A0A087Y209_POEFO Loading...

Solute carrier family 66 member 3

AlphaFold DB , UniProt , Accession A0A087Y209, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 207 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
1M55.8Low75.5Confident191 Ų19186.9 Ų86.994%0.94145%0.454SS*.  0-65.10-74.9-164.8176.300112.1D4 T5M1-D4 VanDerWaalsContact CA-OD2 3.27Å; M1-D4 WeakPolarHBondContact CA-OD2 3.43Å; M1-D4 PolarHBondContact N-OD2 3.36Å; M1-D4 PolarHBondContact O-N 3.26Å; M1-T5 PolarHBondContact O-N 2.98Å; M1-T5 PolarHBondContact O-OG1 3.04Å; M1-T5 VanDerWaalsContact O-OG1 3.08Å
2Q63.2Low76.2Confident167 Ų16791.8 Ų91.878%0.7847%0.469SS*.Hα-helixtrans-71.4-33.5-176.4-152.7154.40.600113.7L6Q2-L6 WeakPolarHBondContact O-CG 3.34Å; Q2-L6 PolarHBondContact O-N 3.36Å
3S63Low76.8Confident60 Ų6086.8 Ų86.842%0.4245%0.447SS..Hα-helixtrans-61.6-41.2170.748.10000112.8L6 L7S3-L6 PolarHBondContact O-N 3.12Å; S3-L7 WeakPolarHBondContact O-CB 3.44Å; S3-L7 PolarHBondContact O-N 3.25Å
4D75Confident77.1Confident81 Ų8180.6 Ų80.643%0.43342%0.415SS..Hα-helixtrans-69.9-40.9-176.5-47.8-48.2000110.6M1 L6 L7 H8M1-D4 VanDerWaalsContact CA-OD2 3.27Å; M1-D4 WeakPolarHBondContact CA-OD2 3.43Å; M1-D4 PolarHBondContact N-OD2 3.36Å; M1-D4 PolarHBondContact O-N 3.26Å; D4-L6 PolarHBondContact O-N 3.4Å; D4-L7 WeakPolarHBondContact O-CB 3.5Å; D4-L7 PolarHBondContact O-N 2.93Å; D4-H8 PolarHBondContact O-CD2 2.88Å; D4-H8 PolarHBondContact O-N 3.18Å
5T80.7Confident77.5Confident82 Ų8277.9 Ų77.950%0.50340%0.401SS..Hα-helixtrans-61.5-44.1175.2-48.90000111.9M1 L7 H8 I9M1-T5 PolarHBondContact O-N 2.98Å; M1-T5 PolarHBondContact O-OG1 3.04Å; M1-T5 VanDerWaalsContact O-OG1 3.08Å; T5-L7 VanDerWaalsContact C-N 3.34Å; T5-L7 PolarHBondContact O-N 2.96Å; T5-H8 PolarHBondContact O-N 3.05Å; T5-I9 HydrophobicContact CG2-CD1 3.94Å; T5-I9 VanDerWaalsContact O-CG1 3.24Å; T5-I9 WeakPolarHBondContact O-CG1 3.13Å; T5-I9 PolarHBondContact O-N 3.4Å
6L80.9Confident77.8Confident97 Ų9780.7 Ų80.751%0.50841%0.41SS..Hα-helixtrans-64.1-39.5176.9-72172.7000112Q2 S3 D4 I9 A10 Y163Q2-L6 WeakPolarHBondContact O-CG 3.34Å; Q2-L6 PolarHBondContact O-N 3.36Å; S3-L6 PolarHBondContact O-N 3.12Å; D4-L6 PolarHBondContact O-N 3.4Å; L6-I9 PolarHBondContact O-N 3.3Å; L6-A10 WeakPolarHBondContact O-CB 3.09Å; L6-A10 PolarHBondContact O-N 3.32Å; L6-Y163 HydrophobicContact CB-CE1 4.39Å
7L82.1Confident77.9Confident25 Ų2578.5 Ų78.513%0.13140%0.4CS..Hα-helixtrans-61.3-46.1175.9-169.883.9000111.7S3 D4 T5 A10 N11 Y163 T164 V167 T168S3-L7 WeakPolarHBondContact O-CB 3.44Å; S3-L7 PolarHBondContact O-N 3.25Å; D4-L7 WeakPolarHBondContact O-CB 3.5Å; D4-L7 PolarHBondContact O-N 2.93Å; T5-L7 VanDerWaalsContact C-N 3.34Å; T5-L7 PolarHBondContact O-N 2.96Å; L7-A10 PolarHBondContact O-N 2.86Å; L7-N11 PolarHBondContact O-N 2.99Å; L7-N11 PolarHBondContact O-ND2 3.24Å; L7-Y163 HydrophobicContact CD1-CE1 4.48Å; L7-T164 HydrophobicContact CD1-CG2 4.04Å; L7-V167 HydrophobicContact CD1-CB 4.06Å; L7-V167 HydrophobicContact CD1-CG1 3.97Å; L7-T168 HydrophobicContact CD1-CG2 3.87Å; L7-T168 HydrophobicContact CD2-CG2 3.93Å; L7-T168 HydrophobicContact CG-CG2 4.44Å
8H81.3Confident77.8Confident127 Ų12774.6 Ų74.659%0.58838%0.38SS*.Hα-helixtrans-64.5-43.5177.9-72.8-59.1000112D4 T5 A10 N11 F12D4-H8 PolarHBondContact O-CD2 2.88Å; D4-H8 PolarHBondContact O-N 3.18Å; T5-H8 PolarHBondContact O-N 3.05Å; H8-A10 VanDerWaalsContact C-N 3.34Å; H8-A10 PolarHBondContact O-N 3.03Å; H8-N11 PolarHBondContact O-N 3.35Å; H8-F12 VanDerWaalsContact O-CB 3.24Å; H8-F12 WeakPolarHBondContact O-CB 3.39Å; H8-F12 PolarHBondContact O-N 3.49Å
9I83.8Confident77.7Confident99 Ų9974.7 Ų74.751%0.50838%0.38SS..Hα-helixtrans-61-44.1177.1-69.4167.3000110.7T5 L6 F12 S13T5-I9 HydrophobicContact CG2-CD1 3.94Å; T5-I9 VanDerWaalsContact O-CG1 3.24Å; T5-I9 WeakPolarHBondContact O-CG1 3.13Å; T5-I9 PolarHBondContact O-N 3.4Å; L6-I9 PolarHBondContact O-N 3.3Å; I9-F12 PolarHBondContact O-N 3.47Å; I9-S13 VanDerWaalsContact O-CB 3.28Å; I9-S13 WeakPolarHBondContact O-CB 3.29Å; I9-S13 PolarHBondContact O-N 3.37Å; I9-S13 PolarHBondContact O-OG 2.97Å
10A80.9Confident77.4Confident12 Ų1274.7 Ų74.710%0.09938%0.383CS..Hα-helixtrans-66-43.6179.800000113L6 L7 H8 S13 T14 T164L6-A10 WeakPolarHBondContact O-CB 3.09Å; L6-A10 PolarHBondContact O-N 3.32Å; L7-A10 PolarHBondContact O-N 2.86Å; H8-A10 VanDerWaalsContact C-N 3.34Å; H8-A10 PolarHBondContact O-N 3.03Å; A10-S13 PolarHBondContact O-OG 3.43Å; A10-S13 VanDerWaalsContact O-OG 3.11Å; A10-T14 WeakPolarHBondContact O-CB 3.35Å; A10-T14 WeakPolarHBondContact O-CG2 3.32Å; A10-T14 PolarHBondContact O-N 2.98Å; A10-T14 VanDerWaalsContact O-N 3.1Å; A10-T14 PolarHBondContact O-OG1 3.32Å; A10-T164 HydrophobicContact CB-CG2 3.9Å
11N84.1Confident77Confident15 Ų1574 Ų748%0.0838%0.381CS..Hα-helixtrans-65.8-41.1175.7-73.9-59.7000111.3L7 H8 T14 L15 P65L7-N11 PolarHBondContact O-N 2.99Å; L7-N11 PolarHBondContact O-ND2 3.24Å; H8-N11 PolarHBondContact O-N 3.35Å; N11-T14 PolarHBondContact O-OG1 2.84Å; N11-L15 VanDerWaalsContact O-CB 3.28Å; N11-L15 WeakPolarHBondContact O-CB 3.46Å; N11-L15 PolarHBondContact O-N 3.34Å; N11-P65 HydrophobicContact CB-CB 4.46Å; N11-P65 PolarHBondContact OD1-O 2.96Å; N11-P65 VanDerWaalsContact OD1-O 3.14Å
12F83.6Confident77.8Confident146 Ų14665.4 Ų65.464%0.6434%0.338SS*.Hα-helixtrans-68.3-42.8178.9-170.9-97.2000112.3H8 I9 T14 L15 F16H8-F12 VanDerWaalsContact O-CB 3.24Å; H8-F12 WeakPolarHBondContact O-CB 3.39Å; H8-F12 PolarHBondContact O-N 3.49Å; I9-F12 PolarHBondContact O-N 3.47Å; F12-T14 PolarHBondContact O-N 3.36Å; F12-L15 PolarHBondContact O-N 2.86Å; F12-F16 WeakPolarHBondContact O-CB 3.34Å; F12-F16 PolarHBondContact O-N 2.93Å
13S84.4Confident78.2Confident26 Ų2663.2 Ų63.218%0.18233%0.326CS..Hα-helixtrans-64.1-42.317970.70000111.7I9 A10 F16 L17 Y156I9-S13 VanDerWaalsContact O-CB 3.28Å; I9-S13 WeakPolarHBondContact O-CB 3.29Å; I9-S13 PolarHBondContact O-N 3.37Å; I9-S13 PolarHBondContact O-OG 2.97Å; A10-S13 PolarHBondContact O-OG 3.43Å; A10-S13 VanDerWaalsContact O-OG 3.11Å; S13-F16 PolarHBondContact O-N 3.27Å; S13-L17 WeakPolarHBondContact O-CB 3.02Å; S13-L17 VanDerWaalsContact O-CG 3.28Å; S13-L17 WeakPolarHBondContact O-CG 3.47Å; S13-L17 PolarHBondContact O-N 3.4Å; S13-Y156 PolarHBondContact OG-OH 3.07Å
14T80.6Confident78.5Confident0 Ų064.1 Ų64.10%033%0.33CS..Hα-helixtrans-66.3-42.8176.450.50000111.9A10 N11 F12 F16 L17 C18 T157 A160 R161A10-T14 WeakPolarHBondContact O-CB 3.35Å; A10-T14 WeakPolarHBondContact O-CG2 3.32Å; A10-T14 PolarHBondContact O-N 2.98Å; A10-T14 VanDerWaalsContact O-N 3.1Å; A10-T14 PolarHBondContact O-OG1 3.32Å; N11-T14 PolarHBondContact O-OG1 2.84Å; F12-T14 PolarHBondContact O-N 3.36Å; T14-F16 PolarHBondContact O-N 3.11Å; T14-L17 PolarHBondContact O-N 3.01Å; T14-C18 WeakPolarHBondContact O-CB 3.38Å; T14-C18 PolarHBondContact O-N 3.1Å; T14-C18 PolarHBondContact O-SG 3.27Å; T14-T157 HydrophobicContact CG2-CG2 4.08Å; T14-A160 HydrophobicContact CG2-CB 3.57Å; T14-R161 PolarHBondContact OG1-NH2 2.9Å
15L83Confident78.1Confident40 Ų4064.4 Ų64.421%0.20933%0.329CS..Hα-helixtrans-60.2-45.5175.5-175.5147.8000111.9N11 F12 C18 M19 L68 I72N11-L15 VanDerWaalsContact O-CB 3.28Å; N11-L15 WeakPolarHBondContact O-CB 3.46Å; N11-L15 PolarHBondContact O-N 3.34Å; F12-L15 PolarHBondContact O-N 2.86Å; L15-C18 PolarHBondContact O-N 3.5Å; L15-M19 HydrophobicContact CD2-CE 3.79Å; L15-M19 HydrophobicContact CD2-SD 4.12Å; L15-M19 WeakPolarHBondContact O-CG 3.38Å; L15-M19 PolarHBondContact O-N 3.31Å; L15-L68 HydrophobicContact CD1-CB 4.33Å; L15-I72 HydrophobicContact CD1-CD1 4.47Å; L15-I72 HydrophobicContact CG-CD1 4.35Å
16F82.8Confident77.8Confident123 Ų12361.5 Ų61.554%0.53931%0.31SS..Hα-helixtrans-63.8-44.8177.7-176.2-97.8000112.3F12 S13 T14 C18 M19 V20F12-F16 WeakPolarHBondContact O-CB 3.34Å; F12-F16 PolarHBondContact O-N 2.93Å; S13-F16 PolarHBondContact O-N 3.27Å; T14-F16 PolarHBondContact O-N 3.11Å; F16-C18 PolarHBondContact O-N 2.96Å; F16-M19 WeakPolarHBondContact O-CB 3.31Å; F16-M19 PolarHBondContact O-N 2.92Å; F16-V20 HydrophobicContact CE1-CG2 4.31Å; F16-V20 HydrophobicContact CZ-CG2 4.27Å; F16-V20 WeakPolarHBondContact O-CG2 3.31Å; F16-V20 PolarHBondContact O-N 3.48Å
17L80.1Confident77.3Confident44 Ų4462.8 Ų62.823%0.2331%0.312CS..Hα-helixtrans-60-47.1176.3-76.5166.6000111.5S13 T14 M19 V20 L21 M153 Y156S13-L17 WeakPolarHBondContact O-CB 3.02Å; S13-L17 VanDerWaalsContact O-CG 3.28Å; S13-L17 WeakPolarHBondContact O-CG 3.47Å; S13-L17 PolarHBondContact O-N 3.4Å; T14-L17 PolarHBondContact O-N 3.01Å; L17-M19 VanDerWaalsContact C-N 3.32Å; L17-M19 PolarHBondContact O-N 2.98Å; L17-V20 PolarHBondContact O-N 3.48Å; L17-V20 VanDerWaalsContact O-N 3.15Å; L17-L21 WeakPolarHBondContact O-CB 3.48Å; L17-L21 WeakPolarHBondContact O-CD1 3.05Å; L17-L21 WeakPolarHBondContact O-CG 3.36Å; L17-L21 PolarHBondContact O-N 3.36Å; L17-M153 HydrophobicContact CD2-SD 4.35Å; L17-Y156 HydrophobicContact CD1-CD1 3.76Å; L17-Y156 HydrophobicContact CD1-CE1 3.7Å
18C75.7Confident76.8Confident8 Ų866.1 Ų66.15%0.05433%0.333CS..Hα-helixtrans-62-37.6178.4-72.90000112.5T14 L15 F16 V20 E69 L73 Q76T14-C18 WeakPolarHBondContact O-CB 3.38Å; T14-C18 PolarHBondContact O-N 3.1Å; T14-C18 PolarHBondContact O-SG 3.27Å; L15-C18 PolarHBondContact O-N 3.5Å; F16-C18 PolarHBondContact O-N 2.96Å; C18-V20 VanDerWaalsContact C-N 3.32Å; C18-V20 PolarHBondContact O-N 2.97Å; C18-E69 HydrophobicContact CB-CB 4.05Å; C18-L73 HydrophobicContact CB-CD1 4.1Å; C18-L73 HydrophobicContact CB-CD2 3.91Å; C18-L73 HydrophobicContact CB-CG 4.04Å; C18-L73 WeakPolarHBondContact O-CD2 3.49Å; C18-Q76 PolarHBondContact O-OE1 3.42Å
19M74.7Confident76.3Confident76 Ų7660.3 Ų60.337%0.37431%0.306SS..Hα-helixtrans-58.6-43.5173.2-82.3-172.8174.500112L15 F16 L17 F23 I72 Q76L15-M19 HydrophobicContact CD2-CE 3.79Å; L15-M19 HydrophobicContact CD2-SD 4.12Å; L15-M19 WeakPolarHBondContact O-CG 3.38Å; L15-M19 PolarHBondContact O-N 3.31Å; F16-M19 WeakPolarHBondContact O-CB 3.31Å; F16-M19 PolarHBondContact O-N 2.92Å; L17-M19 VanDerWaalsContact C-N 3.32Å; L17-M19 PolarHBondContact O-N 2.98Å; M19-F23 WeakPolarHBondContact O-CD2 3.29Å; M19-F23 WeakPolarHBondContact O-CE2 3.31Å; M19-I72 HydrophobicContact CE-CD1 3.61Å; M19-I72 HydrophobicContact CG-CD1 4.39Å; M19-I72 HydrophobicContact CG-CG2 4.02Å; M19-Q76 PolarHBondContact O-NE2 3.38Å
20V72.8Confident75.7Confident74 Ų7459.6 Ų59.645%0.44830%0.302SS..Hα-helixtrans-83.8-25.8-172.2-177.50000112.8F16 L17 C18 K22 F23 P24F16-V20 HydrophobicContact CE1-CG2 4.31Å; F16-V20 HydrophobicContact CZ-CG2 4.27Å; F16-V20 WeakPolarHBondContact O-CG2 3.31Å; F16-V20 PolarHBondContact O-N 3.48Å; L17-V20 PolarHBondContact O-N 3.48Å; L17-V20 VanDerWaalsContact O-N 3.15Å; C18-V20 VanDerWaalsContact C-N 3.32Å; C18-V20 PolarHBondContact O-N 2.97Å; V20-K22 PolarHBondContact O-N 2.96Å; V20-F23 PolarHBondContact O-N 3.03Å; V20-P24 WeakPolarHBondContact O-CD 3.35Å
21L69.7Low75.4Confident62 Ų6268.8 Ų68.833%0.32533%0.334SS..Hα-helixtrans-58.2-37.8-167.7-92.9163.7000115.5L17 M153L17-L21 WeakPolarHBondContact O-CB 3.48Å; L17-L21 WeakPolarHBondContact O-CD1 3.05Å; L17-L21 WeakPolarHBondContact O-CG 3.36Å; L17-L21 PolarHBondContact O-N 3.36Å; L21-M153 HydrophobicContact CD2-CE 4.1Å; L21-M153 HydrophobicContact CD2-SD 4.47Å
22K71Confident74.6Confident10 Ų1070.5 Ų70.54%0.04335%0.35CS..THydrogen-bonded Turntrans-90.6-14.2-175.8-64.8-79.8178.91490113.8V20 Q25 I26 E46 Q76 D77 L80V20-K22 PolarHBondContact O-N 2.96Å; K22-Q25 WeakPolarHBondContact O-CB 3.29Å; K22-Q25 PolarHBondContact O-N 3.33Å; K22-Q25 VanDerWaalsContact O-N 3.1Å; K22-I26 WeakPolarHBondContact O-CG1 3.19Å; K22-I26 PolarHBondContact O-N 2.99Å; K22-E46 VanDerWaalsContact CE-OE1 3.24Å; K22-E46 WeakPolarHBondContact CE-OE1 3.36Å; K22-E46 IonicContact NZ-OE1 2.74Å; K22-E46 PolarHBondContact NZ-OE1 3.42Å; K22-E46 IonicContact NZ-OE2 3.43Å; K22-E46 PolarHBondContact NZ-OE2 3.49Å; K22-Q76 HydrophobicContact CB-CB 4.16Å; K22-Q76 HydrophobicContact CG-CB 4.35Å; K22-D77 WeakPolarHBondContact CD-OD1 3.47Å; K22-D77 WeakPolarHBondContact CE-OD1 3.39Å; K22-D77 IonicContact NZ-OD1 2.7Å; K22-D77 PolarHBondContact NZ-OD1 3.15Å; K22-D77 IonicContact NZ-OD2 3.21Å; K22-D77 PolarHBondContact NZ-OD2 3.42Å; K22-L80 HydrophobicContact CB-CD1 4.44Å; K22-L80 HydrophobicContact CD-CD1 4.01Å
23F72.4Confident73.9Confident120 Ų12070.9 Ų70.953%0.52635%0.352SS..Hα-helixtrans-57.4-43.2-179.9-82.1-80.6000114.2M19 V20 Q25 I26 F27M19-F23 WeakPolarHBondContact O-CD2 3.29Å; M19-F23 WeakPolarHBondContact O-CE2 3.31Å; V20-F23 PolarHBondContact O-N 3.03Å; F23-Q25 VanDerWaalsContact C-N 3.28Å; F23-Q25 PolarHBondContact O-N 3.47Å; F23-I26 PolarHBondContact O-N 2.93Å; F23-F27 WeakPolarHBondContact O-CB 3.45Å; F23-F27 PolarHBondContact O-N 2.86Å
24P68.6Low72.8Confident79 Ų7978.2 Ų78.251%0.51338%0.375SS..Hα-helixtrans-60-38.9175.7-24.534.4000112.6V20 F27 V28V20-P24 WeakPolarHBondContact O-CD 3.35Å; P24-F27 PolarHBondContact O-N 3.3Å; P24-V28 WeakPolarHBondContact O-CB 3.29Å; P24-V28 VanDerWaalsContact O-CG2 3.25Å; P24-V28 WeakPolarHBondContact O-CG2 3.3Å; P24-V28 PolarHBondContact O-N 2.83Å
25Q68.2Low71.8Confident88 Ų8879.4 Ų79.441%0.41138%0.384SS..Hα-helixtrans-66.4-43.7178.4-63.8-177.74.100111.3K22 F23 F27 V28 L29K22-Q25 WeakPolarHBondContact O-CB 3.29Å; K22-Q25 PolarHBondContact O-N 3.33Å; K22-Q25 VanDerWaalsContact O-N 3.1Å; F23-Q25 VanDerWaalsContact C-N 3.28Å; F23-Q25 PolarHBondContact O-N 3.47Å; Q25-F27 PolarHBondContact O-N 2.89Å; Q25-V28 PolarHBondContact O-N 3.41Å; Q25-L29 WeakPolarHBondContact O-CB 3.47Å; Q25-L29 PolarHBondContact O-N 3.29Å
