDerWaalsContact O-N 3.12Å; L248-F251 PolarHBondContact O-N 3.37Å; F249-F251 VanDerWaalsContact C-N 3.34Å; F249-F251 PolarHBondContact O-N 2.93Å; F251-A254 PolarHBondContact O-N 2.91Å; F251-H255 WeakPolarHBondContact O-CB 3.26Å; F251-H255 PolarHBondContact O-N 3.27Å
252L89.4Confident89.7Confident35 Ų3553.2 Ų53.218%0.18326%0.255CS..Hα-helixtrans-64-42.5176.5-71.6170.9000112.2F144 L145 F148 L248 F249 F250 F256F144-L252 HydrophobicContact CE1-CD2 4.49Å; L145-L252 HydrophobicContact CD1-CB 3.62Å; L145-L252 HydrophobicContact CD1-CD1 3.9Å; L145-L252 HydrophobicContact CD1-CG 4.28Å; F148-L252 HydrophobicContact CD1-CD1 4.23Å; F148-L252 HydrophobicContact CE1-CD1 4.39Å; L248-L252 HydrophobicContact CD1-CD1 4.33Å; L248-L252 HydrophobicContact CG-CD1 4.16Å; L248-L252 WeakPolarHBondContact O-CG 3.3Å; L248-L252 PolarHBondContact O-N 3.36Å; F249-L252 HydrophobicContact CD1-CD1 4.18Å; F249-L252 HydrophobicContact CE1-CD1 4.48Å; F249-L252 PolarHBondContact O-N 3.43Å; F250-L252 PolarHBondContact O-N 3.01Å; L252-F256 PolarHBondContact O-N 3.41Å
253F87.8Confident89.5Confident24 Ų2458.6 Ų58.611%0.10528%0.278CS..Hα-helixtrans-72.9-34.9177.1-88.3-102.5000112.5L145 T208 Q211 L212 F215 F249 F250 F256 W257L145-F253 HydrophobicContact CD1-CD2 4.2Å; L145-F253 HydrophobicContact CD1-CE2 4Å; L145-F253 HydrophobicContact CD2-CD2 4.24Å; L145-F253 HydrophobicContact CD2-CE2 4.2Å; L145-F253 HydrophobicContact CG-CE2 4.43Å; T208-F253 HydrophobicContact CG2-CD1 4.44Å; Q211-F253 HydrophobicContact CB-CD1 4.23Å; Q211-F253 HydrophobicContact CB-CE1 4.14Å; Q211-F253 HydrophobicContact CG-CE1 4.47Å; L212-F253 HydrophobicContact CD2-CB 3.62Å; L212-F253 HydrophobicContact CG-CB 4.37Å; F215-F253 HydrophobicContact CE2-CB 4.17Å; F215-F253 HydrophobicContact CE2-CD1 4.27Å; F215-F253 AromaticContact CE2-CD2 3.54Å; F215-F253 HydrophobicContact CE2-CD2 3.54Å; F215-F253 AromaticContact CE2-CE2 3.92Å; F215-F253 HydrophobicContact CE2-CE2 3.92Å; F215-F253 AromaticContact CE2-CG 3.73Å; F215-F253 HydrophobicContact CE2-CG 3.73Å; F215-F253 HydrophobicContact CE2-CZ 4.43Å; F215-F253 AromaticContact CZ-CD2 3.94Å; F215-F253 HydrophobicContact CZ-CD2 3.94Å; F215-F253 AromaticContact CZ-CE2 3.91Å; F215-F253 HydrophobicContact CZ-CE2 3.91Å; F215-F253 HydrophobicContact CZ-CZ 4.49Å; F249-F253 WeakPolarHBondContact O-CB 3.47Å; F249-F253 WeakPolarHBondContact O-CD2 3.35Å; F249-F253 PolarHBondContact O-N 3.44Å; F250-F253 PolarHBondContact O-N 3.04Å; F253-F256 WeakPolarHBondContact O-CB 3.37Å; F253-F256 PolarHBondContact O-N 2.99Å; F253-W257 WeakPolarHBondContact O-CB 3.45Å; F253-W257 PolarHBondContact O-N 3.13Å