26I72.4Confident70.4Confident21 Ų2183.3 Ų83.311%0.10841%0.409CS..Hα-helixtrans-60.5-46.5175.9-65166.4000110.4K22 F23 L29 M30 L80 L83K22-I26 WeakPolarHBondContact O-CG1 3.19Å; K22-I26 PolarHBondContact O-N 2.99Å; F23-I26 PolarHBondContact O-N 2.93Å; I26-L29 PolarHBondContact O-N 3.45Å; I26-M30 HydrophobicContact CG2-CE 4.04Å; I26-M30 HydrophobicContact CG2-CG 4.46Å; I26-M30 HydrophobicContact CG2-SD 4.31Å; I26-M30 WeakPolarHBondContact O-CG 3.44Å; I26-M30 PolarHBondContact O-N 3.25Å; I26-L80 HydrophobicContact CB-CD2 4.26Å; I26-L80 HydrophobicContact CD1-CG 4.39Å; I26-L80 HydrophobicContact CG1-CD1 4.14Å; I26-L80 HydrophobicContact CG1-CD2 3.51Å; I26-L80 HydrophobicContact CG1-CG 3.6Å; I26-L83 HydrophobicContact CG2-CD1 4.1Å
27F72Confident69.2Low124 Ų12481.4 Ų81.454%0.54442%0.424SS..Hα-helixtrans-64.3-43.5-178.9-172.9-98.9000112.6F23 P24 Q25 L29 M30 R31F23-F27 WeakPolarHBondContact O-CB 3.45Å; F23-F27 PolarHBondContact O-N 2.86Å; P24-F27 PolarHBondContact O-N 3.3Å; Q25-F27 PolarHBondContact O-N 2.89Å; F27-L29 VanDerWaalsContact C-N 3.34Å; F27-L29 PolarHBondContact O-N 2.94Å; F27-M30 HydrophobicContact CD2-CE 4.33Å; F27-M30 PolarHBondContact O-N 3.34Å; F27-R31 WeakPolarHBondContact O-CB 3.46Å; F27-R31 PolarHBondContact O-N 3.5Å
28V71.2Confident68.4Low95 Ų9581.5 Ų81.558%0.57643%0.425SS*.Hα-helixtrans-61.4-44.5176.1169.70000110.8P24 Q25 R31 A32P24-V28 WeakPolarHBondContact O-CB 3.29Å; P24-V28 VanDerWaalsContact O-CG2 3.25Å; P24-V28 WeakPolarHBondContact O-CG2 3.3Å; P24-V28 PolarHBondContact O-N 2.83Å; Q25-V28 PolarHBondContact O-N 3.41Å; V28-R31 PolarHBondContact O-N 2.89Å; V28-A32 VanDerWaalsContact O-CB 3.31Å; V28-A32 WeakPolarHBondContact O-CB 3.38Å; V28-A32 PolarHBondContact O-N 3.36Å
29L70.5Confident68.2Low4 Ų484.4 Ų84.42%0.02145%0.445CS..Hα-helixtrans-62-46.7178.4-17766.2000111.9Q25 I26 F27 R31 A32 K33 R34 I38 L80 L83 I84 Y87Q25-L29 WeakPolarHBondContact O-CB 3.47Å; Q25-L29 PolarHBondContact O-N 3.29Å; I26-L29 PolarHBondContact O-N 3.45Å; F27-L29 VanDerWaalsContact C-N 3.34Å; F27-L29 PolarHBondContact O-N 2.94Å; L29-R31 VanDerWaalsContact C-N 3.3Å; L29-R31 PolarHBondContact O-N 3.33Å; L29-A32 PolarHBondContact O-N 3.09Å; L29-K33 PolarHBondContact O-N 3.41Å; L29-R34 WeakPolarHBondContact CD1-O 3.46Å; L29-I38 HydrophobicContact CB-CD1 4.22Å; L29-I38 HydrophobicContact CD1-CD1 4.3Å; L29-I38 HydrophobicContact CD2-CD1 4.5Å; L29-L80 HydrophobicContact CD2-CD2 3.99Å; L29-L83 HydrophobicContact CD2-CB 3.66Å; L29-L83 HydrophobicContact CD2-CD1 4.41Å; L29-I84 HydrophobicContact CD1-CG1 4.26Å; L29-I84 HydrophobicContact CD2-CG1 3.69Å; L29-Y87 HydrophobicContact CD1-CD2 4.34Å; L29-Y87 HydrophobicContact CG-CD2 4.21Å; L29-Y87 HydrophobicContact CG-CE2 4.15Å
30M72.1Confident68.2Low85 Ų8582.8 Ų82.842%0.41944%0.438SS..Hα-helixtrans-61.1-39.4177-71.9-169.4-56.500112.1I26 F27 K33 L83I26-M30 HydrophobicContact CG2-CE 4.04Å; I26-M30 HydrophobicContact CG2-CG 4.46Å; I26-M30 HydrophobicContact CG2-SD 4.31Å; I26-M30 WeakPolarHBondContact O-CG 3.44Å; I26-M30 PolarHBondContact O-N 3.25Å; F27-M30 HydrophobicContact CD2-CE 4.33Å; F27-M30 PolarHBondContact O-N 3.34Å; M30-K33 WeakPolarHBondContact O-CG 3.46Å; M30-L83 HydrophobicContact CG-CD1 4.31Å
31R73.2Confident68.2Low205 Ų20584.8 Ų84.877%0.77445%0.446SS*.Hα-helixtrans-71.1-39.2179-170.4176.3-177.9176.91.4112.3F27 V28 L29 K33F27-R31 WeakPolarHBondContact O-CB 3.46Å; F27-R31 PolarHBondContact O-N 3.5Å; V28-R31 PolarHBondContact O-N 2.89Å; L29-R31 VanDerWaalsContact C-N 3.3Å; L29-R31 PolarHBondContact O-N 3.33Å; R31-K33 VanDerWaalsContact C-N 3.31Å
32A68.7Low68.3Low51 Ų5185 Ų8542%0.42145%0.453SS..Hα-helixtrans-72.6-24.7179.300000112.8V28 L29 R34V28-A32 VanDerWaalsContact O-CB 3.31Å; V28-A32 WeakPolarHBondContact O-CB 3.38Å; V28-A32 PolarHBondContact O-N 3.36Å; L29-A32 PolarHBondContact O-N 3.09Å; A32-R34 PolarHBondContact O-N 3.07Å
33K68.1Low68.8Low153 Ų15384.9 Ų84.967%0.66545%0.452SS*.THydrogen-bonded Turntrans4923.4-173.4-64.3-173177.8-177.70113.6L29 M30 R31 Y87L29-K33 PolarHBondContact O-N 3.41Å; M30-K33 WeakPolarHBondContact O-CG 3.46Å; R31-K33 VanDerWaalsContact C-N 3.31Å; K33-Y87 HydrophobicContact CB-CD1 4.49Å; K33-Y87 HydrophobicContact CB-CE1 4.23Å; K33-Y87 HydrophobicContact CG-CE1 4.36Å
34R61.3Low69.2Low180 Ų18080.4 Ų80.468%0.67943%0.434SS*.SBendtrans-148.4143.3-178.9-66.9-172177.6-161-0.7107.4L29 A32 T36L29-R34 WeakPolarHBondContact CD1-O 3.46Å; A32-R34 PolarHBondContact O-N 3.07Å; R34-T36 WeakPolarHBondContact CB-OG1 3.25Å; R34-T36 PolarHBondContact O-N 3.31Å; R34-T36 VanDerWaalsContact O-N 3.11Å
35S59.8Low69.8Low26 Ų2680.9 Ų80.918%0.18243%0.432CS..  trans-76.512.2178.867.60000114.1G37 I38 N88S35-G37 PolarHBondContact O-N 3.03Å; S35-G37 VanDerWaalsContact O-N 3.09Å; S35-I38 PolarHBondContact O-N 3.21Å; S35-N88 PolarHBondContact OG-ND2 3.41Å; S35-N88 PolarHBondContact OG-OD1 3.2Å; S35-N88 VanDerWaalsContact OG-OD1 3.05Å
36T53.8Low70.5Confident121 Ų12179.8 Ų79.874%0.74243%0.427SS*.THydrogen-bonded Turntrans-65.6111-175.2-180000109.8R34R34-T36 WeakPolarHBondContact CB-OG1 3.25Å; R34-T36 PolarHBondContact O-N 3.31Å; R34-T36 VanDerWaalsContact O-N 3.11Å
37G56.5Low71.1Confident83 Ų8378.8 Ų78.886%0.85642%0.421SS*.THydrogen-bonded Turntrans113.5-9.8176.400000115.9S35S35-G37 PolarHBondContact O-N 3.03Å; S35-G37 VanDerWaalsContact O-N 3.09Å
38I64.7Low71.7Confident46 Ų4677.2 Ų77.224%0.23642%0.418CS..  trans-111.7118.5174-56.8179000109.2L29 S35 L40 I84L29-I38 HydrophobicContact CB-CD1 4.22Å; L29-I38 HydrophobicContact CD1-CD1 4.3Å; L29-I38 HydrophobicContact CD2-CD1 4.5Å; S35-I38 PolarHBondContact O-N 3.21Å; I38-L40 PolarHBondContact O-N 3.44Å; I38-I84 HydrophobicContact CB-CD1 4.25Å; I38-I84 HydrophobicContact CG2-CD1 3.78Å
39S71.3Confident72.5Confident69 Ų6973 Ų7348%0.48339%0.394SS..  trans-75.8113.2177.3175.80000110.7N41 S42 L43S39-N41 VanDerWaalsContact C-N 3.26Å; S39-N41 PolarHBondContact O-N 3.46Å; S39-S42 WeakPolarHBondContact O-CB 3.41Å; S39-S42 PolarHBondContact O-N 3.04Å; S39-S42 VanDerWaalsContact O-N 3.12Å; S39-S42 PolarHBondContact OG-N 3.1Å; S39-L43 PolarHBondContact O-N 3.5Å; S39-L43 VanDerWaalsContact O-N 3.07Å
40L74Confident73.3Confident42 Ų4274.1 Ų74.122%0.2240%0.398CS..Hα-helixtrans-53.1-43.8174-85.7174.1000112.3I38 S42 L43 L44 L81 I84I38-L40 PolarHBondContact O-N 3.44Å; L40-S42 VanDerWaalsContact C-N 3.3Å; L40-S42 PolarHBondContact O-N 3.29Å; L40-L43 PolarHBondContact O-N 3.43Å; L40-L44 WeakPolarHBondContact O-CG 3.45Å; L40-L44 PolarHBondContact O-N 2.91Å; L40-L81 HydrophobicContact CD2-CD1 3.8Å; L40-I84 HydrophobicContact CD1-CG2 3.98Å; L40-I84 HydrophobicContact CD2-CB 3.94Å; L40-I84 HydrophobicContact CD2-CD1 4Å; L40-I84 HydrophobicContact CD2-CG2 3.34Å; L40-I84 HydrophobicContact CG-CG2 3.68Å
41N73.4Confident74.1Confident116 Ų11670.9 Ų70.962%0.6238%0.383SS*.Hα-helixtrans-65-36.7-179.5-67.7-9.7000111.7S39 L45S39-N41 VanDerWaalsContact C-N 3.26Å; S39-N41 PolarHBondContact O-N 3.46Å; N41-L45 WeakPolarHBondContact O-CB 3.47Å; N41-L45 PolarHBondContact O-N 3.03Å
42S71.6Confident74.8Confident68 Ų6861.6 Ų61.648%0.47635%0.348SS..Hα-helixtrans-66.8-41.4175.8-168.80000111.6S39 L40 L45 E46S39-S42 WeakPolarHBondContact O-CB 3.41Å; S39-S42 PolarHBondContact O-N 3.04Å; S39-S42 VanDerWaalsContact O-N 3.12Å; S39-S42 PolarHBondContact OG-N 3.1Å; L40-S42 VanDerWaalsContact C-N 3.3Å; L40-S42 PolarHBondContact O-N 3.29Å; S42-L45 PolarHBondContact O-N 3.07Å; S42-E46 WeakPolarHBondContact O-CB 3.33Å; S42-E46 PolarHBondContact O-N 3.45Å
43L80.5Confident75.7Confident6 Ų659.1 Ų59.13%0.03133%0.328CS..Hα-helixtrans-64.6-43.2177.3-176.767.3000111.5S39 L40 E46 L47 D77 L80 L81 I84S39-L43 PolarHBondContact O-N 3.5Å; S39-L43 VanDerWaalsContact O-N 3.07Å; L40-L43 PolarHBondContact O-N 3.43Å; L43-E46 PolarHBondContact O-N 2.93Å; L43-L47 WeakPolarHBondContact O-CB 3.44Å; L43-L47 PolarHBondContact O-N 3.36Å; L43-D77 HydrophobicContact CD1-CB 3.87Å; L43-L80 HydrophobicContact CD1-CB 4.36Å; L43-L80 HydrophobicContact CD1-CD1 4.45Å; L43-L80 HydrophobicContact CD2-CB 4.01Å; L43-L81 HydrophobicContact CD2-CB 3.85Å; L43-L81 HydrophobicContact CD2-CD1 4.24Å; L43-I84 HydrophobicContact CD2-CD1 3.88Å
44L82.3Confident76.7Confident26 Ų2652.1 Ų52.114%0.13630%0.298CS..Hα-helixtrans-64.2-41.5176.8-71172.6000112L40 E46 L47 I48 L81 Y97L40-L44 WeakPolarHBondContact O-CG 3.45Å; L40-L44 PolarHBondContact O-N 2.91Å; L44-E46 VanDerWaalsContact C-N 3.31Å; L44-E46 PolarHBondContact O-N 3.32Å; L44-L47 PolarHBondContact O-N 2.88Å; L44-I48 WeakPolarHBondContact O-CB 3.28Å; L44-I48 WeakPolarHBondContact O-CD1 3.49Å; L44-I48 VanDerWaalsContact O-CG1 3.23Å; L44-I48 WeakPolarHBondContact O-CG1 3.5Å; L44-I48 PolarHBondContact O-N 3.35Å; L44-L81 HydrophobicContact CD2-CD1 4.04Å; L44-L81 HydrophobicContact CD2-CD2 3.94Å; L44-Y97 HydrophobicContact CD1-CD1 4.13Å; L44-Y97 HydrophobicContact CD1-CE1 3.49Å; L44-Y97 VanDerWaalsContact CD1-CE1 3.49Å; L44-Y97 HydrophobicContact CD2-CD1 3.86Å; L44-Y97 HydrophobicContact CD2-CE1 4.08Å; L44-Y97 HydrophobicContact CD2-CG 4.48Å; L44-Y97 HydrophobicContact CG-CE1 4.44Å
45L79.8Confident78Confident89 Ų8943.6 Ų43.647%0.46627%0.266SS..Hα-helixtrans-60.9-42.6175.7-122.694.6000111.7N41 S42 G49 I125N41-L45 WeakPolarHBondContact O-CB 3.47Å; N41-L45 PolarHBondContact O-N 3.03Å; S42-L45 PolarHBondContact O-N 3.07Å; L45-G49 PolarHBondContact O-N 2.94Å; L45-I125 HydrophobicContact CD2-CG2 3.53Å
46E82.6Confident79.3Confident65 Ų6542.7 Ų42.730%0.30426%0.259SS..Hα-helixtrans-63.8-47.4178.3-169.7175.816900110.9K22 S42 L43 L44 I48 G49 F50K22-E46 VanDerWaalsContact CE-OE1 3.24Å; K22-E46 WeakPolarHBondContact CE-OE1 3.36Å; K22-E46 IonicContact NZ-OE1 2.74Å; K22-E46 PolarHBondContact NZ-OE1 3.42Å; K22-E46 IonicContact NZ-OE2 3.43Å; K22-E46 PolarHBondContact NZ-OE2 3.49Å; S42-E46 WeakPolarHBondContact O-CB 3.33Å; S42-E46 PolarHBondContact O-N 3.45Å; L43-E46 PolarHBondContact O-N 2.93Å; L44-E46 VanDerWaalsContact C-N 3.31Å; L44-E46 PolarHBondContact O-N 3.32Å; E46-I48 PolarHBondContact O-N 2.94Å; E46-G49 PolarHBondContact O-N 3.33Å; E46-G49 VanDerWaalsContact O-N 3.11Å; E46-F50 HydrophobicContact CG-CD2 4.11Å; E46-F50 HydrophobicContact CG-CE1 4.24Å; E46-F50 HydrophobicContact CG-CE2 3.44Å; E46-F50 VanDerWaalsContact CG-CE2 3.44Å; E46-F50 HydrophobicContact CG-CZ 3.51Å; E46-F50 WeakPolarHBondContact O-CG 3.23Å; E46-F50 PolarHBondContact O-N 2.9Å; E46-F50 WeakPolarHBondContact OE1-CE2 3.44Å; E46-F50 VanDerWaalsContact OE1-CZ 3.28Å; E46-F50 WeakPolarHBondContact OE1-CZ 3.48Å
47L85.4Confident80.9Confident0 Ų037 Ų370%022%0.224CC..Hα-helixtrans-59.2-46.7177.4-17365.5000112.3L43 L44 G49 F50 I51 I74 D77 V78 L81 L101L43-L47 WeakPolarHBondContact O-CB 3.44Å; L43-L47 PolarHBondContact O-N 3.36Å; L44-L47 PolarHBondContact O-N 2.88Å; L47-G49 VanDerWaalsContact C-N 3.31Å; L47-G49 PolarHBondContact O-N 2.93Å; L47-F50 PolarHBondContact O-N 2.81Å; L47-I51 HydrophobicContact CD1-CD1 4.48Å; L47-I51 HydrophobicContact CG-CD1 4.13Å; L47-I51 WeakPolarHBondContact O-CB 3.05Å; L47-I51 WeakPolarHBondContact O-CG1 3.08Å; L47-I51 PolarHBondContact O-N 3.24Å; L47-I74 HydrophobicContact CD1-CB 4.29Å; L47-I74 HydrophobicContact CD1-CG1 4.38Å; L47-I74 HydrophobicContact CD1-CG2 3.86Å; L47-D77 HydrophobicContact CD1-CB 4.01Å; L47-V78 HydrophobicContact CD1-CG2 3.96Å; L47-V78 HydrophobicContact CD2-CG2 4.21Å; L47-L81 HydrophobicContact CD2-CD2 4.38Å; L47-L101 HydrophobicContact CD2-CD1 3.53Å; L47-L101 HydrophobicContact CD2-CD2 3.82Å; L47-L101 HydrophobicContact CD2-CG 4.34Å; L47-L101 HydrophobicContact CG-CD2 4.16Å
48I85.9Confident82.3Confident92 Ų9237.5 Ų37.547%0.47221%0.205SC..Hα-helixtrans-60.6-44.4175.1-68.6165000109.9L44 E46 F50 I51 V52L44-I48 WeakPolarHBondContact O-CB 3.28Å; L44-I48 WeakPolarHBondContact O-CD1 3.49Å; L44-I48 VanDerWaalsContact O-CG1 3.23Å; L44-I48 WeakPolarHBondContact O-CG1 3.5Å; L44-I48 PolarHBondContact O-N 3.35Å; E46-I48 PolarHBondContact O-N 2.94Å; I48-F50 VanDerWaalsContact C-N 3.35Å; I48-F50 PolarHBondContact O-N 3.4Å; I48-I51 PolarHBondContact O-N 3.07Å; I48-V52 HydrophobicContact CG2-CG2 4.14Å; I48-V52 WeakPolarHBondContact O-CB 3.38Å; I48-V52 WeakPolarHBondContact O-CG2 3.47Å; I48-V52 PolarHBondContact O-N 3.47Å
49G86Confident83.4Confident6 Ų638.7 Ų38.76%0.06221%0.207CC..Hα-helixtrans-64.3-36-179.400000113.9L45 E46 L47 F53 C122L45-G49 PolarHBondContact O-N 2.94Å; E46-G49 PolarHBondContact O-N 3.33Å; E46-G49 VanDerWaalsContact O-N 3.11Å; L47-G49 VanDerWaalsContact C-N 3.31Å; L47-G49 PolarHBondContact O-N 2.93Å; G49-F53 WeakPolarHBondContact O-CB 3.36Å; G49-F53 PolarHBondContact O-N 3.12Å; G49-C122 WeakPolarHBondContact CA-SG 3.47Å
50F87.6Confident84.1Confident27 Ų2739 Ų3912%0.11820%0.198CC..Hα-helixtrans-71.8-41.6173.7-65.3-25.5000112.2E46 L47 I48 F53 V54 Y70 L73 I74E46-F50 HydrophobicContact CG-CD2 4.11Å; E46-F50 HydrophobicContact CG-CE1 4.24Å; E46-F50 HydrophobicContact CG-CE2 3.44Å; E46-F50 VanDerWaalsContact CG-CE2 3.44Å; E46-F50 HydrophobicContact CG-CZ 3.51Å; E46-F50 WeakPolarHBondContact O-CG 3.23Å; E46-F50 PolarHBondContact O-N 2.9Å; E46-F50 WeakPolarHBondContact OE1-CE2 3.44Å; E46-F50 VanDerWaalsContact OE1-CZ 3.28Å; E46-F50 WeakPolarHBondContact OE1-CZ 3.48Å; L47-F50 PolarHBondContact O-N 2.81Å; I48-F50 VanDerWaalsContact C-N 3.35Å; I48-F50 PolarHBondContact O-N 3.4Å; F50-F53 PolarHBondContact O-N 3.34Å; F50-V54 WeakPolarHBondContact O-CG2 3.17Å; F50-V54 PolarHBondContact O-N 3.01Å; F50-Y70 HydrophobicContact CB-CD1 4.29Å; F50-Y70 AromaticContact CD1-CD1 3.51Å; F50-Y70 HydrophobicContact CD1-CD1 3.51Å; F50-Y70 AromaticContact CD1-CE1 3.77Å; F50-Y70 HydrophobicContact CD1-CE1 3.77Å; F50-Y70 HydrophobicContact CE1-CD1 4.04Å; F50-Y70 HydrophobicContact CE1-CE1 4.01Å; F50-Y70 HydrophobicContact CG-CD1 4.05Å; F50-L73 HydrophobicContact CD2-CB 3.98Å; F50-L73 HydrophobicContact CE1-CD1 4.41Å; F50-L73 HydrophobicContact CE2-CB 3.78Å; F50-L73 HydrophobicContact CE2-CD1 4.2Å; F50-L73 HydrophobicContact CZ-CB 4.44Å; F50-L73 HydrophobicContact CZ-CD1 4.01Å; F50-I74 HydrophobicContact CB-CD1 3.95Å; F50-I74 HydrophobicContact CB-CG1 3.56Å; F50-I74 HydrophobicContact CD2-CG1 4.41Å; F50-I74 HydrophobicContact CG-CG1 4.47Å
51I88.8Confident84.6Confident18 Ų1844 Ų449%0.09223%0.225CC..Hα-helixtrans-57.6-54.8174.7-77.7165.7000110.1L47 I48 F53 V54 T55 I74 L101 W105L47-I51 HydrophobicContact CD1-CD1 4.48Å; L47-I51 HydrophobicContact CG-CD1 4.13Å; L47-I51 WeakPolarHBondContact O-CB 3.05Å; L47-I51 WeakPolarHBondContact O-CG1 3.08Å; L47-I51 PolarHBondContact O-N 3.24Å; I48-I51 PolarHBondContact O-N 3.07Å; I51-F53 PolarHBondContact O-N 3.43Å; I51-V54 PolarHBondContact O-N 3.38Å; I51-T55 WeakPolarHBondContact O-CB 3.23Å; I51-T55 PolarHBondContact O-N 3.44Å; I51-T55 PolarHBondContact O-OG1 3.05Å; I51-I74 HydrophobicContact CG1-CD1 4.01Å; I51-I74 HydrophobicContact CG1-CG1 4.44Å; I51-L101 HydrophobicContact CD1-CD2 3.62Å; I51-W105 HydrophobicContact CB-CE3 4.37Å; I51-W105 HydrophobicContact CB-CZ3 4.46Å; I51-W105 HydrophobicContact CG1-CE3 4.4Å; I51-W105 HydrophobicContact CG1-CZ3 4.5Å; I51-W105 HydrophobicContact CG2-CD2 4.5Å; I51-W105 HydrophobicContact CG2-CE3 3.47Å; I51-W105 VanDerWaalsContact CG2-CE3 3.47Å; I51-W105 HydrophobicContact CG2-CZ3 3.9Å
52V88.5Confident85.2Confident9 Ų940.3 Ų40.36%0.05520%0.203CC..Hα-helixtrans-52.8-44.9178.4173.30000110.9I48 Y56 L108 A118 M119 C122I48-V52 HydrophobicContact CG2-CG2 4.14Å; I48-V52 WeakPolarHBondContact O-CB 3.38Å; I48-V52 WeakPolarHBondContact O-CG2 3.47Å; I48-V52 PolarHBondContact O-N 3.47Å; V52-Y56 VanDerWaalsContact O-CB 3.26Å; V52-Y56 WeakPolarHBondContact O-CB 3.37Å; V52-Y56 PolarHBondContact O-N 3.16Å; V52-L108 HydrophobicContact CB-CD2 4.1Å; V52-L108 HydrophobicContact CG1-CD2 4.26Å; V52-L108 HydrophobicContact CG2-CD2 3.81Å; V52-A118 HydrophobicContact CG1-CB 3.9Å; V52-A118 HydrophobicContact CG2-CB 4.42Å; V52-M119 HydrophobicContact CG1-CB 4.25Å; V52-M119 HydrophobicContact CG1-SD 4.47Å; V52-C122 HydrophobicContact CG1-CB 4.3Å
53F88.2Confident85.8Confident0 Ų039.7 Ų39.70%020%0.197CC..Hα-helixtrans-66.4-46.2-178.4-171.5-96.9000112.9G49 F50 I51 Y56 Q57 Y70 M119 V174 F178G49-F53 WeakPolarHBondContact O-CB 3.36Å; G49-F53 PolarHBondContact O-N 3.12Å; F50-F53 PolarHBondContact O-N 3.34Å; I51-F53 PolarHBondContact O-N 3.43Å; F53-Y56 PolarHBondContact O-N 3.49Å; F53-Q57 HydrophobicContact CD1-CG 4.16Å; F53-Q57 HydrophobicContact CE1-CG 3.83Å; F53-Q57 HydrophobicContact CZ-CG 4.17Å; F53-Q57 WeakPolarHBondContact O-CG 3.42Å; F53-Q57 PolarHBondContact O-N 3.42Å; F53-Y70 HydrophobicContact CD1-CD1 4.08Å; F53-Y70 AromaticContact CD1-CD2 3.62Å; F53-Y70 HydrophobicContact CD1-CD2 3.62Å; F53-Y70 AromaticContact CD1-CE1 3.85Å; F53-Y70 HydrophobicContact CD1-CE1 3.85Å; F53-Y70 AromaticContact CD1-CE2 3.36Å; F53-Y70 HydrophobicContact CD1-CE2 3.36Å; F53-Y70 AromaticContact CD1-CG 3.98Å; F53-Y70 HydrophobicContact CD1-CG 3.98Å; F53-Y70 AromaticContact CD1-CZ 3.5Å; F53-Y70 VanDerWaalsContact CD1-CZ 3.5Å; F53-Y70 AromaticContact CE1-CD2 3.71Å; F53-Y70 HydrophobicContact CE1-CD2 3.71Å; F53-Y70 HydrophobicContact CE1-CE1 4.27Å; F53-Y70 AromaticContact CE1-CE2 3.09Å; F53-Y70 HydrophobicContact CE1-CE2 3.09Å; F53-Y70 HydrophobicContact CE1-CG 4.49Å; F53-Y70 AromaticContact CE1-CZ 3.44Å; F53-Y70 VanDerWaalsContact CE1-CZ 3.44Å; F53-Y70 HydrophobicContact CG-CE1 4.42Å; F53-Y70 HydrophobicContact CZ-CE2 4.1Å; F53-M119 HydrophobicContact CD2-SD 3.97Å; F53-V174 HydrophobicContact CE2-CG1 3.99Å; F53-V174 HydrophobicContact CE2-CG2 4.42Å; F53-V174 HydrophobicContact CZ-CG1 4.05Å; F53-F178 HydrophobicContact CE1-CZ 4.38Å; F53-F178 HydrophobicContact CE2-CE2 4.15Å; F53-F178 HydrophobicContact CE2-CZ 4Å; F53-F178 AromaticContact CZ-CE2 3.79Å; F53-F178 HydrophobicContact CZ-CE2 3.79Å; F53-F178 AromaticContact CZ-CZ 3.56Å; F53-F178 HydrophobicContact CZ-CZ 3.56Å
54V88.1Confident85.8Confident5 Ų542.6 Ų42.63%0.0322%0.216CC..Hα-helixtrans-66.2-44.9177.7173.80000110.8F50 I51 Y56 Q57 M58 Y67 Y70 P71 I74 W105F50-V54 WeakPolarHBondContact O-CG2 3.17Å; F50-V54 PolarHBondContact O-N 3.01Å; I51-V54 PolarHBondContact O-N 3.38Å; V54-Y56 VanDerWaalsContact C-N 3.26Å; V54-Y56 PolarHBondContact O-N 2.83Å; V54-Q57 PolarHBondContact O-N 3.25Å; V54-M58 HydrophobicContact CG1-CG 4.16Å; V54-M58 HydrophobicContact CG1-SD 3.8Å; V54-M58 WeakPolarHBondContact O-CB 3.03Å; V54-M58 VanDerWaalsContact O-CG 3.31Å; V54-M58 WeakPolarHBondContact O-CG 3.38Å; V54-M58 PolarHBondContact O-N 3.03Å; V54-Y67 HydrophobicContact CG1-CD2 4.17Å; V54-Y70 HydrophobicContact CG2-CG 4.06Å; V54-P71 HydrophobicContact CG1-CG 4.38Å; V54-P71 HydrophobicContact CG2-CG 4.42Å; V54-I74 HydrophobicContact CG2-CD1 4.1Å; V54-W105 HydrophobicContact CG1-CH2 4.16Å
55T88.4Confident85.8Confident2 Ų244.2 Ų44.21%0.01223%0.228CC..Hα-helixtrans-58.6-43.2177.2-47.10000110.1I51 M58 Y59 W105 L108 T109 I115I51-T55 WeakPolarHBondContact O-CB 3.23Å; I51-T55 PolarHBondContact O-N 3.44Å; I51-T55 PolarHBondContact O-OG1 3.05Å; T55-M58 PolarHBondContact O-N 2.82Å; T55-Y59 WeakPolarHBondContact O-CB 3.46Å; T55-Y59 PolarHBondContact O-N 2.75Å; T55-W105 HydrophobicContact CG2-CH2 4.4Å; T55-W105 HydrophobicContact CG2-CZ2 4.1Å; T55-W105 VanDerWaalsContact OG1-CE3 3.3Å; T55-W105 WeakPolarHBondContact OG1-CH2 3.2Å; T55-W105 WeakPolarHBondContact OG1-CZ3 3.38Å; T55-L108 HydrophobicContact CG2-CB 4.27Å; T55-T109 HydrophobicContact CG2-CG2 3.41Å; T55-T109 VanDerWaalsContact CG2-CG2 3.41Å; T55-I115 HydrophobicContact CG2-CD1 3.65Å
56Y88.1Confident85.9Confident6 Ų640.1 Ų40.12%0.02421%0.207CC..Hα-helixtrans-60.1-47.6177-179.7-84.1000111V52 F53 V54 M58 Y59 Y60 Y62 I115 D116 M119 D171 Q173 V174V52-Y56 VanDerWaalsContact O-CB 3.26Å; V52-Y56 WeakPolarHBondContact O-CB 3.37Å; V52-Y56 PolarHBondContact O-N 3.16Å; F53-Y56 PolarHBondContact O-N 3.49Å; V54-Y56 VanDerWaalsContact C-N 3.26Å; V54-Y56 PolarHBondContact O-N 2.83Å; Y56-M58 PolarHBondContact O-N 3.43Å; Y56-Y59 PolarHBondContact O-N 2.84Å; Y56-Y60 HydrophobicContact CD1-CD2 4.12Å; Y56-Y60 HydrophobicContact CD2-CD2 4.08Å; Y56-Y60 AromaticContact CD2-CE2 3.79Å; Y56-Y60 HydrophobicContact CD2-CE2 3.79Å; Y56-Y60 AromaticContact CE1-CD2 3.86Å; Y56-Y60 HydrophobicContact CE1-CD2 3.86Å; Y56-Y60 HydrophobicContact CE1-CE2 4.19Å; Y56-Y60 AromaticContact CE2-CD2 3.84Å; Y56-Y60 HydrophobicContact CE2-CD2 3.84Å; Y56-Y60 AromaticContact CE2-CE2 3.34Å; Y56-Y60 HydrophobicContact CE2-CE2 3.34Å; Y56-Y60 HydrophobicContact CG-CD2 4.21Å; Y56-Y60 HydrophobicContact CG-CE2 4.38Å; Y56-Y60 AromaticContact CZ-CD2 3.69Å; Y56-Y60 AromaticContact CZ-CE2 3.55Å; Y56-Y60 WeakPolarHBondContact O-CD2 3.19Å; Y56-Y60 PolarHBondContact O-N 3.46Å; Y56-Y60 VanDerWaalsContact O-N 3.11Å; Y56-Y62 HydrophobicContact CD1-CE2 4.32Å; Y56-Y62 AromaticContact CE1-CE2 3.89Å; Y56-Y62 HydrophobicContact CE1-CE2 3.89Å; Y56-I115 HydrophobicContact CD2-CG1 4.19Å; Y56-D116 WeakPolarHBondContact CE2-OD1 3.41Å; Y56-M119 HydrophobicContact CD1-CG 4.38Å; Y56-M119 HydrophobicContact CD2-CB 3.78Å; Y56-M119 HydrophobicContact CD2-CG 3.74Å; Y56-M119 HydrophobicContact CE2-CB 4.21Å; Y56-M119 HydrophobicContact CE2-CG 4.04Å; Y56-M119 HydrophobicContact CG-CB 4.33Å; Y56-M119 HydrophobicContact CG-CG 3.95Å; Y56-D171 WeakPolarHBondContact CE1-OD2 3.44Å; Y56-D171 PolarHBondContact OH-OD2 3.03Å; Y56-Q173 PolarHBondContact OH-OE1 3.26Å; Y56-Q173 VanDerWaalsContact OH-OE1 3.09Å; Y56-V174 HydrophobicContact CD1-CG2 4.17Å; Y56-V174 HydrophobicContact CE1-CG2 3.65Å
57Q86.8Confident85.9Confident1 Ų138.7 Ų38.71%0.00520%0.199CC..Hα-helixtrans-64.2-39.7179.8-64.5-93.9-13.500112.9F53 V54 N61 Y62 T66 Y67F53-Q57 HydrophobicContact CD1-CG 4.16Å; F53-Q57 HydrophobicContact CE1-CG 3.83Å; F53-Q57 HydrophobicContact CZ-CG 4.17Å; F53-Q57 WeakPolarHBondContact O-CG 3.42Å; F53-Q57 PolarHBondContact O-N 3.42Å; V54-Q57 PolarHBondContact O-N 3.25Å; Q57-N61 PolarHBondContact O-N 3.28Å; Q57-Y62 HydrophobicContact CB-CD2 4.16Å; Q57-Y62 HydrophobicContact CG-CD2 4.25Å; Q57-Y62 PolarHBondContact O-N 3.24Å; Q57-T66 PolarHBondContact OE1-OG1 3.43Å; Q57-Y67 HydrophobicContact CB-CD1 3.62Å; Q57-Y67 HydrophobicContact CB-CE1 4.27Å; Q57-Y67 HydrophobicContact CB-CG 3.88Å; Q57-Y67 HydrophobicContact CG-CD1 4.36Å; Q57-Y67 HydrophobicContact CG-CG 4.44Å
58M86.6Confident85.8Confident94 Ų9442.7 Ų42.746%0.46322%0.22SC..Hα-helixtrans-67.7-39.7174.9-69.9-178.770.600111.9V54 T55 Y56 Y60 N61 Y67 W105V54-M58 HydrophobicContact CG1-CG 4.16Å; V54-M58 HydrophobicContact CG1-SD 3.8Å; V54-M58 WeakPolarHBondContact O-CB 3.03Å; V54-M58 VanDerWaalsContact O-CG 3.31Å; V54-M58 WeakPolarHBondContact O-CG 3.38Å; V54-M58 PolarHBondContact O-N 3.03Å; T55-M58 PolarHBondContact O-N 2.82Å; Y56-M58 PolarHBondContact O-N 3.43Å; M58-Y60 VanDerWaalsContact C-N 3.34Å; M58-Y60 PolarHBondContact O-N 2.74Å; M58-N61 PolarHBondContact O-N 2.9Å; M58-N61 VanDerWaalsContact O-N 3.14Å; M58-Y67 HydrophobicContact CG-CE2 3.96Å; M58-W105 HydrophobicContact SD-CH2 4.18Å; M58-W105 HydrophobicContact SD-CZ2 4.25Å
59Y87.2Confident85.7Confident71 Ų7138.4 Ų38.428%0.27820%0.198SC..Hα-helixtrans-61.3-42.6179.8-172.7-86.7000111.8T55 Y56 N61 R112 I115T55-Y59 WeakPolarHBondContact O-CB 3.46Å; T55-Y59 PolarHBondContact O-N 2.75Å; Y56-Y59 PolarHBondContact O-N 2.84Å; Y59-N61 VanDerWaalsContact C-N 3.28Å; Y59-N61 PolarHBondContact O-N 3.22Å; Y59-N61 PolarHBondContact O-ND2 3.46Å; Y59-R112 HydrophobicContact CE1-CG 3.72Å; Y59-R112 WeakPolarHBondContact OH-CG 3.24Å; Y59-R112 PolarHBondContact OH-NE 3.33Å; Y59-I115 HydrophobicContact CD1-CG2 4.22Å; Y59-I115 HydrophobicContact CD2-CD1 4.35Å; Y59-I115 HydrophobicContact CG-CD1 4.09Å; Y59-I115 HydrophobicContact CG-CG2 4.35Å
60Y86.4Confident85.6Confident77 Ų7739 Ų3930%0.30220%0.198SC..THydrogen-bonded Turntrans-868.2177.3-72.9-78000114.1Y56 M58 Y62 I115 D116Y56-Y60 HydrophobicContact CD1-CD2 4.12Å; Y56-Y60 HydrophobicContact CD2-CD2 4.08Å; Y56-Y60 AromaticContact CD2-CE2 3.79Å; Y56-Y60 HydrophobicContact CD2-CE2 3.79Å; Y56-Y60 AromaticContact CE1-CD2 3.86Å; Y56-Y60 HydrophobicContact CE1-CD2 3.86Å; Y56-Y60 HydrophobicContact CE1-CE2 4.19Å; Y56-Y60 AromaticContact CE2-CD2 3.84Å; Y56-Y60 HydrophobicContact CE2-CD2 3.84Å; Y56-Y60 AromaticContact CE2-CE2 3.34Å; Y56-Y60 HydrophobicContact CE2-CE2 3.34Å; Y56-Y60 HydrophobicContact CG-CD2 4.21Å; Y56-Y60 HydrophobicContact CG-CE2 4.38Å; Y56-Y60 AromaticContact CZ-CD2 3.69Å; Y56-Y60 AromaticContact CZ-CE2 3.55Å; Y56-Y60 WeakPolarHBondContact O-CD2 3.19Å; Y56-Y60 PolarHBondContact O-N 3.46Å; Y56-Y60 VanDerWaalsContact O-N 3.11Å; M58-Y60 VanDerWaalsContact C-N 3.34Å; M58-Y60 PolarHBondContact O-N 2.74Å; Y60-Y62 VanDerWaalsContact C-N 3.28Å; Y60-Y62 HydrophobicContact CG-CE2 4.4Å; Y60-Y62 PolarHBondContact O-N 3.38Å; Y60-I115 HydrophobicContact CE2-CG2 4.5Å; Y60-D116 WeakPolarHBondContact CE2-OD1 3.36Å; Y60-D116 VanDerWaalsContact OH-CG 3.3Å; Y60-D116 PolarHBondContact OH-OD1 2.91Å; Y60-D116 PolarHBondContact OH-OD2 2.99Å
61N84.9Confident85.6Confident145 Ų14540.4 Ų40.478%0.77521%0.21SC*.THydrogen-bonded Turntrans5439.5178.7-62-79.2000113.9Q57 M58 Y59Q57-N61 PolarHBondContact O-N 3.28Å; M58-N61 PolarHBondContact O-N 2.9Å; M58-N61 VanDerWaalsContact O-N 3.14Å; Y59-N61 VanDerWaalsContact C-N 3.28Å; Y59-N61 PolarHBondContact O-N 3.22Å; Y59-N61 PolarHBondContact O-ND2 3.46Å
62Y84.6Confident85.5Confident40 Ų4041.8 Ų41.816%0.15722%0.217CC..  trans-68.8156.6177.8-66.8-36.3000112.6Y56 Q57 Y60 Y67 T169 D171Y56-Y62 HydrophobicContact CD1-CE2 4.32Å; Y56-Y62 AromaticContact CE1-CE2 3.89Å; Y56-Y62 HydrophobicContact CE1-CE2 3.89Å; Q57-Y62 HydrophobicContact CB-CD2 4.16Å; Q57-Y62 HydrophobicContact CG-CD2 4.25Å; Q57-Y62 PolarHBondContact O-N 3.24Å; Y60-Y62 VanDerWaalsContact C-N 3.28Å; Y60-Y62 HydrophobicContact CG-CE2 4.4Å; Y60-Y62 PolarHBondContact O-N 3.38Å; Y62-Y67 WeakPolarHBondContact O-CE1 3.49Å; Y62-T169 HydrophobicContact CD1-CG2 3.33Å; Y62-T169 HydrophobicContact CD2-CG2 4.19Å; Y62-T169 HydrophobicContact CE1-CG2 3.9Å; Y62-T169 HydrophobicContact CG-CG2 3.52Å; Y62-D171 HydrophobicContact CE2-CB 4.46Å; Y62-D171 WeakPolarHBondContact OH-CB 3.35Å; Y62-D171 PolarHBondContact OH-OD2 3.48Å
63P84.1Confident85.3Confident55 Ų5541.9 Ų41.936%0.35722%0.218SC..  trans-60132.8-177.9-23.434000111.6P65 T66P63-P65 VanDerWaalsContact C-N 3.31Å; P63-P65 WeakPolarHBondContact O-CD 3.45Å; P63-T66 HydrophobicContact CB-CG2 4.39Å; P63-T66 PolarHBondContact O-N 2.9Å; P63-T66 PolarHBondContact O-OG1 3.49Å
64P82.1Confident85.3Confident67 Ų6743.4 Ų43.444%0.43523%0.225SC..G310 helixtrans-48.6-39.9-176.4-27.833.6000116.1T66 Y67 L68P64-T66 PolarHBondContact O-N 3.3Å; P64-Y67 PolarHBondContact O-N 3.47Å; P64-Y67 VanDerWaalsContact O-N 3.09Å; P64-L68 HydrophobicContact CB-CD1 3.92Å; P64-L68 HydrophobicContact CB-CG 4.14Å; P64-L68 WeakPolarHBondContact O-CB 3.46Å; P64-L68 WeakPolarHBondContact O-CG 3.44Å; P64-L68 PolarHBondContact O-N 3.45Å
65P82.3Confident85.2Confident60 Ų6045.7 Ų45.739%0.3925%0.245SC..G310 helixtrans-57-21.7178.2-25.936.1000115N11 P63 Y67 R161N11-P65 HydrophobicContact CB-CB 4.46Å; N11-P65 PolarHBondContact OD1-O 2.96Å; N11-P65 VanDerWaalsContact OD1-O 3.14Å; P63-P65 VanDerWaalsContact C-N 3.31Å; P63-P65 WeakPolarHBondContact O-CD 3.45Å; P65-Y67 VanDerWaalsContact C-N 3.28Å; P65-Y67 PolarHBondContact O-N 3.11Å; P65-R161 PolarHBondContact O-NH1 3.22Å