254A90.3Very high89Confident28 Ų2855.4 Ų55.423%0.23128%0.275CS..Hα-helixtrans-63.5-44172.900000110.6L212 F250 F251 F256 W257 V258L212-A254 HydrophobicContact CD2-CB 4.49Å; F250-A254 VanDerWaalsContact O-CB 3.24Å; F250-A254 WeakPolarHBondContact O-CB 3.25Å; F250-A254 PolarHBondContact O-N 3.42Å; F251-A254 PolarHBondContact O-N 2.91Å; A254-F256 VanDerWaalsContact C-N 3.34Å; A254-F256 PolarHBondContact O-N 2.75Å; A254-W257 WeakPolarHBondContact O-CB 3.04Å; A254-W257 PolarHBondContact O-N 3.48Å; A254-V258 WeakPolarHBondContact O-CG2 3.44Å; A254-V258 PolarHBondContact O-N 2.91Å
255H91.1Very high88.4Confident112 Ų11258.3 Ų58.352%0.51929%0.286SS..Hα-helixtrans-60.5-43.6172.6176.4-101.8000111.7F251 W257 V258 Q259F251-H255 WeakPolarHBondContact O-CB 3.26Å; F251-H255 PolarHBondContact O-N 3.27Å; H255-W257 VanDerWaalsContact C-N 3.35Å; H255-W257 PolarHBondContact O-N 2.95Å; H255-V258 PolarHBondContact O-N 3.43Å; H255-Q259 PolarHBondContact NE2-NE2 3.25Å; H255-Q259 VanDerWaalsContact O-CG 3.3Å; H255-Q259 WeakPolarHBondContact O-CG 3.38Å; H255-Q259 PolarHBondContact O-N 3.3Å
256F87.3Confident87.8Confident50 Ų5060.5 Ų60.522%0.21929%0.293CS..Hα-helixtrans-58.1-45.4173.7173.3-97.5000112L145 T208 L252 F253 A254 V258 Q259 A260 Y261L145-F256 HydrophobicContact CD2-CB 4.14Å; T208-F256 HydrophobicContact CG2-CD1 3.99Å; T208-F256 HydrophobicContact CG2-CE1 4.11Å; L252-F256 PolarHBondContact O-N 3.41Å; F253-F256 WeakPolarHBondContact O-CB 3.37Å; F253-F256 PolarHBondContact O-N 2.99Å; A254-F256 VanDerWaalsContact C-N 3.34Å; A254-F256 PolarHBondContact O-N 2.75Å; F256-V258 PolarHBondContact O-N 2.77Å; F256-Q259 PolarHBondContact O-N 3.27Å; F256-A260 HydrophobicContact CD1-CB 4.43Å; F256-A260 HydrophobicContact CD2-CB 4.5Å; F256-A260 HydrophobicContact CE1-CB 4.06Å; F256-A260 HydrophobicContact CE2-CB 4.14Å; F256-A260 HydrophobicContact CZ-CB 3.91Å; F256-A260 WeakPolarHBondContact O-CB 3.37Å; F256-A260 PolarHBondContact O-N 3.04Å; F256-Y261 HydrophobicContact CE1-CE2 4.4Å
257W88.1Confident87.2Confident71 Ų7164.5 Ų64.527%0.26931%0.313SS..Hα-helixtrans-57.4-48.7177.9-179.7-80.5000111.9K205 T208 A209 L212 F253 A254 H255 Q259 A260 Y261 I262K205-W257 HydrophobicContact CB-CH2 4.41Å; K205-W257 WeakPolarHBondContact O-CZ3 3.25Å; T208-W257 HydrophobicContact CG2-CE3 3.71Å; T208-W257 HydrophobicContact CG2-CZ3 4.26Å; A209-W257 HydrophobicContact CB-CH2 4.11Å; A209-W257 HydrophobicContact CB-CZ3 3.95Å; L212-W257 HydrophobicContact CD1-CB 4.41Å; L212-W257 HydrophobicContact CD1-CD2 4.28Å; L212-W257 HydrophobicContact CD1-CE3 3.9Å; F253-W257 WeakPolarHBondContact O-CB 3.45Å; F253-W257 PolarHBondContact O-N 3.13Å; A254-W257 WeakPolarHBondContact O-CB 3.04Å; A254-W257 PolarHBondContact O-N 3.48Å; H255-W257 VanDerWaalsContact C-N 3.35Å; H255-W257 PolarHBondContact O-N 