66T80.3Confident85Confident3 Ų346.4 Ų46.42%0.01825%0.248CC..G310 helixtrans-75.3-16-179.666.40000113.5Q57 P63 P64 R161 T168 T169Q57-T66 PolarHBondContact OE1-OG1 3.43Å; P63-T66 HydrophobicContact CB-CG2 4.39Å; P63-T66 PolarHBondContact O-N 2.9Å; P63-T66 PolarHBondContact O-OG1 3.49Å; P64-T66 PolarHBondContact O-N 3.3Å; T66-R161 PolarHBondContact O-NH1 2.83Å; T66-T168 HydrophobicContact CG2-CG2 4.34Å; T66-T168 VanDerWaalsContact CG2-OG1 3.3Å; T66-T168 WeakPolarHBondContact CG2-OG1 3.12Å; T66-T169 HydrophobicContact CG2-CG2 4.34Å
67Y82.8Confident84.8Confident35 Ų3546.1 Ų46.114%0.13725%0.247CC..THydrogen-bonded Turntrans-139.1-1.4-177.965.3-92.1000115.6V54 Q57 M58 Y62 P64 P65 E69 Y70 P71V54-Y67 HydrophobicContact CG1-CD2 4.17Å; Q57-Y67 HydrophobicContact CB-CD1 3.62Å; Q57-Y67 HydrophobicContact CB-CE1 4.27Å; Q57-Y67 HydrophobicContact CB-CG 3.88Å; Q57-Y67 HydrophobicContact CG-CD1 4.36Å; Q57-Y67 HydrophobicContact CG-CG 4.44Å; M58-Y67 HydrophobicContact CG-CE2 3.96Å; Y62-Y67 WeakPolarHBondContact O-CE1 3.49Å; P64-Y67 PolarHBondContact O-N 3.47Å; P64-Y67 VanDerWaalsContact O-N 3.09Å; P65-Y67 VanDerWaalsContact C-N 3.28Å; P65-Y67 PolarHBondContact O-N 3.11Å; Y67-E69 PolarHBondContact O-N 2.95Å; Y67-E69 VanDerWaalsContact O-N 3.1Å; Y67-Y70 PolarHBondContact O-N 3.22Å; Y67-P71 WeakPolarHBondContact O-CD 3.38Å
68L83.8Confident84.8Confident83 Ų8348.5 Ų48.544%0.43526%0.261SS..THydrogen-bonded Turntrans-56.9-25.9-176.6-91.9166.7000114.9L15 P64 P71L15-L68 HydrophobicContact CD1-CB 4.33Å; P64-L68 HydrophobicContact CB-CD1 3.92Å; P64-L68 HydrophobicContact CB-CG 4.14Å; P64-L68 WeakPolarHBondContact O-CB 3.46Å; P64-L68 WeakPolarHBondContact O-CG 3.44Å; P64-L68 PolarHBondContact O-N 3.45Å; L68-P71 WeakPolarHBondContact O-CD 3.3Å
69E83.7Confident84.8Confident3 Ų348.2 Ų48.21%0.01426%0.261CS..Hα-helixtrans-70.5-28.8175.370.4-75.9-178.200113.4C18 Y67 I72 L73 R161C18-E69 HydrophobicContact CB-CB 4.05Å; Y67-E69 PolarHBondContact O-N 2.95Å; Y67-E69 VanDerWaalsContact O-N 3.1Å; E69-I72 WeakPolarHBondContact O-CB 3.38Å; E69-I72 PolarHBondContact O-N 2.95Å; E69-L73 WeakPolarHBondContact O-CG 3.49Å; E69-L73 PolarHBondContact O-N 3.29Å; E69-R161 IonicContact OE1-CZ 2.9Å; E69-R161 IonicContact OE1-NE 2.97Å; E69-R161 PolarHBondContact OE1-NE 3.38Å; E69-R161 IonicContact OE1-NH1 3.07Å; E69-R161 PolarHBondContact OE1-NH1 3.43Å; E69-R161 IonicContact OE1-NH2 2.75Å; E69-R161 PolarHBondContact OE1-NH2 2.96Å; E69-R161 IonicContact OE2-CZ 3.02Å; E69-R161 IonicContact OE2-NH1 2.95Å; E69-R161 PolarHBondContact OE2-NH1 2.9Å; E69-R161 IonicContact OE2-NH2 2.69Å; E69-R161 PolarHBondContact OE2-NH2 3.05Å
70Y85.5Confident84.7Confident18 Ų1844.9 Ų44.97%0.07125%0.248CC..Hα-helixtrans-72.8-40.6-175.3-68.3-86.4000113.6F50 F53 V54 Y67 I72 L73 I74 F178F50-Y70 HydrophobicContact CB-CD1 4.29Å; F50-Y70 AromaticContact CD1-CD1 3.51Å; F50-Y70 HydrophobicContact CD1-CD1 3.51Å; F50-Y70 AromaticContact CD1-CE1 3.77Å; F50-Y70 HydrophobicContact CD1-CE1 3.77Å; F50-Y70 HydrophobicContact CE1-CD1 4.04Å; F50-Y70 HydrophobicContact CE1-CE1 4.01Å; F50-Y70 HydrophobicContact CG-CD1 4.05Å; F53-Y70 HydrophobicContact CD1-CD1 4.08Å; F53-Y70 AromaticContact CD1-CD2 3.62Å; F53-Y70 HydrophobicContact CD1-CD2 3.62Å; F53-Y70 AromaticContact CD1-CE1 3.85Å; F53-Y70 HydrophobicContact CD1-CE1 3.85Å; F53-Y70 AromaticContact CD1-CE2 3.36Å; F53-Y70 HydrophobicContact CD1-CE2 3.36Å; F53-Y70 AromaticContact CD1-CG 3.98Å; F53-Y70 HydrophobicContact CD1-CG 3.98Å; F53-Y70 AromaticContact CD1-CZ 3.5Å; F53-Y70 VanDerWaalsContact CD1-CZ 3.5Å; F53-Y70 AromaticContact CE1-CD2 3.71Å; F53-Y70 HydrophobicContact CE1-CD2 3.71Å; F53-Y70 HydrophobicContact CE1-CE1 4.27Å; F53-Y70 AromaticContact CE1-CE2 3.09Å; F53-Y70 HydrophobicContact CE1-CE2 3.09Å; F53-Y70 HydrophobicContact CE1-CG 4.49Å; F53-Y70 AromaticContact CE1-CZ 3.44Å; F53-Y70 VanDerWaalsContact CE1-CZ 3.44Å; F53-Y70 HydrophobicContact CG-CE1 4.42Å; F53-Y70 HydrophobicContact CZ-CE2 4.1Å; V54-Y70 HydrophobicContact CG2-CG 4.06Å; Y67-Y70 PolarHBondContact O-N 3.22Å; Y70-I72 PolarHBondContact O-N 3.23Å; Y70-L73 HydrophobicContact CD1-CD1 4.4Å; Y70-L73 PolarHBondContact O-N 3.28Å; Y70-L73 VanDerWaalsContact O-N 3.16Å; Y70-I74 WeakPolarHBondContact O-CB 3.49Å; Y70-I74 VanDerWaalsContact O-CG1 3.23Å; Y70-I74 WeakPolarHBondContact O-CG1 2.93Å; Y70-I74 PolarHBondContact O-N 3.4Å; Y70-F178 WeakPolarHBondContact OH-CE1 3Å; Y70-F178 WeakPolarHBondContact OH-CZ 3.47Å
71P86.1Confident84.6Confident56 Ų5641.6 Ų41.636%0.36424%0.235SC..Hα-helixtrans-54.4-37.1169.6-29.335.3000113.3V54 Y67 L68 A75V54-P71 HydrophobicContact CG1-CG 4.38Å; V54-P71 HydrophobicContact CG2-CG 4.42Å; Y67-P71 WeakPolarHBondContact O-CD 3.38Å; L68-P71 WeakPolarHBondContact O-CD 3.3Å; P71-A75 PolarHBondContact O-N 3.07Å
72I86.3Confident84.6Confident48 Ų4838.2 Ų38.225%0.24622%0.217CC..Hα-helixtrans-68.2-45.9177.4-58.9167.6000110L15 M19 E69 Y70 I74 A75 Q76L15-I72 HydrophobicContact CD1-CD1 4.47Å; L15-I72 HydrophobicContact CG-CD1 4.35Å; M19-I72 HydrophobicContact CE-CD1 3.61Å; M19-I72 HydrophobicContact CG-CD1 4.39Å; M19-I72 HydrophobicContact CG-CG2 4.02Å; E69-I72 WeakPolarHBondContact O-CB 3.38Å; E69-I72 PolarHBondContact O-N 2.95Å; Y70-I72 PolarHBondContact O-N 3.23Å; I72-I74 PolarHBondContact O-N 3.13Å; I72-A75 PolarHBondContact O-N 2.75Å; I72-Q76 WeakPolarHBondContact O-CG 3.49Å; I72-Q76 PolarHBondContact O-N 3.31Å
73L85.3Confident84.5Confident11 Ų1138.1 Ų38.16%0.05822%0.219CC..Hα-helixtrans-61.1-42.7175.7-69.9170.2000112.1C18 F50 E69 Y70 A75 Q76 D77C18-L73 HydrophobicContact CB-CD1 4.1Å; C18-L73 HydrophobicContact CB-CD2 3.91Å; C18-L73 HydrophobicContact CB-CG 4.04Å; C18-L73 WeakPolarHBondContact O-CD2 3.49Å; F50-L73 HydrophobicContact CD2-CB 3.98Å; F50-L73 HydrophobicContact CE1-CD1 4.41Å; F50-L73 HydrophobicContact CE2-CB 3.78Å; F50-L73 HydrophobicContact CE2-CD1 4.2Å; F50-L73 HydrophobicContact CZ-CB 4.44Å; F50-L73 HydrophobicContact CZ-CD1 4.01Å; E69-L73 WeakPolarHBondContact O-CG 3.49Å; E69-L73 PolarHBondContact O-N 3.29Å; Y70-L73 HydrophobicContact CD1-CD1 4.4Å; Y70-L73 PolarHBondContact O-N 3.28Å; Y70-L73 VanDerWaalsContact O-N 3.16Å; L73-A75 VanDerWaalsContact C-N 3.33Å; L73-A75 PolarHBondContact O-N 2.95Å; L73-Q76 PolarHBondContact O-N 2.88Å; L73-D77 WeakPolarHBondContact O-CB 3.46Å; L73-D77 PolarHBondContact O-N 3.26Å
74I87.2Confident84.4Confident31 Ų3135.5 Ų35.516%0.15920%0.202CC..Hα-helixtrans-58-46.5175.2-71.3165.6000110.1L47 F50 I51 V54 Y70 I72 Q76 D77 V78L47-I74 HydrophobicContact CD1-CB 4.29Å; L47-I74 HydrophobicContact CD1-CG1 4.38Å; L47-I74 HydrophobicContact CD1-CG2 3.86Å; F50-I74 HydrophobicContact CB-CD1 3.95Å; F50-I74 HydrophobicContact CB-CG1 3.56Å; F50-I74 HydrophobicContact CD2-CG1 4.41Å; F50-I74 HydrophobicContact CG-CG1 4.47Å; I51-I74 HydrophobicContact CG1-CD1 4.01Å; I51-I74 HydrophobicContact CG1-CG1 4.44Å; V54-I74 HydrophobicContact CG2-CD1 4.1Å; Y70-I74 WeakPolarHBondContact O-CB 3.49Å; Y70-I74 VanDerWaalsContact O-CG1 3.23Å; Y70-I74 WeakPolarHBondContact O-CG1 2.93Å; Y70-I74 PolarHBondContact O-N 3.4Å; I72-I74 PolarHBondContact O-N 3.13Å; I74-Q76 VanDerWaalsContact C-N 3.33Å; I74-Q76 PolarHBondContact O-N 2.97Å; I74-D77 PolarHBondContact O-N 3.35Å; I74-V78 HydrophobicContact CG2-CG2 4.47Å; I74-V78 WeakPolarHBondContact O-CB 3.45Å; I74-V78 VanDerWaalsContact O-CG2 3.28Å; I74-V78 WeakPolarHBondContact O-CG2 3.34Å; I74-V78 PolarHBondContact O-N 3.31Å
75A86.6Confident84.4Confident53 Ų5332.3 Ų32.344%0.43818%0.181SC..Hα-helixtrans-61-42.8177.900000111.8P71 I72 L73 V78 I79P71-A75 PolarHBondContact O-N 3.07Å; I72-A75 PolarHBondContact O-N 2.75Å; L73-A75 VanDerWaalsContact C-N 3.33Å; L73-A75 PolarHBondContact O-N 2.95Å; A75-V78 PolarHBondContact O-N 3.04Å; A75-I79 VanDerWaalsContact O-CG1 3.3Å; A75-I79 WeakPolarHBondContact O-CG1 3.21Å; A75-I79 PolarHBondContact O-N 3.32Å; A75-I79 VanDerWaalsContact O-N 3.07Å
76Q83.9Confident84.5Confident18 Ų1836.2 Ų36.28%0.08419%0.189CC..Hα-helixtrans-64.3-42.1176.9-68.7177.7-900112.5C18 M19 K22 I72 L73 I74 I79 L80C18-Q76 PolarHBondContact O-OE1 3.42Å; M19-Q76 PolarHBondContact O-NE2 3.38Å; K22-Q76 HydrophobicContact CB-CB 4.16Å; K22-Q76 HydrophobicContact CG-CB 4.35Å; I72-Q76 WeakPolarHBondContact O-CG 3.49Å; I72-Q76 PolarHBondContact O-N 3.31Å; L73-Q76 PolarHBondContact O-N 2.88Å; I74-Q76 VanDerWaalsContact C-N 3.33Å; I74-Q76 PolarHBondContact O-N 2.97Å; Q76-I79 PolarHBondContact O-N 3.27Å; Q76-L80 PolarHBondContact O-N 3.01Å
77D85.5Confident84.6Confident0 Ų039.2 Ų39.20%020%0.201CC..Hα-helixtrans-69.6-34.6178.6-82.4-0.6000112.4K22 L43 L47 L73 I74 L80 L81K22-D77 WeakPolarHBondContact CD-OD1 3.47Å; K22-D77 WeakPolarHBondContact CE-OD1 3.39Å; K22-D77 IonicContact NZ-OD1 2.7Å; K22-D77 PolarHBondContact NZ-OD1 3.15Å; K22-D77 IonicContact NZ-OD2 3.21Å; K22-D77 PolarHBondContact NZ-OD2 3.42Å; L43-D77 HydrophobicContact CD1-CB 3.87Å; L47-D77 HydrophobicContact CD1-CB 4.01Å; L73-D77 WeakPolarHBondContact O-CB 3.46Å; L73-D77 PolarHBondContact O-N 3.26Å; I74-D77 PolarHBondContact O-N 3.35Å; D77-L80 PolarHBondContact O-N 2.85Å; D77-L81 WeakPolarHBondContact O-CB 3.46Å; D77-L81 PolarHBondContact O-N 3.19Å
78V86.8Confident84.3Confident51 Ų5141.1 Ų41.131%0.30921%0.213SC..Hα-helixtrans-64.3-43171.6169.60000110.9L47 I74 A75 L80 L81 L82L47-V78 HydrophobicContact CD1-CG2 3.96Å; L47-V78 HydrophobicContact CD2-CG2 4.21Å; I74-V78 HydrophobicContact CG2-CG2 4.47Å; I74-V78 WeakPolarHBondContact O-CB 3.45Å; I74-V78 VanDerWaalsContact O-CG2 3.28Å; I74-V78 WeakPolarHBondContact O-CG2 3.34Å; I74-V78 PolarHBondContact O-N 3.31Å; A75-V78 PolarHBondContact O-N 3.04Å; V78-L80 VanDerWaalsContact C-N 3.34Å; V78-L80 PolarHBondContact O-N 2.87Å; V78-L81 PolarHBondContact O-N 3.49Å; V78-L82 HydrophobicContact CG1-CD1 4.14Å; V78-L82 HydrophobicContact CG1-CG 4.45Å; V78-L82 VanDerWaalsContact O-CG 3.31Å; V78-L82 WeakPolarHBondContact O-CG 3.46Å; V78-L82 PolarHBondContact O-N 3.36Å
79I85.8Confident84Confident87 Ų8740.4 Ų40.445%0.44623%0.226SC..Hα-helixtrans-60.7-45.3175.4-68.3164.4000110.4A75 Q76 L81 L82 L83A75-I79 VanDerWaalsContact O-CG1 3.3Å; A75-I79 WeakPolarHBondContact O-CG1 3.21Å; A75-I79 PolarHBondContact O-N 3.32Å; A75-I79 VanDerWaalsContact O-N 3.07Å; Q76-I79 PolarHBondContact O-N 3.27Å; I79-L81 PolarHBondContact O-N 2.98Å; I79-L82 PolarHBondContact O-N 3.42Å; I79-L83 HydrophobicContact CG2-CD1 4.13Å; I79-L83 WeakPolarHBondContact O-CG 3.41Å; I79-L83 PolarHBondContact O-N 2.93Å
80L83.9Confident83.8Confident1 Ų141.5 Ų41.51%0.00523%0.234CC..Hα-helixtrans-58.6-46174.6-83.9168.3000112K22 I26 L29 L43 Q76 D77 V78 L82 L83 I84K22-L80 HydrophobicContact CB-CD1 4.44Å; K22-L80 HydrophobicContact CD-CD1 4.01Å; I26-L80 HydrophobicContact CB-CD2 4.26Å; I26-L80 HydrophobicContact CD1-CG 4.39Å; I26-L80 HydrophobicContact CG1-CD1 4.14Å; I26-L80 HydrophobicContact CG1-CD2 3.51Å; I26-L80 HydrophobicContact CG1-CG 3.6Å; L29-L80 HydrophobicContact CD2-CD2 3.99Å; L43-L80 HydrophobicContact CD1-CB 4.36Å; L43-L80 HydrophobicContact CD1-CD1 4.45Å; L43-L80 HydrophobicContact CD2-CB 4.01Å; Q76-L80 PolarHBondContact O-N 3.01Å; D77-L80 PolarHBondContact O-N 2.85Å; V78-L80 VanDerWaalsContact C-N 3.34Å; V78-L80 PolarHBondContact O-N 2.87Å; L80-L82 VanDerWaalsContact C-N 3.34Å; L80-L82 PolarHBondContact O-N 3.21Å; L80-L83 PolarHBondContact O-N 2.92Å; L80-I84 VanDerWaalsContact O-CG1 3.31Å; L80-I84 WeakPolarHBondContact O-CG1 3.44Å; L80-I84 PolarHBondContact O-N 3.5Å
81L85.6Confident83.4Confident8 Ų844.9 Ų44.94%0.04225%0.253CS..Hα-helixtrans-60.3-45.5179.4-17964.5000110.9L40 L43 L44 L47 D77 V78 I79 I84 L85L40-L81 HydrophobicContact CD2-CD1 3.8Å; L43-L81 HydrophobicContact CD2-CB 3.85Å; L43-L81 HydrophobicContact CD2-CD1 4.24Å; L44-L81 HydrophobicContact CD2-CD1 4.04Å; L44-L81 HydrophobicContact CD2-CD2 3.94Å; L47-L81 HydrophobicContact CD2-CD2 4.38Å; D77-L81 WeakPolarHBondContact O-CB 3.46Å; D77-L81 PolarHBondContact O-N 3.19Å; V78-L81 PolarHBondContact O-N 3.49Å; I79-L81 PolarHBondContact O-N 2.98Å; L81-I84 PolarHBondContact O-N 3.09Å; L81-L85 HydrophobicContact CD1-CD1 4.32Å; L81-L85 HydrophobicContact CD1-CG 4.48Å; L81-L85 HydrophobicContact CG-CD1 4.12Å; L81-L85 VanDerWaalsContact O-CG 3.29Å; L81-L85 WeakPolarHBondContact O-CG 3.31Å; L81-L85 PolarHBondContact O-N 3.39Å
82L84.6Confident83Confident75 Ų7553.1 Ų53.139%0.39328%0.277SS..Hα-helixtrans-61.7-43.8176.9-71.2174000112V78 I79 L80 I84 L85 Y86 S94V78-L82 HydrophobicContact CG1-CD1 4.14Å; V78-L82 HydrophobicContact CG1-CG 4.45Å; V78-L82 VanDerWaalsContact O-CG 3.31Å; V78-L82 WeakPolarHBondContact O-CG 3.46Å; V78-L82 PolarHBondContact O-N 3.36Å; I79-L82 PolarHBondContact O-N 3.42Å; L80-L82 VanDerWaalsContact C-N 3.34Å; L80-L82 PolarHBondContact O-N 3.21Å; L82-I84 PolarHBondContact O-N 3.37Å; L82-L85 PolarHBondContact O-N 2.95Å; L82-Y86 VanDerWaalsContact O-CB 3.29Å; L82-Y86 WeakPolarHBondContact O-CB 3.48Å; L82-Y86 PolarHBondContact O-N 3.22Å; L82-S94 WeakPolarHBondContact CD2-OG 3.32Å
83L82.5Confident82.8Confident37 Ų3755.4 Ų55.419%0.19429%0.286CS..Hα-helixtrans-61.8-43.1176.3-74.6170.9000111.7I26 L29 M30 I79 L80 Y86 Y87I26-L83 HydrophobicContact CG2-CD1 4.1Å; L29-L83 HydrophobicContact CD2-CB 3.66Å; L29-L83 HydrophobicContact CD2-CD1 4.41Å; M30-L83 HydrophobicContact CG-CD1 4.31Å; I79-L83 HydrophobicContact CG2-CD1 4.13Å; I79-L83 WeakPolarHBondContact O-CG 3.41Å; I79-L83 PolarHBondContact O-N 2.93Å; L80-L83 PolarHBondContact O-N 2.92Å; L83-Y86 WeakPolarHBondContact O-CB 3.22Å; L83-Y86 PolarHBondContact O-N 3.29Å; L83-Y87 HydrophobicContact CB-CE2 4.28Å; L83-Y87 HydrophobicContact CD2-CE2 4.27Å; L83-Y87 WeakPolarHBondContact O-CD2 3.41Å; L83-Y87 PolarHBondContact O-N 3.48Å
84I81.6Confident82.6Confident0 Ų056 Ų560%029%0.292CS..Hα-helixtrans-63.2-45.7177.7-66.3167.4000110.8L29 I38 L40 L43 L80 L81 L82 Y86 Y87 N88L29-I84 HydrophobicContact CD1-CG1 4.26Å; L29-I84 HydrophobicContact CD2-CG1 3.69Å; I38-I84 HydrophobicContact CB-CD1 4.25Å; I38-I84 HydrophobicContact CG2-CD1 3.78Å; L40-I84 HydrophobicContact CD1-CG2 3.98Å; L40-I84 HydrophobicContact CD2-CB 3.94Å; L40-I84 HydrophobicContact CD2-CD1 4Å; L40-I84 HydrophobicContact CD2-CG2 3.34Å; L40-I84 HydrophobicContact CG-CG2 3.68Å; L43-I84 HydrophobicContact CD2-CD1 3.88Å; L80-I84 VanDerWaalsContact O-CG1 3.31Å; L80-I84 WeakPolarHBondContact O-CG1 3.44Å; L80-I84 PolarHBondContact O-N 3.5Å; L81-I84 PolarHBondContact O-N 3.09Å; L82-I84 PolarHBondContact O-N 3.37Å; I84-Y86 VanDerWaalsContact C-N 3.31Å; I84-Y86 PolarHBondContact O-N 3.18Å; I84-Y87 PolarHBondContact O-N 3.36Å; I84-N88 WeakPolarHBondContact CG2-ND2 3.5Å; I84-N88 WeakPolarHBondContact O-CB 3.28Å; I84-N88 PolarHBondContact O-N 3.48Å; I84-N88 PolarHBondContact O-ND2 3.27Å
85L82.9Confident82.4Confident0 Ų060.8 Ų60.80%032%0.317CS..Hα-helixtrans-65.9-35.3178.5-67173.1000112.3L81 L82 G89 S90 Q93 Y97L81-L85 HydrophobicContact CD1-CD1 4.32Å; L81-L85 HydrophobicContact CD1-CG 4.48Å; L81-L85 HydrophobicContact CG-CD1 4.12Å; L81-L85 VanDerWaalsContact O-CG 3.29Å; L81-L85 WeakPolarHBondContact O-CG 3.31Å; L81-L85 PolarHBondContact O-N 3.39Å; L82-L85 PolarHBondContact O-N 2.95Å; L85-G89 PolarHBondContact O-N 2.86Å; L85-S90 WeakPolarHBondContact CD2-OG 3.38Å; L85-S90 PolarHBondContact O-N 2.84Å; L85-Q93 HydrophobicContact CD2-CB 4.35Å; L85-Y97 HydrophobicContact CD1-CD2 3.79Å; L85-Y97 HydrophobicContact CD1-CE2 4.15Å; L85-Y97 HydrophobicContact CD2-CD2 4.44Å; L85-Y97 HydrophobicContact CD2-CE2 3.96Å
86Y84.4Confident82.3Confident143 Ų14362.4 Ų62.456%0.56132%0.321SS*.Hα-helixtrans-61.7-51.5172.9-179.6-95.9000111.3L82 L83 I84 N88 G89 L91L82-Y86 VanDerWaalsContact O-CB 3.29Å; L82-Y86 WeakPolarHBondContact O-CB 3.48Å; L82-Y86 PolarHBondContact O-N 3.22Å; L83-Y86 WeakPolarHBondContact O-CB 3.22Å; L83-Y86 PolarHBondContact O-N 3.29Å; I84-Y86 VanDerWaalsContact C-N 3.31Å; I84-Y86 PolarHBondContact O-N 3.18Å; Y86-N88 VanDerWaalsContact C-N 3.31Å; Y86-N88 PolarHBondContact O-N 3.25Å; Y86-G89 PolarHBondContact O-N 3.37Å; Y86-G89 VanDerWaalsContact O-N 3.12Å; Y86-L91 HydrophobicContact CD2-CD1 3.89Å; Y86-L91 HydrophobicContact CD2-CD2 4.16Å; Y86-L91 HydrophobicContact CD2-CG 4.39Å; Y86-L91 HydrophobicContact CE2-CD1 4.46Å
87Y80.9Confident82.3Confident66 Ų6664.1 Ų64.126%0.25933%0.327SS..Hα-helixtrans-69.4-26.2-179.8-66.7-52.5000113.7L29 K33 L83 I84 G89L29-Y87 HydrophobicContact CD1-CD2 4.34Å; L29-Y87 HydrophobicContact CG-CD2 4.21Å; L29-Y87 HydrophobicContact CG-CE2 4.15Å; K33-Y87 HydrophobicContact CB-CD1 4.49Å; K33-Y87 HydrophobicContact CB-CE1 4.23Å; K33-Y87 HydrophobicContact CG-CE1 4.36Å; L83-Y87 HydrophobicContact CB-CE2 4.28Å; L83-Y87 HydrophobicContact CD2-CE2 4.27Å; L83-Y87 WeakPolarHBondContact O-CD2 3.41Å; L83-Y87 PolarHBondContact O-N 3.48Å; I84-Y87 PolarHBondContact O-N 3.36Å; Y87-G89 VanDerWaalsContact C-N 3.27Å
88N77.3Confident82.1Confident74 Ų7466.3 Ų66.340%0.39635%0.345SS..THydrogen-bonded Turntrans-81.7-2.1173.4-77.3-30.6000113.8S35 I84 Y86 S90S35-N88 PolarHBondContact OG-ND2 3.41Å; S35-N88 PolarHBondContact OG-OD1 3.2Å; S35-N88 VanDerWaalsContact OG-OD1 3.05Å; I84-N88 WeakPolarHBondContact CG2-ND2 3.5Å; I84-N88 WeakPolarHBondContact O-CB 3.28Å; I84-N88 PolarHBondContact O-N 3.48Å; I84-N88 PolarHBondContact O-ND2 3.27Å; Y86-N88 VanDerWaalsContact C-N 3.31Å; Y86-N88 PolarHBondContact O-N 3.25Å; N88-S90 PolarHBondContact O-N 2.92Å
89G78.3Confident82Confident68 Ų6870.2 Ų70.270%0.70136%0.363SS*.THydrogen-bonded Turntrans67.111.8-178.100000114.1L85 Y86 Y87L85-G89 PolarHBondContact O-N 2.86Å; Y86-G89 PolarHBondContact O-N 3.37Å; Y86-G89 VanDerWaalsContact O-N 3.12Å; Y87-G89 VanDerWaalsContact C-N 3.27Å
90S78.3Confident82Confident27 Ų2771.3 Ų71.319%0.18937%0.37CS..  trans-106.234.7-174.366.90000113L85 N88 R92 Q93L85-S90 WeakPolarHBondContact CD2-OG 3.38Å; L85-S90 PolarHBondContact O-N 2.84Å; N88-S90 PolarHBondContact O-N 2.92Å; S90-R92 PolarHBondContact O-N 2.79Å; S90-Q93 WeakPolarHBondContact O-CB 3.46Å; S90-Q93 PolarHBondContact O-N 3.34Å; S90-Q93 PolarHBondContact OG-OE1 3.49Å
91L77.8Confident81.9Confident89 Ų8973 Ų7347%0.46638%0.379SS..Hα-helixtrans-51.1-30.8-178.7-75.9168.3000114.2Y86 Q93 S94Y86-L91 HydrophobicContact CD2-CD1 3.89Å; Y86-L91 HydrophobicContact CD2-CD2 4.16Å; Y86-L91 HydrophobicContact CD2-CG 4.39Å; Y86-L91 HydrophobicContact CE2-CD1 4.46Å; L91-Q93 PolarHBondContact O-N 2.86Å; L91-S94 WeakPolarHBondContact O-CB 3.26Å; L91-S94 PolarHBondContact O-N 2.96Å
92R78.6Confident81.8Confident229 Ų22977.2 Ų77.286%0.86441%0.405SS*.Hα-helixtrans-59.8-30.9175.4-72.5-175179.5-178.20.1113.2S90 S94 L95S90-R92 PolarHBondContact O-N 2.79Å; R92-S94 PolarHBondContact O-N 3.02Å; R92-L95 PolarHBondContact O-N 3.26Å
93Q80.9Confident81.7Confident95 Ų9575.6 Ų75.644%0.44441%0.406SS..Hα-helixtrans-68.8-21.3175.8-65.4177.3-2000112.2L85 S90 L91 L95 V96 Y97L85-Q93 HydrophobicContact CD2-CB 4.35Å; S90-Q93 WeakPolarHBondContact O-CB 3.46Å; S90-Q93 PolarHBondContact O-N 3.34Å; S90-Q93 PolarHBondContact OG-OE1 3.49Å; L91-Q93 PolarHBondContact O-N 2.86Å; Q93-L95 VanDerWaalsContact C-N 3.26Å; Q93-L95 PolarHBondContact O-N 3.1Å; Q93-V96 WeakPolarHBondContact O-CB 3.44Å; Q93-V96 PolarHBondContact O-N 3.42Å; Q93-V96 VanDerWaalsContact O-N 3.1Å; Q93-Y97 HydrophobicContact CB-CD2 4.3Å; Q93-Y97 HydrophobicContact CB-CE2 3.92Å; Q93-Y97 WeakPolarHBondContact O-CD2 3.44Å; Q93-Y97 PolarHBondContact O-N 3.06Å
94S81.6Confident81.6Confident25 Ų2575.1 Ų75.118%0.17541%0.41CS..Hα-helixtrans-58.6-38.4176.2179.30000112.1L82 L91 R92 V96 Y97 A98L82-S94 WeakPolarHBondContact CD2-OG 3.32Å; L91-S94 WeakPolarHBondContact O-CB 3.26Å; L91-S94 PolarHBondContact O-N 2.96Å; R92-S94 PolarHBondContact O-N 3.02Å; S94-V96 VanDerWaalsContact C-N 3.34Å; S94-V96 PolarHBondContact O-N 3.43Å; S94-Y97 PolarHBondContact O-N 3.32Å; S94-A98 WeakPolarHBondContact O-CB 3.44Å; S94-A98 PolarHBondContact O-N 3.47Å
95L82.3Confident81.6Confident131 Ų13178.8 Ų78.869%0.68642%0.424SS*.Hα-helixtrans-64.9-39.3176.7-66.7175.5000111.8R92 Q93 A98 L99R92-L95 PolarHBondContact O-N 3.26Å; Q93-L95 VanDerWaalsContact C-N 3.26Å; Q93-L95 PolarHBondContact O-N 3.1Å; L95-A98 PolarHBondContact O-N 3.26Å; L95-L99 WeakPolarHBondContact O-CB 3.28Å; L95-L99 PolarHBondContact O-N 3.03Å
96V84.9Confident81.6Confident87 Ų8787.1 Ų87.153%0.52746%0.455SS..Hα-helixtrans-64.1-46.3176.1-179.40000110.1Q93 S94 A98 L99 L100Q93-V96 WeakPolarHBondContact O-CB 3.44Å; Q93-V96 PolarHBondContact O-N 3.42Å; Q93-V96 VanDerWaalsContact O-N 3.1Å; S94-V96 VanDerWaalsContact C-N 3.34Å; S94-V96 PolarHBondContact O-N 3.43Å; V96-A98 PolarHBondContact O-N 3.27Å; V96-L99 PolarHBondContact O-N 3.23Å; V96-L100 HydrophobicContact CG1-CD1 4.07Å; V96-L100 HydrophobicContact CG1-CG 4.43Å; V96-L100 WeakPolarHBondContact O-CB 3.48Å; V96-L100 VanDerWaalsContact O-CG 3.29Å; V96-L100 WeakPolarHBondContact O-CG 3.2Å; V96-L100 PolarHBondContact O-N 3.43Å
97Y83.5Confident81.4Confident53 Ų5385.5 Ų85.521%0.20846%0.456CS..Hα-helixtrans-62.3-43.2175.8-68.2-61.2000112.2L44 L85 Q93 S94 L99 L100 L101L44-Y97 HydrophobicContact CD1-CD1 4.13Å; L44-Y97 HydrophobicContact CD1-CE1 3.49Å; L44-Y97 VanDerWaalsContact CD1-CE1 3.49Å; L44-Y97 HydrophobicContact CD2-CD1 3.86Å; L44-Y97 HydrophobicContact CD2-CE1 4.08Å; L44-Y97 HydrophobicContact CD2-CG 4.48Å; L44-Y97 HydrophobicContact CG-CE1 4.44Å; L85-Y97 HydrophobicContact CD1-CD2 3.79Å; L85-Y97 HydrophobicContact CD1-CE2 4.15Å; L85-Y97 HydrophobicContact CD2-CD2 4.44Å; L85-Y97 HydrophobicContact CD2-CE2 3.96Å; Q93-Y97 HydrophobicContact CB-CD2 4.3Å; Q93-Y97 HydrophobicContact CB-CE2 3.92Å; Q93-Y97 WeakPolarHBondContact O-CD2 3.44Å; Q93-Y97 PolarHBondContact O-N 3.06Å; S94-Y97 PolarHBondContact O-N 3.32Å; Y97-L99 VanDerWaalsContact C-N 3.31Å; Y97-L99 PolarHBondContact O-N 2.84Å; Y97-L100 PolarHBondContact O-N 2.9Å; Y97-L101 WeakPolarHBondContact O-CB 3.16Å; Y97-L101 WeakPolarHBondContact O-CG 3.23Å; Y97-L101 PolarHBondContact O-N 3.06Å
98A82.6Confident81.4Confident46 Ų4683.5 Ų83.538%0.3845%0.449SS..Hα-helixtrans-59.3-44.117600000111.5S94 L95 V96 L101 V102S94-A98 WeakPolarHBondContact O-CB 3.44Å; S94-A98 PolarHBondContact O-N 3.47Å; L95-A98 PolarHBondContact O-N 3.26Å; V96-A98 PolarHBondContact O-N 3.27Å; A98-L101 PolarHBondContact O-N 3.49Å; A98-V102 WeakPolarHBondContact O-CB 3.29Å; A98-V102 VanDerWaalsContact O-CG2 3.29Å; A98-V102 WeakPolarHBondContact O-CG2 3.39Å; A98-V102 PolarHBondContact O-N 2.84Å
99L84.6Confident81.4Confident133 Ų13382.5 Ų82.570%0.69645%0.446SS*.Hα-helixtrans-67.7-38.6179.5-157.9140.2000111.9L95 V96 Y97 G103L95-L99 WeakPolarHBondContact O-CB 3.28Å; L95-L99 PolarHBondContact O-N 3.03Å; V96-L99 PolarHBondContact O-N 3.23Å; Y97-L99 VanDerWaalsContact C-N 3.31Å; Y97-L99 PolarHBondContact O-N 2.84Å; L99-G103 WeakPolarHBondContact O-CA 3.2Å; L99-G103 PolarHBondContact O-N 3.18Å
100L85.1Confident81.5Confident110 Ų11083.5 Ų83.558%0.57644%0.438SS*.Hα-helixtrans-64.4-41.6173.2-73.2172.1000112.2V96 Y97 G104V96-L100 HydrophobicContact CG1-CD1 4.07Å; V96-L100 HydrophobicContact CG1-CG 4.43Å; V96-L100 WeakPolarHBondContact O-CB 3.48Å; V96-L100 VanDerWaalsContact O-CG 3.29Å; V96-L100 WeakPolarHBondContact O-CG 3.2Å; V96-L100 PolarHBondContact O-N 3.43Å; Y97-L100 PolarHBondContact O-N 2.9Å; L100-G104 WeakPolarHBondContact O-CA 3.35Å; L100-G104 PolarHBondContact O-N 3.24Å
101L82.8Confident81.6Confident37 Ų3787 Ų8719%0.19445%0.452CS..Hα-helixtrans-68.7-45.1179.4-68.3168.4000111.6L47 I51 Y97 A98 W105L47-L101 HydrophobicContact CD2-CD1 3.53Å; L47-L101 HydrophobicContact CD2-CD2 3.82Å; L47-L101 HydrophobicContact CD2-CG 4.34Å; L47-L101 HydrophobicContact CG-CD2 4.16Å; I51-L101 HydrophobicContact CD1-CD2 3.62Å; Y97-L101 WeakPolarHBondContact O-CB 3.16Å; Y97-L101 WeakPolarHBondContact O-CG 3.23Å; Y97-L101 PolarHBondContact O-N 3.06Å; A98-L101 PolarHBondContact O-N 3.49Å; L101-W105 WeakPolarHBondContact O-CB 3.1Å; L101-W105 PolarHBondContact O-N 2.91Å
102V83Confident81.7Confident97 Ų9790.6 Ų90.659%0.58846%0.459SS*.Hα-helixtrans-68.4-43.8177.9174.50000111.1A98 W105 R106A98-V102 WeakPolarHBondContact O-CB 3.29Å; A98-V102 VanDerWaalsContact O-CG2 3.29Å; A98-V102 WeakPolarHBondContact O-CG2 3.39Å; A98-V102 PolarHBondContact O-N 2.84Å; V102-W105 PolarHBondContact O-N 3.41Å; V102-R106 WeakPolarHBondContact O-CG 3.38Å; V102-R106 PolarHBondContact O-N 3.39Å; V102-R106 VanDerWaalsContact O-N 3.07Å
103G80.9Confident82Confident41 Ų4187.3 Ų87.342%0.42345%0.447SS..Hα-helixtrans-63.1-44.9176.100000112L99 R106 L107L99-G103 WeakPolarHBondContact O-CA 3.2Å; L99-G103 PolarHBondContact O-N 3.18Å; G103-R106 PolarHBondContact O-N 2.86Å; G103-L107 PolarHBondContact O-N 3.47Å
104G81.2Confident82.3Confident27 Ų2784.5 Ų84.528%0.27844%0.435SS..Hα-helixtrans-59.6-49.2174.500000111.9L100 R106 L107 L108L100-G104 WeakPolarHBondContact O-CA 3.35Å; L100-G104 PolarHBondContact O-N 3.24Å; G104-R106 VanDerWaalsContact C-N 3.31Å; G104-R106 PolarHBondContact O-N 3.32Å; G104-L107 PolarHBondContact O-N 3.41Å; G104-L107 VanDerWaalsContact O-N 3.13Å; G104-L108 WeakPolarHBondContact O-CD1 3.49Å; G104-L108 PolarHBondContact O-N 3.23Å
105W81Confident82.6Confident77 Ų7783.3 Ų83.329%0.29243%0.426SS..Hα-helixtrans-53.9-47.4176.4-179.3-75.3000112.1I51 V54 T55 M58 L101 V102 L107 L108 T109I51-W105 HydrophobicContact CB-CE3 4.37Å; I51-W105 HydrophobicContact CB-CZ3 4.46Å; I51-W105 HydrophobicContact CG1-CE3 4.4Å; I51-W105 HydrophobicContact CG1-CZ3 4.5Å; I51-W105 HydrophobicContact CG2-CD2 4.5Å; I51-W105 HydrophobicContact CG2-CE3 3.47Å; I51-W105 VanDerWaalsContact CG2-CE3 3.47Å; I51-W105 HydrophobicContact CG2-CZ3 3.9Å; V54-W105 HydrophobicContact CG1-CH2 4.16Å; T55-W105 HydrophobicContact CG2-CH2 4.4Å; T55-W105 HydrophobicContact CG2-CZ2 4.1Å; T55-W105 VanDerWaalsContact OG1-CE3 3.3Å; T55-W105 WeakPolarHBondContact OG1-CH2 3.2Å; T55-W105 WeakPolarHBondContact OG1-CZ3 3.38Å; M58-W105 HydrophobicContact SD-CH2 4.18Å; M58-W105 HydrophobicContact SD-CZ2 4.25Å; L101-W105 WeakPolarHBondContact O-CB 3.1Å; L101-W105 PolarHBondContact O-N 2.91Å; V102-W105 PolarHBondContact O-N 3.41Å; W105-L107 PolarHBondContact O-N 3.13Å; W105-L108 PolarHBondContact O-N 3.46Å; W105-T109 PolarHBondContact O-N 3.37Å
106R82.8Confident82.8Confident175 Ų17579.2 Ų79.266%0.6641%0.405SS*.Hα-helixtrans-61.4-44.8178.4-73.6-62.9-164.8-1672.8111.5V102 G103 G104 L108 T109 V110V102-R106 WeakPolarHBondContact O-CG 3.38Å; V102-R106 PolarHBondContact O-N 3.39Å; V102-R106 VanDerWaalsContact O-N 3.07Å; G103-R106 PolarHBondContact O-N 2.86Å; G104-R106 VanDerWaalsContact C-N 3.31Å; G104-R106 PolarHBondContact O-N 3.32Å; R106-L108 VanDerWaalsContact C-N 3.34Å; R106-L108 PolarHBondContact O-N 2.97Å; R106-T109 PolarHBondContact O-N 2.99Å; R106-T109 PolarHBondContact O-OG1 2.94Å; R106-V110 WeakPolarHBondContact O-CG2 3.41Å
107L80.1Confident82.8Confident109 Ų10979.2 Ų79.257%0.57140%0.401SS*.Hα-helixtrans-62.2-39.4179.4-170.468.5000112.4G103 G104 W105 T109 V110G103-L107 PolarHBondContact O-N 3.47Å; G104-L107 PolarHBondContact O-N 3.41Å; G104-L107 VanDerWaalsContact O-N 3.13Å; W105-L107 PolarHBondContact O-N 3.13Å; L107-T109 PolarHBondContact O-N 3.35Å; L107-V110 HydrophobicContact CD1-CG2 4.49Å; L107-V110 WeakPolarHBondContact O-CB 3.43Å; L107-V110 WeakPolarHBondContact O-CG2 3.4Å; L107-V110 PolarHBondContact O-N 3.47Å