2.95Å; W257-Q259 VanDerWaalsContact C-N 3.35Å; W257-Q259 PolarHBondContact O-N 3.33Å; W257-A260 PolarHBondContact O-N 3.48Å; W257-Y261 HydrophobicContact CB-CD2 4.42Å; W257-Y261 AromaticContact CD2-CD2 3.61Å; W257-Y261 HydrophobicContact CD2-CD2 3.61Å; W257-Y261 HydrophobicContact CD2-CE2 4.18Å; W257-Y261 AromaticContact CE3-CD2 3.66Å; W257-Y261 HydrophobicContact CE3-CD2 3.66Å; W257-Y261 AromaticContact CE3-CE2 3.74Å; W257-Y261 HydrophobicContact CE3-CE2 3.74Å; W257-Y261 AromaticContact CG-CD2 3.98Å; W257-Y261 HydrophobicContact CG-CD2 3.98Å; W257-Y261 HydrophobicContact CZ3-CD2 4.13Å; W257-Y261 HydrophobicContact CZ3-CE2 4.07Å; W257-Y261 WeakPolarHBondContact O-CB 2.99Å; W257-Y261 PolarHBondContact O-N 2.6Å; W257-I262 PolarHBondContact O-N 3.19Å
258V90Very high86.1Confident54 Ų5464.4 Ų64.433%0.32731%0.313SS..Iπ-helixtrans-58.4-47.7177.9173.40000110.5A254 H255 F256 I262 K263A254-V258 WeakPolarHBondContact O-CG2 3.44Å; A254-V258 PolarHBondContact O-N 2.91Å; H255-V258 PolarHBondContact O-N 3.43Å; F256-V258 PolarHBondContact O-N 2.77Å; V258-I262 HydrophobicContact CB-CD1 4.49Å; V258-I262 HydrophobicContact CG2-CD1 4.09Å; V258-I262 WeakPolarHBondContact O-CB 3.28Å; V258-I262 PolarHBondContact O-N 2.85Å; V258-K263 PolarHBondContact O-N 3.11Å
259Q86.9Confident84.9Confident40 Ų4066.7 Ų66.719%0.18733%0.33CS..Iπ-helixtrans-71-41.2-177.7-63.9-70.9-20.300112.7H255 F256 W257 K265H255-Q259 PolarHBondContact NE2-NE2 3.25Å; H255-Q259 VanDerWaalsContact O-CG 3.3Å; H255-Q259 WeakPolarHBondContact O-CG 3.38Å; H255-Q259 PolarHBondContact O-N 3.3Å; F256-Q259 PolarHBondContact O-N 3.27Å; W257-Q259 VanDerWaalsContact C-N 3.35Å; W257-Q259 PolarHBondContact O-N 3.33Å; Q259-K265 WeakPolarHBondContact O-CB 3.34Å; Q259-K265 WeakPolarHBondContact O-CG 3.2Å; Q259-K265 PolarHBondContact O-N 3.39Å
260A83.6Confident83.3Confident1 Ų170.3 Ų70.31%0.00836%0.361CS..Iπ-helixtrans-76.5-43.2-174.200000112.7F256 W257 G264 K265 R266F256-A260 HydrophobicContact CD1-CB 4.43Å; F256-A260 HydrophobicContact CD2-CB 4.5Å; F256-A260 HydrophobicContact CE1-CB 4.06Å; F256-A260 HydrophobicContact CE2-CB 4.14Å; F256-A260 HydrophobicContact CZ-CB 3.91Å; F256-A260 WeakPolarHBondContact O-CB 3.37Å; F256-A260 PolarHBondContact O-N 3.04Å; W257-A260 PolarHBondContact O-N 3.48Å; A260-G264 CarbonylContact O-C 3.46Å; A260-K265 PolarHBondContact O-N 3.19Å; A260-R266 HydrophobicContact CB-CB 3.95Å; A260-R266 PolarHBondContact O-N 3.42Å
261Y85.3Confident81.2Confident17 Ų1773 Ų737%0.06737%0.374CS..Iπ-helixtrans-112-42.6-167.8-56-55.6000113.8K204 K205 T208 F256 W257K204-Y261 PolarHBondContact O-OH 3.43Å; K205-Y261 HydrophobicContact CD-CD1 4.27Å; K205-Y261 HydrophobicContact CG-CD1 3.73Å; K205-Y261 HydrophobicContact CG-CE1 3.72Å; K205-Y261 HydrophobicContact CG-CG 4.23Å; T208-Y261 HydrophobicContact CG2-CE2 4.07Å; T208-Y261 PolarHBondContact OG1-OH 3.05Å; F256-Y261 HydrophobicContact CE1-CE2 4.4Å; W257-Y261 HydrophobicContact CB-CD2 4.42Å; W257-Y261 AromaticContact CD2-CD2 3.61Å; W257-Y261 HydrophobicContact CD2-CD2 3.61Å; W257-Y261 HydrophobicContact CD2-CE2 4.18Å; W257-Y261 AromaticContact CE3-CD2 3.66Å; W257-Y261 HydrophobicContact CE3-CD2 3.66Å; W257-Y261 AromaticContact CE3-CE2 3.74Å; W257-Y261 HydrophobicContact CE3-CE2 3.74Å; W257-Y261 AromaticContact CG-CD2 3.98Å; W257-Y261 HydrophobicContact CG-CD2 3.98Å; W257-Y261 HydrophobicContact CZ3-CD2 4.13Å; W257-Y261 HydrophobicContact CZ3-CE2 4.07Å; W257-Y261 WeakPolarHBondContact O-CB 2.99Å; W257-Y261 PolarHBondContact O-N 2.6Å
262I86.6Confident78.6Confident118 Ų11872 Ų7261%0.60538%0.381SS*.Iπ-helixtrans-75.5-46.9179.3-57.4-178.5000109.9W257 V258 G264W257-I262 PolarHBondContact O-N 3.19Å; V258-I262 HydrophobicContact CB-CD1 4.49Å; V258-I262 HydrophobicContact CG2-CD1 4.09Å; V258-I262 WeakPolarHBondContact O-CB 3.28Å; V258-I262 PolarHBondContact O-N 2.85Å; I262-G264 VanDerWaalsContact C-N 3.28Å; I262-G264 PolarHBondContact O-N 3.23Å
263K86.8Confident76.1Confident124 Ų12480.3 Ų80.354%0.53942%0.416SS..SBendtrans-84.71.1175.1-63.2-178.8178.2177.90113.6V258 K265V258-K263 PolarHBondContact O-N 3.11Å; K263-K265 VanDerWaalsContact C-N 3.31Å; K263-K265 PolarHBondContact O-N 3.28Å
264G81.6Confident73.9Confident31 Ų3187.3 Ų87.332%0.3245%0.449SS..  trans709.5171.100000117.5A260 I262 R266A260-G264 CarbonylContact O-C 3.46Å; I262-G264 VanDerWaalsContact C-N 3.28Å; I262-G264 PolarHBondContact O-N 3.23Å; G264-R266 VanDerWaalsContact C-N 3.26Å; G264-R266 PolarHBondContact O-N 3.39Å
265K81.4Confident71.4Confident145 Ų14593.4 Ų93.463%0.6348%0.477SS*.THydrogen-bonded Turntrans-68.9-17.6-172.8-63.6179.3175.7172.80114.7Q259 A260 K263Q259-K265 WeakPolarHBondContact O-CB 3.34Å; Q259-K265 WeakPolarHBondContact O-CG 3.2Å; Q259-K265 PolarHBondContact O-N 3.39Å; A260-K265 PolarHBondContact O-N 3.19Å; K263-K265 VanDerWaalsContact C-N 3.31Å; K263-K265 PolarHBondContact O-N 3.28Å
266R76.7Confident68.8Low93 Ų9391.2 Ų91.235%0.35149%0.486SS..THydrogen-bonded Turntrans-145.439.4-174.6-61.2-174.6177.1-166.4-3.4113.3S140 K204 A260 G264S140-R266 PolarHBondContact O-NH2 3.46Å; K204-R266 PolarHBondContact NZ-O 3.42Å; A260-R266 HydrophobicContact CB-CB 3.95Å; A260-R266 PolarHBondContact O-N 3.42Å; G264-R266 VanDerWaalsContact C-N 3.26Å; G264-R266 PolarHBondContact O-N 3.39Å
267L77.6Confident66.2Low90 Ų9095.6 Ų95.647%0.47152%0.516SS..  trans-55.6152.9177.5-68173.2000112.1