108L81.4Confident83Confident23 Ų2377.7 Ų77.712%0.1240%0.4CS..Hα-helixtrans-58.2-35.2176.9-94.887.1000112.6V52 T55 G104 W105 R106 V110 A118V52-L108 HydrophobicContact CB-CD2 4.1Å; V52-L108 HydrophobicContact CG1-CD2 4.26Å; V52-L108 HydrophobicContact CG2-CD2 3.81Å; T55-L108 HydrophobicContact CG2-CB 4.27Å; G104-L108 WeakPolarHBondContact O-CD1 3.49Å; G104-L108 PolarHBondContact O-N 3.23Å; W105-L108 PolarHBondContact O-N 3.46Å; R106-L108 VanDerWaalsContact C-N 3.34Å; R106-L108 PolarHBondContact O-N 2.97Å; L108-V110 VanDerWaalsContact C-N 3.34Å; L108-A118 HydrophobicContact CD2-CB 4.35Å; L108-A118 HydrophobicContact CG-CB 4.48Å
109T78.5Confident83.2Confident53 Ų5375.5 Ų75.533%0.32538%0.382SS..THydrogen-bonded Turntrans-86.90.2-175.956.50000114.4T55 W105 R106 L107T55-T109 HydrophobicContact CG2-CG2 3.41Å; T55-T109 VanDerWaalsContact CG2-CG2 3.41Å; W105-T109 PolarHBondContact O-N 3.37Å; R106-T109 PolarHBondContact O-N 2.99Å; R106-T109 PolarHBondContact O-OG1 2.94Å; L107-T109 PolarHBondContact O-N 3.35Å
110V79Confident83.3Confident90 Ų9072 Ų7255%0.54537%0.368SS..THydrogen-bonded Turntrans-71.9-46.4-175.1-179.40000111.4R106 L107 L108 I114R106-V110 WeakPolarHBondContact O-CG2 3.41Å; L107-V110 HydrophobicContact CD1-CG2 4.49Å; L107-V110 WeakPolarHBondContact O-CB 3.43Å; L107-V110 WeakPolarHBondContact O-CG2 3.4Å; L107-V110 PolarHBondContact O-N 3.47Å; L108-V110 VanDerWaalsContact C-N 3.34Å; V110-I114 HydrophobicContact CB-CD1 4.44Å
111E80.6Confident83.4Confident101 Ų10170.9 Ų70.947%0.47236%0.363SS..  trans-138.7149-176.7-75.5-60.8159.300112.1W113 I114 I115E111-W113 HydrophobicContact CB-CG 4.5Å; E111-W113 PolarHBondContact O-N 2.87Å; E111-I114 HydrophobicContact CB-CD1 3.84Å; E111-I114 HydrophobicContact CB-CG1 3.96Å; E111-I114 HydrophobicContact CG-CD1 4.43Å; E111-I114 WeakPolarHBondContact O-CB 3.37Å; E111-I114 PolarHBondContact O-N 3.47Å; E111-I115 PolarHBondContact O-N 3.27Å
112R80.3Confident83.4Confident163 Ų16369.8 Ų69.862%0.61536%0.358SS*.Hα-helixtrans-57.8-46179.7-72.4-176.6177.7-174.91.3113.1Y59 I114 I115 D116Y59-R112 HydrophobicContact CE1-CG 3.72Å; Y59-R112 WeakPolarHBondContact OH-CG 3.24Å; Y59-R112 PolarHBondContact OH-NE 3.33Å; R112-I114 PolarHBondContact O-N 3.23Å; R112-I115 WeakPolarHBondContact O-CG2 3.48Å; R112-I115 PolarHBondContact O-N 3.43Å; R112-D116 PolarHBondContact O-N 3.44Å; R112-D116 VanDerWaalsContact O-N 3.17Å
113W85.5Confident83.5Confident161 Ų16166.1 Ų66.161%0.6134%0.336SS*.Hα-helixtrans-65.2-27.9-177.273-91.5000112.3E111 L117E111-W113 HydrophobicContact CB-CG 4.5Å; E111-W113 PolarHBondContact O-N 2.87Å; W113-L117 HydrophobicContact CE3-CD2 4.22Å; W113-L117 HydrophobicContact CZ3-CD2 3.86Å; W113-L117 WeakPolarHBondContact O-CB 3.28Å; W113-L117 PolarHBondContact O-N 2.99Å
114I86.6Confident83.7Confident36 Ų3671.1 Ų71.119%0.18535%0.346CS..Hα-helixtrans-68.5-44.6178.9-61.6175.8000109.8V110 E111 R112 A118V110-I114 HydrophobicContact CB-CD1 4.44Å; E111-I114 HydrophobicContact CB-CD1 3.84Å; E111-I114 HydrophobicContact CB-CG1 3.96Å; E111-I114 HydrophobicContact CG-CD1 4.43Å; E111-I114 WeakPolarHBondContact O-CB 3.37Å; E111-I114 PolarHBondContact O-N 3.47Å; R112-I114 PolarHBondContact O-N 3.23Å; I114-A118 WeakPolarHBondContact O-CB 3.42Å; I114-A118 PolarHBondContact O-N 3.49Å
115I87.4Confident83.8Confident0 Ų073.8 Ų73.80%035%0.353CS..Hα-helixtrans-71.1-39.7-177.7-159.2159.9000111.9T55 Y56 Y59 Y60 E111 R112 A118 M119T55-I115 HydrophobicContact CG2-CD1 3.65Å; Y56-I115 HydrophobicContact CD2-CG1 4.19Å; Y59-I115 HydrophobicContact CD1-CG2 4.22Å; Y59-I115 HydrophobicContact CD2-CD1 4.35Å; Y59-I115 HydrophobicContact CG-CD1 4.09Å; Y59-I115 HydrophobicContact CG-CG2 4.35Å; Y60-I115 HydrophobicContact CE2-CG2 4.5Å; E111-I115 PolarHBondContact O-N 3.27Å; R112-I115 WeakPolarHBondContact O-CG2 3.48Å; R112-I115 PolarHBondContact O-N 3.43Å; I115-A118 PolarHBondContact O-N 2.98Å; I115-M119 VanDerWaalsContact O-CB 3.27Å; I115-M119 WeakPolarHBondContact O-CB 3.19Å; I115-M119 PolarHBondContact O-N 3.48Å
116D86.1Confident83.8Confident44 Ų4471.8 Ų71.824%0.23535%0.351CS..Hα-helixtrans-66.8-40.2177-62.4-16.9000111.4Y56 Y60 R112 M119 S120 Q173Y56-D116 WeakPolarHBondContact CE2-OD1 3.41Å; Y60-D116 WeakPolarHBondContact CE2-OD1 3.36Å; Y60-D116 VanDerWaalsContact OH-CG 3.3Å; Y60-D116 PolarHBondContact OH-OD1 2.91Å; Y60-D116 PolarHBondContact OH-OD2 2.99Å; R112-D116 PolarHBondContact O-N 3.44Å; R112-D116 VanDerWaalsContact O-N 3.17Å; D116-M119 PolarHBondContact O-N 3.47Å; D116-S120 WeakPolarHBondContact O-CB 3.28Å; D116-S120 PolarHBondContact O-N 2.91Å; D116-S120 PolarHBondContact O-OG 3.33Å; D116-Q173 PolarHBondContact O-NE2 3.25Å
117L86.8Confident83.8Confident87 Ų8764.3 Ų64.346%0.45533%0.326SS..Hα-helixtrans-66.2-46.3175-177.267.2000110.9W113 M119 S120 L121W113-L117 HydrophobicContact CE3-CD2 4.22Å; W113-L117 HydrophobicContact CZ3-CD2 3.86Å; W113-L117 WeakPolarHBondContact O-CB 3.28Å; W113-L117 PolarHBondContact O-N 2.99Å; L117-M119 VanDerWaalsContact C-N 3.28Å; L117-M119 PolarHBondContact O-N 3.49Å; L117-S120 PolarHBondContact O-N 3.28Å; L117-L121 HydrophobicContact CD1-CD1 4.25Å; L117-L121 HydrophobicContact CD1-CG 4.27Å; L117-L121 HydrophobicContact CD2-CD1 4.42Å; L117-L121 HydrophobicContact CG-CD1 3.87Å; L117-L121 HydrophobicContact CG-CG 4.3Å; L117-L121 WeakPolarHBondContact O-CB 3.36Å; L117-L121 VanDerWaalsContact O-CG 3.29Å; L117-L121 WeakPolarHBondContact O-CG 3.48Å; L117-L121 PolarHBondContact O-N 3.1Å
118A86.9Confident83.9Confident22 Ų2261.2 Ų61.218%0.18232%0.316CS..Hα-helixtrans-59-41.9177.600000111.3V52 L108 I114 I115 C122V52-A118 HydrophobicContact CG1-CB 3.9Å; V52-A118 HydrophobicContact CG2-CB 4.42Å; L108-A118 HydrophobicContact CD2-CB 4.35Å; L108-A118 HydrophobicContact CG-CB 4.48Å; I114-A118 WeakPolarHBondContact O-CB 3.42Å; I114-A118 PolarHBondContact O-N 3.49Å; I115-A118 PolarHBondContact O-N 2.98Å; A118-C122 WeakPolarHBondContact O-CB 3.4Å; A118-C122 PolarHBondContact O-N 2.93Å
119M87.4Confident83.7Confident0 Ų062.3 Ų62.30%033%0.326CS..Hα-helixtrans-65.3-43.3177.7-171.938.3-116.800111.6V52 F53 Y56 I115 D116 L117 C122 T123 R177V52-M119 HydrophobicContact CG1-CB 4.25Å; V52-M119 HydrophobicContact CG1-SD 4.47Å; F53-M119 HydrophobicContact CD2-SD 3.97Å; Y56-M119 HydrophobicContact CD1-CG 4.38Å; Y56-M119 HydrophobicContact CD2-CB 3.78Å; Y56-M119 HydrophobicContact CD2-CG 3.74Å; Y56-M119 HydrophobicContact CE2-CB 4.21Å; Y56-M119 HydrophobicContact CE2-CG 4.04Å; Y56-M119 HydrophobicContact CG-CB 4.33Å; Y56-M119 HydrophobicContact CG-CG 3.95Å; I115-M119 VanDerWaalsContact O-CB 3.27Å; I115-M119 WeakPolarHBondContact O-CB 3.19Å; I115-M119 PolarHBondContact O-N 3.48Å; D116-M119 PolarHBondContact O-N 3.47Å; L117-M119 VanDerWaalsContact C-N 3.28Å; L117-M119 PolarHBondContact O-N 3.49Å; M119-C122 PolarHBondContact O-N 3.38Å; M119-T123 WeakPolarHBondContact CE-OG1 3.43Å; M119-T123 PolarHBondContact O-N 2.97Å; M119-T123 VanDerWaalsContact O-N 3.1Å; M119-T123 PolarHBondContact O-OG1 3.38Å; M119-R177 HydrophobicContact CE-CB 3.94Å; M119-R177 VanDerWaalsContact CE-CD 3.43Å; M119-R177 HydrophobicContact CE-CG 3.83Å; M119-R177 PolarHBondContact SD-NH1 2.97Å
120S85.9Confident83.8Confident58 Ų5862.2 Ų62.241%0.40632%0.321SS..Hα-helixtrans-63.2-47.9175-59.40000112.7D116 L117 C122 T123 F124 Q173D116-S120 WeakPolarHBondContact O-CB 3.28Å; D116-S120 PolarHBondContact O-N 2.91Å; D116-S120 PolarHBondContact O-OG 3.33Å; L117-S120 PolarHBondContact O-N 3.28Å; S120-C122 PolarHBondContact O-N 3.42Å; S120-T123 WeakPolarHBondContact O-CB 3.2Å; S120-T123 PolarHBondContact O-N 3.27Å; S120-F124 PolarHBondContact O-N 2.99Å; S120-Q173 PolarHBondContact OG-NE2 2.92Å
121L86.4Confident83.9Confident88 Ų8861.6 Ų61.646%0.46131%0.314SS..Hα-helixtrans-62.6-43177.7-71.4173.3000111.4L117 T123 F124 I125L117-L121 HydrophobicContact CD1-CD1 4.25Å; L117-L121 HydrophobicContact CD1-CG 4.27Å; L117-L121 HydrophobicContact CD2-CD1 4.42Å; L117-L121 HydrophobicContact CG-CD1 3.87Å; L117-L121 HydrophobicContact CG-CG 4.3Å; L117-L121 WeakPolarHBondContact O-CB 3.36Å; L117-L121 VanDerWaalsContact O-CG 3.29Å; L117-L121 WeakPolarHBondContact O-CG 3.48Å; L117-L121 PolarHBondContact O-N 3.1Å; L121-T123 VanDerWaalsContact C-N 3.27Å; L121-T123 PolarHBondContact O-N 3.27Å; L121-F124 PolarHBondContact O-N 3.09Å; L121-I125 WeakPolarHBondContact O-CB 3.37Å; L121-I125 WeakPolarHBondContact O-CD1 3.14Å; L121-I125 WeakPolarHBondContact O-CG1 3.43Å; L121-I125 PolarHBondContact O-N 3.49Å
122C84.3Confident83.8Confident14 Ų1459.2 Ų59.210%0.09531%0.312CS..Hα-helixtrans-57.4-42.4176178.10000111.6G49 V52 A118 M119 S120 S126G49-C122 WeakPolarHBondContact CA-SG 3.47Å; V52-C122 HydrophobicContact CG1-CB 4.3Å; A118-C122 WeakPolarHBondContact O-CB 3.4Å; A118-C122 PolarHBondContact O-N 2.93Å; M119-C122 PolarHBondContact O-N 3.38Å; S120-C122 PolarHBondContact O-N 3.42Å; C122-S126 VanDerWaalsContact O-CB 3.23Å; C122-S126 WeakPolarHBondContact O-CB 3.38Å; C122-S126 PolarHBondContact O-N 3.02Å; C122-S126 PolarHBondContact O-OG 2.7Å
123T84.6Confident83.5Confident19 Ų1955.2 Ų55.212%0.11730%0.3CS..Hα-helixtrans-63-47.9176.3-55.10000111.2M119 S120 L121 S126 A127 R177 M181M119-T123 WeakPolarHBondContact CE-OG1 3.43Å; M119-T123 PolarHBondContact O-N 2.97Å; M119-T123 VanDerWaalsContact O-N 3.1Å; M119-T123 PolarHBondContact O-OG1 3.38Å; S120-T123 WeakPolarHBondContact O-CB 3.2Å; S120-T123 PolarHBondContact O-N 3.27Å; L121-T123 VanDerWaalsContact C-N 3.27Å; L121-T123 PolarHBondContact O-N 3.27Å; T123-S126 PolarHBondContact O-N 3.45Å; T123-A127 WeakPolarHBondContact O-CB 3.44Å; T123-A127 PolarHBondContact O-N 3.14Å; T123-R177 HydrophobicContact CG2-CB 3.95Å; T123-R177 HydrophobicContact CG2-CG 3.94Å; T123-M181 HydrophobicContact CG2-CE 4.15Å; T123-M181 WeakPolarHBondContact O-CE 3.19Å
124F84.7Confident83Confident147 Ų14747.9 Ų47.965%0.64527%0.273SS*.Hα-helixtrans-63.3-46.2-179.4-172.2-98.4000112.1S120 L121 S126 A127 A128S120-F124 PolarHBondContact O-N 2.99Å; L121-F124 PolarHBondContact O-N 3.09Å; F124-S126 VanDerWaalsContact C-N 3.34Å; F124-S126 PolarHBondContact O-N 3.24Å; F124-A127 PolarHBondContact O-N 3.46Å; F124-A128 WeakPolarHBondContact O-CB 2.93Å; F124-A128 PolarHBondContact O-N 3.39Å
125I83.1Confident82.6Confident83 Ų8352.3 Ų52.343%0.42629%0.293SS..Hα-helixtrans-61.3-44.6177.6-68.5165.7000110.6L45 L121 A127 A128 S129L45-I125 HydrophobicContact CD2-CG2 3.53Å; L121-I125 WeakPolarHBondContact O-CB 3.37Å; L121-I125 WeakPolarHBondContact O-CD1 3.14Å; L121-I125 WeakPolarHBondContact O-CG1 3.43Å; L121-I125 PolarHBondContact O-N 3.49Å; I125-A127 VanDerWaalsContact C-N 3.33Å; I125-A127 PolarHBondContact O-N 3.43Å; I125-A128 PolarHBondContact O-N 3Å; I125-S129 WeakPolarHBondContact O-CB 3.33Å; I125-S129 PolarHBondContact O-N 3.02Å
126S81.9Confident81.7Confident35 Ų3556.2 Ų56.225%0.24532%0.319CS..Hα-helixtrans-62.8-41.8177.8-63.90000111.2C122 T123 F124 S129 K130C122-S126 VanDerWaalsContact O-CB 3.23Å; C122-S126 WeakPolarHBondContact O-CB 3.38Å; C122-S126 PolarHBondContact O-N 3.02Å; C122-S126 PolarHBondContact O-OG 2.7Å; T123-S126 PolarHBondContact O-N 3.45Å; F124-S126 VanDerWaalsContact C-N 3.34Å; F124-S126 PolarHBondContact O-N 3.24Å; S126-S129 PolarHBondContact O-N 2.75Å; S126-K130 VanDerWaalsContact O-CG 3.28Å; S126-K130 WeakPolarHBondContact O-CG 3.37Å; S126-K130 PolarHBondContact O-N 2.83Å; S126-K130 VanDerWaalsContact O-N 3.13Å
127A82.5Confident81.1Confident17 Ų1754.7 Ų54.714%0.1431%0.311CS..Hα-helixtrans-64.5-47.3177.200000111.6T123 F124 I125 S129 K130 L131 M181 L184T123-A127 WeakPolarHBondContact O-CB 3.44Å; T123-A127 PolarHBondContact O-N 3.14Å; F124-A127 PolarHBondContact O-N 3.46Å; I125-A127 VanDerWaalsContact C-N 3.33Å; I125-A127 PolarHBondContact O-N 3.43Å; A127-S129 VanDerWaalsContact C-N 3.33Å; A127-S129 PolarHBondContact O-N 3.45Å; A127-K130 PolarHBondContact O-N 2.92Å; A127-L131 WeakPolarHBondContact O-CG 3.44Å; A127-L131 PolarHBondContact O-N 3.47Å; A127-M181 HydrophobicContact CB-CE 4.31Å; A127-L184 VanDerWaalsContact CA-CD1 3.48Å; A127-L184 HydrophobicContact CB-CD1 3.57Å
128A82.7Confident80.3Confident44 Ų4456.3 Ų56.336%0.36431%0.311SS..Hα-helixtrans-60-41.4176.900000112.1F124 I125 K130 L131 A132F124-A128 WeakPolarHBondContact O-CB 2.93Å; F124-A128 PolarHBondContact O-N 3.39Å; I125-A128 PolarHBondContact O-N 3Å; A128-K130 PolarHBondContact O-N 3.43Å; A128-L131 PolarHBondContact O-N 3.24Å; A128-A132 WeakPolarHBondContact O-CB 3.35Å; A128-A132 PolarHBondContact O-N 3.29Å
129S77.4Confident79.5Confident47 Ų4760.4 Ų60.433%0.32934%0.338SS..Hα-helixtrans-61.1-43.7176.3-176.80000112.1I125 S126 A127 A132 Q133I125-S129 WeakPolarHBondContact O-CB 3.33Å; I125-S129 PolarHBondContact O-N 3.02Å; S126-S129 PolarHBondContact O-N 2.75Å; A127-S129 VanDerWaalsContact C-N 3.33Å; A127-S129 PolarHBondContact O-N 3.45Å; S129-A132 PolarHBondContact O-N 3.47Å; S129-Q133 VanDerWaalsContact O-CG 3.3Å; S129-Q133 WeakPolarHBondContact O-CG 3Å; S129-Q133 PolarHBondContact O-N 3.03Å; S129-Q133 PolarHBondContact OG-NE2 3.2Å
130K79.6Confident78.5Confident51 Ų5163.6 Ų63.622%0.22236%0.36CS..Hα-helixtrans-66.7-38.8177.6-66.4-67.8-173-176.90112.2S126 A127 A128 Q133 L134 W151 L184S126-K130 VanDerWaalsContact O-CG 3.28Å; S126-K130 WeakPolarHBondContact O-CG 3.37Å; S126-K130 PolarHBondContact O-N 2.83Å; S126-K130 VanDerWaalsContact O-N 3.13Å; A127-K130 PolarHBondContact O-N 2.92Å; A128-K130 PolarHBondContact O-N 3.43Å; K130-Q133 PolarHBondContact O-N 2.91Å; K130-L134 WeakPolarHBondContact O-CB 3.2Å; K130-L134 PolarHBondContact O-N 3.3Å; K130-W151 HydrophobicContact CD-CH2 3.27Å; K130-W151 HydrophobicContact CD-CZ2 4.46Å; K130-W151 HydrophobicContact CD-CZ3 3.5Å; K130-W151 VanDerWaalsContact CD-CZ3 3.5Å; K130-L184 HydrophobicContact CB-CB 4.24Å; K130-L184 HydrophobicContact CB-CD1 4.27Å