268P69.3Low63.6Low39 Ų3996.4 Ų96.425%0.25354%0.538SS..  trans-57.215316924-31.3000110.4K204 A270K204-P268 HydrophobicContact CB-CB 4.33Å; K204-P268 HydrophobicContact CD-CB 4.37Å; P268-A270 PolarHBondContact O-N 3.37Å
269V67.1Low60.9Low121 Ų12199.4 Ų99.473%0.73356%0.559SS**  trans-57.1115179.4-179.20000108
270A56.2Low58.2Low81 Ų81101.9 Ų101.967%0.66959%0.586SS**PPolyproline II helixtrans-65.8134.8174.200000108.4P268P268-A270 PolarHBondContact O-N 3.37Å
271H48.3Very low55.7Low124 Ų124108.4 Ų108.457%0.57463%0.625SS**PPolyproline II helixtrans-56.9137.1165.1-68.5-77.1000108.5K199 K273K199-H271 PolarHBondContact O-CE1 3Å; K199-H271 PolarHBondContact O-NE2 3.17Å; H271-K273 PolarHBondContact O-N 3.03Å; H271-K273 VanDerWaalsContact O-N 3.12Å
272P38.7Very low53Low115 Ų115113.1 Ų113.175%0.74766%0.656SS**PPolyproline II helixtrans-54.2122.4158.8-14.727.7000106.4E274P272-E274 VanDerWaalsContact C-N 3.3Å; P272-E274 PolarHBondContact O-N 2.03Å
273K37.9Very low50.3Low208 Ų208117.1 Ų117.190%0.90467%0.669SS**  trans-65.499.1165.4-74.6-174.4175.9-175.40106.3H271H271-K273 PolarHBondContact O-N 3.03Å; H271-K273 VanDerWaalsContact O-N 3.12Å
274E40.9Very low47.4Very low171 Ų171119.1 Ų119.180%0.79968%0.68SS**  trans-74.6125.6158.8-89.9179.6155.200108P272P272-E274 VanDerWaalsContact C-N 3.3Å; P272-E274 PolarHBondContact O-N 2.03Å
275N38.9Very low44.8Very low156 Ų156124.3 Ų124.383%0.83470%0.7SS**  trans77.3135.1171.3-46.6-28.2000115.4
276G34.8Very low42.2Very low67 Ų67126.6 Ų126.669%0.69171%0.713SS**  cis173163.14.100000108.3
277V32.7Very low39.7Very low142 Ų142130 Ų13086%0.86174%0.738SS**  trans69100.9169.3-1660000116
278A34.7Very low37.2Very low87 Ų87128.7 Ų128.772%0.71975%0.746SS**  trans-63.9132.8155.400000108.8A280A278-A280 PolarHBondContact O-N 3.13Å
279P32Very low35.2Very low118 Ų118133.4 Ų133.477%0.76677%0.774SS**  trans-67.8117.5166.4-014.3000107.7T281P279-T281 PolarHBondContact O-N 3.06Å
280A31.7Very low33.2Very low92 Ų92132.2 Ų132.276%0.7678%0.777SS**  trans-62115.7167.200000108.8A278A278-A280 PolarHBondContact O-N 3.13Å
281T30.3Very low32Very low137 Ų137133.4 Ų133.484%0.8478%0.778SS**  trans-104.597.2156.1-22.10000106.6P279 K283P279-T281 PolarHBondContact O-N 3.06Å; T281-K283 PolarHBondContact O-N 3.01Å
282V28.6Very low30.7Very low116 Ų116137.7 Ų137.770%0.70379%0.791SS**  trans-65.8121167.71760000107.8
283K30.3Very low30.1Very low202 Ų202139.7 Ų139.788%0.87879%0.794SS**  trans-131110.4144.1-88.8-168.8173.8-174.80107.4T281T281-K283 PolarHBondContact O-N 3.01Å
284E26.1Very low29.5Very low166 Ų166134.4 Ų134.478%0.77678%0.784SS**  trans-41.9126.5161.8-87.1173.113300111
285L26.8Very low28.8Very low140 Ų140133.9 Ų133.973%0.73379%0.786SS**  105110.577.5-145143.5000108.6
286E26Very low28.2Very low194 Ų194129.9 Ų129.991%0.90778%0.782SS**  trans-163.2136.1135-109.3179-178.700111.3
287N25.8Very low27.7Very low165 Ų165136.4 Ų136.488%0.88279%0.791SS**  trans-64.6153.1-178.2-87.6-34.8000112.9
288G24.6Very low27.5Very low61 Ų61136 Ų13663%0.62979%0.789SS**  trans159.8102.2152.400000116.3
289T26.2Very low27Very low138 Ų138139.1 Ų139.185%0.84779%0.792SS**  trans53.7109.6139.445.50000119.9
290A25.4Very low26.9Very low97 Ų97139.1 Ų139.180%0.80279%0.79SS**  trans-65.2143.8144.900000109.2
291P30.2Very low26.7Very low105 Ų105141.8 Ų141.868%0.68279%0.791SS**  -150152.892.123.8-0.1000117.5
292Y22.9Very low26.5Very low215 Ų215144.5 Ų144.584%0.84379%0.792SS**  trans66130.5141.2-83.4-93.2000124.4
293L25.8Very low26.7Very low156 Ų156145.2 Ų145.282%0.81780%0.796SS**  trans72.7123.9142.5-80.6154.1000122.6
294S25.2Very low26.6Very low98 Ų98145.5 Ų145.569%0.68580%0.797SS**  143.1117.5114.41770000115.2
295N26.1Very low26.7Very low159 Ų159145.8 Ų145.885%0.8580%0.799SS**  trans44.9116.7144.2-70.5-20.8000122.7
296G25.4Very low27.1Very low72 Ų72150.6 Ų150.674%0.74282%0.822SS**  87.5104.8107.400000119.1
297K25.4Very low27.2Very low205 Ų205148.4 Ų148.489%0.89182%0.818SS**  177.3113.8123.6-99.6169.1-177.5176.30111.2
298V27.2Very low27.3Very low134 Ų134147.5 Ų147.581%0.81282%0.815SS**  trans-83.2112.7163.6178.20000107.4V300V298-V300 HydrophobicContact CG1-CG2 3.87Å; V298-V300 PolarHBondContact O-N 3.2Å
299L26Very low27.4Very low151 Ų151152.3 Ų152.379%0.79183%0.825SS**  trans-85.792.3168.4-94.9158.8000109.1N301L299-N301 PolarHBondContact O-N 3.33Å
300V27.9Very low27.5Very low118 Ų118153.2 Ų153.272%0.71582%0.824SS**  trans-72.7101.4162.5-178.60000107.2V298 K302V298-V300 HydrophobicContact CG1-CG2 3.87Å; V298-V300 PolarHBondContact O-N 3.2Å; V300-K302 PolarHBondContact O-N 3.02Å; V300-K302 VanDerWaalsContact O-N 3.15Å
301N27.5Very low27.6Very low148 Ų148156.7 Ų156.779%0.79183%0.825SS**  trans-73.7108.4171.9-90.7-20.2000109.8L299L299-N301 PolarHBondContact O-N 3.33Å
302K27.1Very low27.4Very low195 Ų195160.1 Ų160.185%0.84884%0.835SS**  trans-53.2135.5171.1-81.5177.9171.5179.50111.7V300V300-K302 PolarHBondContact O-N 3.02Å; V300-K302 VanDerWaalsContact O-N 3.15Å
303V32.3Very low27.8Very low131 Ų131156.2 Ų156.279%0.79483%0.834SS**  trans-54129.8157.2175.60000109
304K28.8Very low27.9Very low207 Ų207156.2 Ų156.290%0.984%0.835SS**  trans-96.3105.7161.5-104.3-175.9173.7-176.90108.1
305E27.4Very low28.1Very low173 Ų173161.1 Ų161.181%0.80885%0.848SS**  trans-64.2138.8138.6-63173.9154.900105.4
306I36.6Very low28.3Very low240 Ų240161.3 Ų161.3100%1.23185%0.848SS**  cis-144.6042.6-66.3163.1000107.3

Retrieved 306 of 306 residues in 417.2 ms (Link to these results)

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