131L80.8Confident77.4Confident76 Ų7668.2 Ų68.240%0.39837%0.373SS..Hα-helixtrans-64.3-43173.3-72.4172.1000112A127 A128 Q133 L134 Q135 L184A127-L131 WeakPolarHBondContact O-CG 3.44Å; A127-L131 PolarHBondContact O-N 3.47Å; A128-L131 PolarHBondContact O-N 3.24Å; L131-Q133 VanDerWaalsContact C-N 3.35Å; L131-Q133 PolarHBondContact O-N 3.18Å; L131-L134 WeakPolarHBondContact O-CB 3.33Å; L131-L134 PolarHBondContact O-N 3.2Å; L131-Q135 WeakPolarHBondContact O-CG 3.48Å; L131-Q135 PolarHBondContact O-N 2.9Å; L131-L184 HydrophobicContact CD2-CD2 3.47Å; L131-L184 VanDerWaalsContact CD2-CD2 3.47Å; L131-L184 HydrophobicContact CG-CD2 3.79Å
132A78.5Confident76.1Confident51 Ų5168.4 Ų68.442%0.42138%0.375SS..Hα-helixtrans-63.2-41175.800000111.8A128 S129 L134 Q135 C136A128-A132 WeakPolarHBondContact O-CB 3.35Å; A128-A132 PolarHBondContact O-N 3.29Å; S129-A132 PolarHBondContact O-N 3.47Å; A132-L134 VanDerWaalsContact C-N 3.34Å; A132-L134 PolarHBondContact O-N 3.14Å; A132-Q135 PolarHBondContact O-N 2.75Å; A132-C136 WeakPolarHBondContact O-CB 3.2Å; A132-C136 PolarHBondContact O-N 3.42Å
133Q74.1Confident74.6Confident79 Ų7968 Ų6837%0.36937%0.373SS..Hα-helixtrans-60.2-43.2173.5-73.2170.236.200111.6S129 K130 L131 C136 M137S129-Q133 VanDerWaalsContact O-CG 3.3Å; S129-Q133 WeakPolarHBondContact O-CG 3Å; S129-Q133 PolarHBondContact O-N 3.03Å; S129-Q133 PolarHBondContact OG-NE2 3.2Å; K130-Q133 PolarHBondContact O-N 2.91Å; L131-Q133 VanDerWaalsContact C-N 3.35Å; L131-Q133 PolarHBondContact O-N 3.18Å; Q133-C136 PolarHBondContact O-N 3.11Å; Q133-M137 WeakPolarHBondContact O-CB 3.27Å; Q133-M137 PolarHBondContact O-N 3.01Å
134L76Confident72.9Confident7 Ų769.7 Ų69.74%0.03739%0.394CS..Hα-helixtrans-62.3-45.7176.1-178.367.8000112K130 L131 A132 M137 W138 W187 V188 T191K130-L134 WeakPolarHBondContact O-CB 3.2Å; K130-L134 PolarHBondContact O-N 3.3Å; L131-L134 WeakPolarHBondContact O-CB 3.33Å; L131-L134 PolarHBondContact O-N 3.2Å; A132-L134 VanDerWaalsContact C-N 3.34Å; A132-L134 PolarHBondContact O-N 3.14Å; L134-M137 HydrophobicContact CD1-CE 3.86Å; L134-M137 PolarHBondContact O-N 3.18Å; L134-W138 PolarHBondContact O-N 2.95Å; L134-W187 HydrophobicContact CD2-CD2 4.14Å; L134-W187 HydrophobicContact CD2-CG 3.92Å; L134-V188 HydrophobicContact CB-CG2 4.18Å; L134-V188 HydrophobicContact CD1-CG2 4.17Å; L134-T191 HydrophobicContact CD1-CG2 3.98Å; L134-T191 WeakPolarHBondContact CD1-OG1 3.23Å
135Q77.2Confident71.3Confident130 Ų13072 Ų7261%0.60741%0.406SS*.Hα-helixtrans-61.7-44.3177.2-73.6176.3-9.200112L131 A132 M137 W138 S139L131-Q135 WeakPolarHBondContact O-CG 3.48Å; L131-Q135 PolarHBondContact O-N 2.9Å; A132-Q135 PolarHBondContact O-N 2.75Å; Q135-M137 VanDerWaalsContact C-N 3.3Å; Q135-M137 PolarHBondContact O-N 3.23Å; Q135-W138 PolarHBondContact O-N 3.17Å; Q135-S139 PolarHBondContact O-N 2.68Å
136C69.6Low70.3Confident82 Ų8270.3 Ų70.355%0.55440%0.4SS*.Hα-helixtrans-61.5-40.7176.6-1730000111.4A132 Q133 S139 S140A132-C136 WeakPolarHBondContact O-CB 3.2Å; A132-C136 PolarHBondContact O-N 3.42Å; Q133-C136 PolarHBondContact O-N 3.11Å; C136-S139 PolarHBondContact O-N 2.74Å; C136-S140 WeakPolarHBondContact O-CB 3.35Å; C136-S140 PolarHBondContact O-N 3.37Å; C136-S140 PolarHBondContact O-OG 3.39Å
137M71.6Confident69.7Low12 Ų1271.1 Ų71.16%0.05941%0.406CS..Hα-helixtrans-66.6-38.4177.2-173.4171.746.500112.5Q133 L134 Q135 K141 A143 V188 T191 V192 Y195Q133-M137 WeakPolarHBondContact O-CB 3.27Å; Q133-M137 PolarHBondContact O-N 3.01Å; L134-M137 HydrophobicContact CD1-CE 3.86Å; L134-M137 PolarHBondContact O-N 3.18Å; Q135-M137 VanDerWaalsContact C-N 3.3Å; Q135-M137 PolarHBondContact O-N 3.23Å; M137-K141 PolarHBondContact O-N 2.93Å; M137-A143 HydrophobicContact SD-CB 4.29Å; M137-V188 HydrophobicContact CE-CG1 3.9Å; M137-T191 HydrophobicContact CE-CG2 3.48Å; M137-T191 VanDerWaalsContact CE-CG2 3.48Å; M137-T191 HydrophobicContact SD-CG2 4.29Å; M137-V192 HydrophobicContact CE-CG2 4.07Å; M137-V192 HydrophobicContact SD-CG2 3.57Å; M137-V192 VanDerWaalsContact SD-CG2 3.57Å; M137-Y195 HydrophobicContact CG-CD2 4.47Å; M137-Y195 HydrophobicContact CG-CE2 4.49Å
138W71.7Confident69.2Low121 Ų12171.2 Ų71.246%0.45841%0.406SS..Hα-helixtrans-65.2-38.7172.9-81-11.7000113.2L134 Q135 W187 T191 Y195L134-W138 PolarHBondContact O-N 2.95Å; Q135-W138 PolarHBondContact O-N 3.17Å; W138-W187 AromaticContact CH2-CZ2 3.92Å; W138-W187 HydrophobicContact CH2-CZ2 3.92Å; W138-W187 AromaticContact CH2-NE1 3.92Å; W138-W187 HydrophobicContact CZ2-CZ2 4.38Å; W138-W187 AromaticContact CZ2-NE1 3.57Å; W138-T191 VanDerWaalsContact NE1-CG2 3.31Å; W138-Y195 AromaticContact CD1-CE2 3.78Å; W138-Y195 VanDerWaalsContact CD1-OH 3.3Å
139S68.6Low68.7Low107 Ų10775.5 Ų75.575%0.74842%0.423SS*.Hα-helixtrans-71.4-45.7179.1-178.50000112.4Q135 C136Q135-S139 PolarHBondContact O-N 2.68Å; C136-S139 PolarHBondContact O-N 2.74Å
140S66.9Low68.5Low67 Ų6776.2 Ų76.247%0.46943%0.427SS..Hα-helixtrans-77.6-23.5-177.156.70000113.9C136 D142C136-S140 WeakPolarHBondContact O-CB 3.35Å; C136-S140 PolarHBondContact O-N 3.37Å; C136-S140 PolarHBondContact O-OG 3.39Å; S140-D142 PolarHBondContact O-N 2.96Å
141K64.2Low68.5Low155 Ų15574.7 Ų74.767%0.67442%0.421SS*.  trans53.710-172.1-63.4-178179.9171.30114.7M137 Y195M137-K141 PolarHBondContact O-N 2.93Å; K141-Y195 HydrophobicContact CB-CE1 4.16Å; K141-Y195 HydrophobicContact CG-CE1 4.08Å
142D57.5Low68.5Low92 Ų9272.3 Ų72.349%0.49241%0.414SS..  trans-108.488.3-178-155.3-6.2000110S140 G144 R199S140-D142 PolarHBondContact O-N 2.96Å; D142-G144 PolarHBondContact O-N 2.91Å; D142-G144 PolarHBondContact OD1-N 3.1Å; D142-R199 IonicContact OD1-NH1 3.27Å; D142-R199 PolarHBondContact OD1-NH1 3.48Å; D142-R199 VanDerWaalsContact OD1-NH1 3.07Å
143A52.8Low68.6Low6 Ų673 Ų735%0.0541%0.41CS..G310 helixtrans-79.95.817600000112.9M137 Q145 V146 Y195M137-A143 HydrophobicContact SD-CB 4.29Å; A143-Q145 VanDerWaalsContact C-N 3.29Å; A143-Q145 PolarHBondContact O-N 3.34Å; A143-V146 PolarHBondContact O-N 3.23Å; A143-Y195 HydrophobicContact CB-CD2 4.48Å; A143-Y195 HydrophobicContact CB-CG 4.35Å
144G50.3Low68.9Low55 Ų5570.8 Ų70.857%0.56741%0.405SS*.G310 helixtrans-64.8-26.6-171.100000114.9D142D142-G144 PolarHBondContact O-N 2.91Å; D142-G144 PolarHBondContact OD1-N 3.1Å
145Q50.9Low69.3Low194 Ų19471.1 Ų71.191%0.90741%0.407SS*.G310 helixtrans-87-8.9179.7-63.2-157.7-11.300113.8A143A143-Q145 VanDerWaalsContact C-N 3.29Å; A143-Q145 PolarHBondContact O-N 3.34Å
146V61.6Low69.7Low48 Ų4870 Ų7029%0.29140%0.398SS..SBendtrans-113.8112-170.3-171.70000109.8A143 A148 W151 V192A143-V146 PolarHBondContact O-N 3.23Å; V146-A148 PolarHBondContact O-N 2.9Å; V146-W151 VanDerWaalsContact CG1-CD1 3.45Å; V146-V192 HydrophobicContact CB-CG2 4.34Å; V146-V192 HydrophobicContact CG1-CG2 3.98Å; V146-V192 WeakPolarHBondContact O-CG1 3.42Å
147S69.3Low70.4Confident52 Ų5267 Ų6736%0.36438%0.378SS..  trans-77.5122.6-176.2177.80000112.1L149 S150 W151S147-L149 PolarHBondContact O-N 3.27Å; S147-L149 PolarHBondContact OG-N 2.84Å; S147-S150 WeakPolarHBondContact O-CB 3.45Å; S147-S150 PolarHBondContact O-N 3Å; S147-S150 VanDerWaalsContact O-N 3.09Å; S147-W151 PolarHBondContact O-N 3.43Å
148A73Confident71.1Confident19 Ų1967.3 Ų67.316%0.15738%0.38CS..Hα-helixtrans-57.1-33.5173.900000112V146 S150 W151 G152 L189 V192 I193V146-A148 PolarHBondContact O-N 2.9Å; A148-S150 PolarHBondContact O-N 3.49Å; A148-W151 PolarHBondContact O-N 3.31Å; A148-G152 PolarHBondContact O-N 3.28Å; A148-L189 HydrophobicContact CB-CD1 4.16Å; A148-L189 WeakPolarHBondContact O-CD1 3.13Å; A148-V192 HydrophobicContact CB-CG1 3.87Å; A148-I193 HydrophobicContact CB-CG1 4.35Å
149L72.1Confident71.8Confident135 Ų13566.8 Ų66.871%0.70738%0.384SS*.Hα-helixtrans-63.8-41.6177-68168.9000111.6S147 W151 G152 M153S147-L149 PolarHBondContact O-N 3.27Å; S147-L149 PolarHBondContact OG-N 2.84Å; L149-W151 PolarHBondContact O-N 3.42Å; L149-G152 PolarHBondContact O-N 3.44Å; L149-M153 WeakPolarHBondContact O-CE 3.4Å; L149-M153 WeakPolarHBondContact O-CG 3.46Å; L149-M153 PolarHBondContact O-N 3.34Å
150S72.2Confident72.6Confident61 Ų6162.3 Ų62.343%0.42735%0.354SS..Hα-helixtrans-63.1-42.1178.8-58.60000111.9S147 A148 A154S147-S150 WeakPolarHBondContact O-CB 3.45Å; S147-S150 PolarHBondContact O-N 3Å; S147-S150 VanDerWaalsContact O-N 3.09Å; A148-S150 PolarHBondContact O-N 3.49Å; S150-A154 WeakPolarHBondContact O-CB 3.35Å; S150-A154 PolarHBondContact O-N 2.98Å
151W79.4Confident73.4Confident20 Ų2059.2 Ų59.28%0.07633%0.332CS..Hα-helixtrans-73.2-32.3176.7-71.394.5000113.1K130 V146 S147 A148 L149 A154 T155 N185 V188 L189K130-W151 HydrophobicContact CD-CH2 3.27Å; K130-W151 HydrophobicContact CD-CZ2 4.46Å; K130-W151 HydrophobicContact CD-CZ3 3.5Å; K130-W151 VanDerWaalsContact CD-CZ3 3.5Å; V146-W151 VanDerWaalsContact CG1-CD1 3.45Å; S147-W151 PolarHBondContact O-N 3.43Å; A148-W151 PolarHBondContact O-N 3.31Å; L149-W151 PolarHBondContact O-N 3.42Å; W151-A154 PolarHBondContact O-N 3.46Å; W151-T155 WeakPolarHBondContact O-CB 3.43Å; W151-T155 PolarHBondContact O-N 2.87Å; W151-T155 PolarHBondContact O-OG1 3.44Å; W151-N185 HydrophobicContact CE3-CB 4.14Å; W151-N185 HydrophobicContact CZ3-CB 4.44Å; W151-N185 WeakPolarHBondContact CZ3-OD1 3.16Å; W151-V188 HydrophobicContact CD2-CB 4.02Å; W151-V188 HydrophobicContact CD2-CG1 3.47Å; W151-V188 VanDerWaalsContact CD2-CG1 3.47Å; W151-V188 VanDerWaalsContact CE2-CG1 3.42Å; W151-V188 HydrophobicContact CE3-CB 3.67Å; W151-V188 HydrophobicContact CE3-CG1 3.65Å; W151-V188 HydrophobicContact CE3-CG2 4.35Å; W151-V188 HydrophobicContact CG-CG1 4.06Å; W151-V188 HydrophobicContact CH2-CB 3.93Å; W151-V188 HydrophobicContact CH2-CG1 3.58Å; W151-V188 HydrophobicContact CH2-CG2 3.85Å; W151-V188 HydrophobicContact CZ2-CB 4.37Å; W151-V188 HydrophobicContact CZ2-CG1 3.54Å; W151-V188 HydrophobicContact CZ3-CB 3.59Å; W151-V188 HydrophobicContact CZ3-CG1 3.67Å; W151-V188 HydrophobicContact CZ3-CG2 3.75Å; W151-L189 HydrophobicContact CB-CB 4.1Å; W151-L189 HydrophobicContact CB-CD1 4.08Å
152G81.4Confident74.6Confident26 Ų2653.8 Ų53.827%0.26831%0.31SS..Hα-helixtrans-61.9-49.3171.100000112.1A148 L149 A154 T155 Y156A148-G152 PolarHBondContact O-N 3.28Å; L149-G152 PolarHBondContact O-N 3.44Å; G152-A154 VanDerWaalsContact C-N 3.35Å; G152-A154 PolarHBondContact O-N 3.32Å; G152-T155 PolarHBondContact O-N 2.9Å; G152-Y156 PolarHBondContact O-N 2.96Å
153M79.3Confident75.9Confident65 Ų6553.2 Ų53.232%0.3230%0.301SS..Hα-helixtrans-61.8-40.6175.9-71.1-176.1-69.200112.2L17 L21 L149 Y156 T157L17-M153 HydrophobicContact CD2-SD 4.35Å; L21-M153 HydrophobicContact CD2-CE 4.1Å; L21-M153 HydrophobicContact CD2-SD 4.47Å; L149-M153 WeakPolarHBondContact O-CE 3.4Å; L149-M153 WeakPolarHBondContact O-CG 3.46Å; L149-M153 PolarHBondContact O-N 3.34Å; M153-Y156 PolarHBondContact O-N 3.16Å; M153-T157 WeakPolarHBondContact O-CB 3.39Å; M153-T157 PolarHBondContact O-N 3.02Å; M153-T157 PolarHBondContact O-OG1 2.99Å
154A81.1Confident77.4Confident32 Ų3253 Ų5326%0.26430%0.299SS..Hα-helixtrans-63.6-41.3176.100000112.2S150 W151 G152 T157 C158S150-A154 WeakPolarHBondContact O-CB 3.35Å; S150-A154 PolarHBondContact O-N 2.98Å; W151-A154 PolarHBondContact O-N 3.46Å; G152-A154 VanDerWaalsContact C-N 3.35Å; G152-A154 PolarHBondContact O-N 3.32Å; A154-T157 PolarHBondContact O-N 3.39Å; A154-C158 PolarHBondContact O-N 3.5Å; A154-C158 PolarHBondContact O-SG 3.01Å
155T84.5Confident79.1Confident15 Ų1550.4 Ų50.49%0.09227%0.272CS..Hα-helixtrans-64.4-46.6176.2-54.20000111W151 G152 T157 C158 M159 T182 N185 F186W151-T155 WeakPolarHBondContact O-CB 3.43Å; W151-T155 PolarHBondContact O-N 2.87Å; W151-T155 PolarHBondContact O-OG1 3.44Å; G152-T155 PolarHBondContact O-N 2.9Å; T155-T157 VanDerWaalsContact C-N 3.34Å; T155-T157 PolarHBondContact O-N 3.29Å; T155-C158 PolarHBondContact O-N 3.45Å; T155-M159 WeakPolarHBondContact O-CB 3.46Å; T155-M159 PolarHBondContact O-N 3.46Å; T155-T182 HydrophobicContact CG2-CG2 4.04Å; T155-N185 WeakPolarHBondContact OG1-CB 3.38Å; T155-F186 HydrophobicContact CG2-CB 4.15Å; T155-F186 HydrophobicContact CG2-CD2 4.29Å
156Y85.7Confident80.7Confident105 Ų10544.2 Ų44.241%0.41225%0.25SS..Hα-helixtrans-58.1-46.1175.6172.5-97.5000111.9S13 L17 G152 M153 C158 M159 A160S13-Y156 PolarHBondContact OG-OH 3.07Å; L17-Y156 HydrophobicContact CD1-CD1 3.76Å; L17-Y156 HydrophobicContact CD1-CE1 3.7Å; G152-Y156 PolarHBondContact O-N 2.96Å; M153-Y156 PolarHBondContact O-N 3.16Å; Y156-C158 PolarHBondContact O-N 3.14Å; Y156-M159 PolarHBondContact O-N 3.35Å; Y156-A160 WeakPolarHBondContact O-CB 3.24Å; Y156-A160 PolarHBondContact O-N 3.01Å
157T84.4Confident81.8Confident21 Ų2145.6 Ų45.613%0.12926%0.259CS..Hα-helixtrans-62.9-43.8-179.5-55.30000111.3T14 M153 A154 T155 M159 A160 R161T14-T157 HydrophobicContact CG2-CG2 4.08Å; M153-T157 WeakPolarHBondContact O-CB 3.39Å; M153-T157 PolarHBondContact O-N 3.02Å; M153-T157 PolarHBondContact O-OG1 2.99Å; A154-T157 PolarHBondContact O-N 3.39Å; T155-T157 VanDerWaalsContact C-N 3.34Å; T155-T157 PolarHBondContact O-N 3.29Å; T157-M159 PolarHBondContact O-N 2.95Å; T157-A160 PolarHBondContact O-N 3.01Å; T157-R161 VanDerWaalsContact O-CG 3.29Å; T157-R161 WeakPolarHBondContact O-CG 3.3Å; T157-R161 PolarHBondContact O-N 2.89Å
158C85.9Confident82.3Confident17 Ų1745.3 Ų45.312%0.11526%0.255CS..Hα-helixtrans-65.3-39.8176.8-63.60000111.6A154 T155 Y156 R161 I162 F178 T182A154-C158 PolarHBondContact O-N 3.5Å; A154-C158 PolarHBondContact O-SG 3.01Å; T155-C158 PolarHBondContact O-N 3.45Å; Y156-C158 PolarHBondContact O-N 3.14Å; C158-R161 WeakPolarHBondContact O-CB 3.28Å; C158-R161 PolarHBondContact O-N 2.99Å; C158-R161 VanDerWaalsContact O-N 3.16Å; C158-I162 WeakPolarHBondContact O-CG1 3.43Å; C158-I162 PolarHBondContact O-N 3.01Å; C158-F178 HydrophobicContact CB-CD1 4.47Å; C158-T182 WeakPolarHBondContact CB-OG1 3.41Å
159M86.4Confident82.8Confident111 Ų11146 Ų4655%0.54726%0.257SS..Hα-helixtrans-65.8-42.1177.6-170.816665.100112.4T155 Y156 T157 R161 I162 Y163T155-M159 WeakPolarHBondContact O-CB 3.46Å; T155-M159 PolarHBondContact O-N 3.46Å; Y156-M159 PolarHBondContact O-N 3.35Å; T157-M159 PolarHBondContact O-N 2.95Å; M159-R161 PolarHBondContact O-N 3.01Å; M159-I162 PolarHBondContact O-N 3.21Å; M159-Y163 PolarHBondContact O-N 3.45Å
160A84.9Confident83.1Confident12 Ų1241.5 Ų41.510%0.09924%0.243CC..Hα-helixtrans-58.6-39.5171.900000111.1T14 Y156 T157 Y163 T164T14-A160 HydrophobicContact CG2-CB 3.57Å; Y156-A160 WeakPolarHBondContact O-CB 3.24Å; Y156-A160 PolarHBondContact O-N 3.01Å; T157-A160 PolarHBondContact O-N 3.01Å; A160-Y163 PolarHBondContact O-N 2.95Å; A160-T164 WeakPolarHBondContact O-CG2 3.49Å; A160-T164 PolarHBondContact O-N 2.82Å; A160-T164 PolarHBondContact O-OG1 2.97Å
161R85.4Confident83.8Confident2 Ų239.6 Ų39.61%0.00823%0.228CC..Hα-helixtrans-70.2-33.4176.9-69.9-73.2155.7-170.8-9.4113.9T14 P65 T66 E69 T157 C158 M159 Y163 T164 T165 F178T14-R161 PolarHBondContact OG1-NH2 2.9Å; P65-R161 PolarHBondContact O-NH1 3.22Å; T66-R161 PolarHBondContact O-NH1 2.83Å; E69-R161 IonicContact OE1-CZ 2.9Å; E69-R161 IonicContact OE1-NE 2.97Å; E69-R161 PolarHBondContact OE1-NE 3.38Å; E69-R161 IonicContact OE1-NH1 3.07Å; E69-R161 PolarHBondContact OE1-NH1 3.43Å; E69-R161 IonicContact OE1-NH2 2.75Å; E69-R161 PolarHBondContact OE1-NH2 2.96Å; E69-R161 IonicContact OE2-CZ 3.02Å; E69-R161 IonicContact OE2-NH1 2.95Å; E69-R161 PolarHBondContact OE2-NH1 2.9Å; E69-R161 IonicContact OE2-NH2 2.69Å; E69-R161 PolarHBondContact OE2-NH2 3.05Å; T157-R161 VanDerWaalsContact O-CG 3.29Å; T157-R161 WeakPolarHBondContact O-CG 3.3Å; T157-R161 PolarHBondContact O-N 2.89Å; C158-R161 WeakPolarHBondContact O-CB 3.28Å; C158-R161 PolarHBondContact O-N 2.99Å; C158-R161 VanDerWaalsContact O-N 3.16Å; M159-R161 PolarHBondContact O-N 3.01Å; R161-Y163 VanDerWaalsContact C-N 3.31Å; R161-T164 WeakPolarHBondContact CA-OG1 3.29Å; R161-T164 PolarHBondContact O-OG1 2.75Å; R161-T165 WeakPolarHBondContact O-CB 3.49Å; R161-T165 PolarHBondContact O-N 3.14Å; R161-T165 PolarHBondContact O-OG1 3.19Å; R161-F178 HydrophobicContact CB-CD1 3.68Å; R161-F178 HydrophobicContact CB-CD2 3.79Å; R161-F178 HydrophobicContact CB-CE1 3.56Å; R161-F178 HydrophobicContact CB-CE2 3.66Å; R161-F178 HydrophobicContact CB-CG 3.81Å; R161-F178 HydrophobicContact CB-CZ 3.56Å; R161-F178 HydrophobicContact CG-CD1 4.36Å; R161-F178 HydrophobicContact CG-CE1 3.81Å; R161-F178 HydrophobicContact CG-CE2 4.32Å; R161-F178 HydrophobicContact CG-CZ 3.79Å
162I87.9Confident84Confident41 Ų4145.1 Ų45.121%0.2126%0.256CS..Hα-helixtrans-58.8-48.4170.8-66.7169000109.4C158 M159 S166 L175 F178 V179 T182C158-I162 WeakPolarHBondContact O-CG1 3.43Å; C158-I162 PolarHBondContact O-N 3.01Å; M159-I162 PolarHBondContact O-N 3.21Å; I162-S166 WeakPolarHBondContact O-CB 3.32Å; I162-S166 PolarHBondContact O-N 3.32Å; I162-S166 PolarHBondContact O-OG 3.46Å; I162-L175 HydrophobicContact CG2-CD1 4.03Å; I162-F178 HydrophobicContact CD1-CB 4.43Å; I162-F178 HydrophobicContact CG1-CB 3.58Å; I162-V179 HydrophobicContact CD1-CB 4.46Å; I162-V179 HydrophobicContact CD1-CG2 3.82Å; I162-V179 HydrophobicContact CG1-CG2 4.17Å; I162-T182 WeakPolarHBondContact CD1-OG1 3.43Å
163Y85.9Confident84.1Confident81 Ų8146.1 Ų46.132%0.31825%0.254SS..Hα-helixtrans-64.4-48.3179.5175.5-102.8000112.4L6 L7 M159 A160 R161 T165 S166 V167L6-Y163 HydrophobicContact CB-CE1 4.39Å; L7-Y163 HydrophobicContact CD1-CE1 4.48Å; M159-Y163 PolarHBondContact O-N 3.45Å; A160-Y163 PolarHBondContact O-N 2.95Å; R161-Y163 VanDerWaalsContact C-N 3.31Å; Y163-T165 PolarHBondContact O-N 2.81Å; Y163-S166 PolarHBondContact O-N 2.9Å; Y163-S166 PolarHBondContact O-OG 2.84Å; Y163-V167 HydrophobicContact CD2-CG2 4.3Å; Y163-V167 HydrophobicContact CE2-CG2 3.95Å; Y163-V167 VanDerWaalsContact O-CG2 3.32Å; Y163-V167 WeakPolarHBondContact O-CG2 3.47Å; Y163-V167 PolarHBondContact O-N 2.95Å
164T84Confident84.4Confident0 Ų043 Ų430%024%0.239CC..Hα-helixtrans-66.7-39.9-179.259.80000111.4L7 A10 A160 R161 V167 T168L7-T164 HydrophobicContact CD1-CG2 4.04Å; A10-T164 HydrophobicContact CB-CG2 3.9Å; A160-T164 WeakPolarHBondContact O-CG2 3.49Å; A160-T164 PolarHBondContact O-N 2.82Å; A160-T164 PolarHBondContact O-OG1 2.97Å; R161-T164 WeakPolarHBondContact CA-OG1 3.29Å; R161-T164 PolarHBondContact O-OG1 2.75Å; T164-V167 PolarHBondContact O-N 3.23Å; T164-T168 VanDerWaalsContact O-CB 3.31Å; T164-T168 WeakPolarHBondContact O-CB 3.46Å; T164-T168 VanDerWaalsContact O-CG2 3.31Å; T164-T168 WeakPolarHBondContact O-CG2 3.2Å; T164-T168 PolarHBondContact O-N 2.64Å; T164-T168 PolarHBondContact O-OG1 3.36Å
165T85.5Confident84.7Confident2 Ų243.3 Ų43.31%0.01224%0.236CC..Hα-helixtrans-64-45.5177.8-55.90000111.2R161 Y163 V167 T168 T169 G170 V174 L175R161-T165 WeakPolarHBondContact O-CB 3.49Å; R161-T165 PolarHBondContact O-N 3.14Å; R161-T165 PolarHBondContact O-OG1 3.19Å; Y163-T165 PolarHBondContact O-N 2.81Å; T165-V167 VanDerWaalsContact C-N 3.27Å; T165-V167 PolarHBondContact O-N 3.1Å; T165-T168 PolarHBondContact O-N 3.39Å; T165-T169 WeakPolarHBondContact CG2-OG1 3.41Å; T165-T169 PolarHBondContact O-N 3.02Å; T165-T169 PolarHBondContact O-OG1 3.16Å; T165-G170 PolarHBondContact O-N 3.11Å; T165-V174 HydrophobicContact CG2-CB 4.02Å; T165-V174 HydrophobicContact CG2-CG1 3.67Å; T165-L175 HydrophobicContact CG2-CD1 4.27Å
166S84.9Confident84.8Confident63 Ų6347 Ų4744%0.44126%0.258SS..Hα-helixtrans-64.1-33-179.465.90000112.8I162 Y163I162-S166 WeakPolarHBondContact O-CB 3.32Å; I162-S166 PolarHBondContact O-N 3.32Å; I162-S166 PolarHBondContact O-OG 3.46Å; Y163-S166 PolarHBondContact O-N 2.9Å; Y163-S166 PolarHBondContact O-OG 2.84Å
167V83.7Confident84.9Confident77 Ų7742.9 Ų42.947%0.46724%0.242SC..Hα-helixtrans-83.6-31.3179.31770000112.7L7 Y163 T164 T165L7-V167 HydrophobicContact CD1-CB 4.06Å; L7-V167 HydrophobicContact CD1-CG1 3.97Å; Y163-V167 HydrophobicContact CD2-CG2 4.3Å; Y163-V167 HydrophobicContact CE2-CG2 3.95Å; Y163-V167 VanDerWaalsContact O-CG2 3.32Å; Y163-V167 WeakPolarHBondContact O-CG2 3.47Å; Y163-V167 PolarHBondContact O-N 2.95Å; T164-V167 PolarHBondContact O-N 3.23Å; T165-V167 VanDerWaalsContact C-N 3.27Å; T165-V167 PolarHBondContact O-N 3.1Å
168T81.1Confident85Confident46 Ų4642.3 Ų42.328%0.28224%0.237SC..Hα-helixtrans-98.7-47.4-171.955.20000114.7L7 T66 T164 T165L7-T168 HydrophobicContact CD1-CG2 3.87Å; L7-T168 HydrophobicContact CD2-CG2 3.93Å; L7-T168 HydrophobicContact CG-CG2 4.44Å; T66-T168 HydrophobicContact CG2-CG2 4.34Å; T66-T168 VanDerWaalsContact CG2-OG1 3.3Å; T66-T168 WeakPolarHBondContact CG2-OG1 3.12Å; T164-T168 VanDerWaalsContact O-CB 3.31Å; T164-T168 WeakPolarHBondContact O-CB 3.46Å; T164-T168 VanDerWaalsContact O-CG2 3.31Å; T164-T168 WeakPolarHBondContact O-CG2 3.2Å; T164-T168 PolarHBondContact O-N 2.64Å; T164-T168 PolarHBondContact O-OG1 3.36Å; T165-T168 PolarHBondContact O-N 3.39Å
169T82.8Confident85.2Confident35 Ų3544.3 Ų44.322%0.21525%0.249CC..THydrogen-bonded Turntrans-115.9-34-172.259.20000112.5Y62 T66 T165 D171Y62-T169 HydrophobicContact CD1-CG2 3.33Å; Y62-T169 HydrophobicContact CD2-CG2 4.19Å; Y62-T169 HydrophobicContact CE1-CG2 3.9Å; Y62-T169 HydrophobicContact CG-CG2 3.52Å; T66-T169 HydrophobicContact CG2-CG2 4.34Å; T165-T169 WeakPolarHBondContact CG2-OG1 3.41Å; T165-T169 PolarHBondContact O-N 3.02Å; T165-T169 PolarHBondContact O-OG1 3.16Å; T169-D171 PolarHBondContact O-N 3.38Å
170G79.4Confident85.3Confident39 Ų3940.4 Ų40.440%0.40224%0.235SC..  trans65.814.1-175.800000114.1T165 M172T165-G170 PolarHBondContact O-N 3.11Å; G170-M172 PolarHBondContact O-N 3.44Å
171D85.8Confident85.4Confident22 Ų2240.7 Ų40.712%0.11823%0.234CC..  trans-70.2115.3-177.5-178.3-9.2000111.1Y56 Y62 T169 Q173 V174 L175Y56-D171 WeakPolarHBondContact CE1-OD2 3.44Å; Y56-D171 PolarHBondContact OH-OD2 3.03Å; Y62-D171 HydrophobicContact CE2-CB 4.46Å; Y62-D171 WeakPolarHBondContact OH-CB 3.35Å; Y62-D171 PolarHBondContact OH-OD2 3.48Å; T169-D171 PolarHBondContact O-N 3.38Å; D171-Q173 VanDerWaalsContact C-N 3.32Å; D171-Q173 PolarHBondContact O-N 2.88Å; D171-Q173 WeakPolarHBondContact OD1-CB 3.4Å; D171-Q173 PolarHBondContact OD1-N 3.44Å; D171-V174 HydrophobicContact CB-CB 4.24Å; D171-V174 HydrophobicContact CB-CG2 4.25Å; D171-V174 PolarHBondContact O-N 3.36Å; D171-V174 WeakPolarHBondContact OD2-CG2 3.23Å; D171-L175 VanDerWaalsContact O-CB 3.32Å; D171-L175 WeakPolarHBondContact O-CB 3.47Å; D171-L175 PolarHBondContact O-N 2.91Å
172M84.6Confident85.5Confident135 Ų13541.5 Ų41.567%0.66524%0.239SC*.Hα-helixtrans-62.5-34.2179.6-68.7-64.1160.600113.1G170 L175 V176G170-M172 PolarHBondContact O-N 3.44Å; M172-L175 PolarHBondContact O-N 3.41Å; M172-L175 HydrophobicContact SD-CD2 4.37Å; M172-V176 WeakPolarHBondContact O-CB 3.44Å; M172-V176 WeakPolarHBondContact O-CG2 3.42Å; M172-V176 PolarHBondContact O-N 3.5Å
173Q82.7Confident85.6Confident48 Ų4845 Ų4522%0.22426%0.258CS..Hα-helixtrans-68-45.1-179.7-170.2173.73.400110.9Y56 D116 S120 D171 R177Y56-Q173 PolarHBondContact OH-OE1 3.26Å; Y56-Q173 VanDerWaalsContact OH-OE1 3.09Å; D116-Q173 PolarHBondContact O-NE2 3.25Å; S120-Q173 PolarHBondContact OG-NE2 2.92Å; D171-Q173 VanDerWaalsContact C-N 3.32Å; D171-Q173 PolarHBondContact O-N 2.88Å; D171-Q173 WeakPolarHBondContact OD1-CB 3.4Å; D171-Q173 PolarHBondContact OD1-N 3.44Å; Q173-R177 PolarHBondContact O-N 3.44Å; Q173-R177 VanDerWaalsContact O-N 3.12Å
174V85.2Confident85.6Confident0 Ų042.2 Ų42.20%025%0.249CC..Hα-helixtrans-66.7-39.7175.3176.70000110.8F53 Y56 T165 D171 R177 F178F53-V174 HydrophobicContact CE2-CG1 3.99Å; F53-V174 HydrophobicContact CE2-CG2 4.42Å; F53-V174 HydrophobicContact CZ-CG1 4.05Å; Y56-V174 HydrophobicContact CD1-CG2 4.17Å; Y56-V174 HydrophobicContact CE1-CG2 3.65Å; T165-V174 HydrophobicContact CG2-CB 4.02Å; T165-V174 HydrophobicContact CG2-CG1 3.67Å; D171-V174 HydrophobicContact CB-CB 4.24Å; D171-V174 HydrophobicContact CB-CG2 4.25Å; D171-V174 PolarHBondContact O-N 3.36Å; D171-V174 WeakPolarHBondContact OD2-CG2 3.23Å; V174-R177 WeakPolarHBondContact O-CB 3.05Å; V174-R177 PolarHBondContact O-N 2.84Å; V174-F178 HydrophobicContact CG1-CD2 3.7Å; V174-F178 HydrophobicContact CG1-CE2 3.39Å; V174-F178 VanDerWaalsContact O-CD2 3.23Å; V174-F178 WeakPolarHBondContact O-CD2 3.27Å; V174-F178 PolarHBondContact O-N 2.69Å; V174-F178 VanDerWaalsContact O-N 3.08Å
175L87.3Confident85.7Confident38 Ų3842.6 Ų42.620%0.19925%0.251CS..Hα-helixtrans-63.6-46.9177.9-156.178000111.6I162 T165 D171 M172 R177 F178 V179I162-L175 HydrophobicContact CG2-CD1 4.03Å; T165-L175 HydrophobicContact CG2-CD1 4.27Å; D171-L175 VanDerWaalsContact O-CB 3.32Å; D171-L175 WeakPolarHBondContact O-CB 3.47Å; D171-L175 PolarHBondContact O-N 2.91Å; M172-L175 PolarHBondContact O-N 3.41Å; M172-L175 HydrophobicContact SD-CD2 4.37Å; L175-R177 VanDerWaalsContact C-N 3.31Å; L175-R177 PolarHBondContact O-N 2.67Å; L175-F178 PolarHBondContact O-N 3.09Å; L175-F178 VanDerWaalsContact O-N 3.16Å; L175-V179 WeakPolarHBondContact O-CB 3.43Å; L175-V179 VanDerWaalsContact O-CG2 3.28Å; L175-V179 WeakPolarHBondContact O-CG2 3.32Å; L175-V179 PolarHBondContact O-N 3.16Å
176V87.3Confident85.8Confident93 Ų9347.5 Ų47.556%0.56427%0.272SS*.Hα-helixtrans-59.1-42.7176.7167.20000110.8M172 F178 V179 A180M172-V176 WeakPolarHBondContact O-CB 3.44Å; M172-V176 WeakPolarHBondContact O-CG2 3.42Å; M172-V176 PolarHBondContact O-N 3.5Å; V176-F178 PolarHBondContact O-N 3.12Å; V176-V179 PolarHBondContact O-N 3.08Å; V176-A180 VanDerWaalsContact O-CB 3.27Å; V176-A180 WeakPolarHBondContact O-CB 3.41Å; V176-A180 PolarHBondContact O-N 3.36Å
177R87.8Confident85.8Confident18 Ų1850.6 Ų50.67%0.06827%0.274CS..Hα-helixtrans-54.2-55.3173-178.7-155.4-178.4116.4-6.3110.5M119 T123 Q173 V174 L175 V179 A180 M181M119-R177 HydrophobicContact CE-CB 3.94Å; M119-R177 VanDerWaalsContact CE-CD 3.43Å; M119-R177 HydrophobicContact CE-CG 3.83Å; M119-R177 PolarHBondContact SD-NH1 2.97Å; T123-R177 HydrophobicContact CG2-CB 3.95Å; T123-R177 HydrophobicContact CG2-CG 3.94Å; Q173-R177 PolarHBondContact O-N 3.44Å; Q173-R177 VanDerWaalsContact O-N 3.12Å; V174-R177 WeakPolarHBondContact O-CB 3.05Å; V174-R177 PolarHBondContact O-N 2.84Å; L175-R177 VanDerWaalsContact C-N 3.31Å; L175-R177 PolarHBondContact O-N 2.67Å; R177-V179 PolarHBondContact O-N 3.4Å; R177-A180 PolarHBondContact O-N 3.4Å; R177-M181 WeakPolarHBondContact O-CB 3.41Å; R177-M181 VanDerWaalsContact O-CG 3.23Å; R177-M181 WeakPolarHBondContact O-CG 3.49Å; R177-M181 PolarHBondContact O-N 3.46Å
178F87.5Confident85.8Confident8 Ų847 Ų474%0.03525%0.252CS..Hα-helixtrans-68.9-35-175.6-72.1-59.7000113.5F53 Y70 C158 R161 I162 V174 L175 V176 M181 T182F53-F178 HydrophobicContact CE1-CZ 4.38Å; F53-F178 HydrophobicContact CE2-CE2 4.15Å; F53-F178 HydrophobicContact CE2-CZ 4Å; F53-F178 AromaticContact CZ-CE2 3.79Å; F53-F178 HydrophobicContact CZ-CE2 3.79Å; F53-F178 AromaticContact CZ-CZ 3.56Å; F53-F178 HydrophobicContact CZ-CZ 3.56Å; Y70-F178 WeakPolarHBondContact OH-CE1 3Å; Y70-F178 WeakPolarHBondContact OH-CZ 3.47Å; C158-F178 HydrophobicContact CB-CD1 4.47Å; R161-F178 HydrophobicContact CB-CD1 3.68Å; R161-F178 HydrophobicContact CB-CD2 3.79Å; R161-F178 HydrophobicContact CB-CE1 3.56Å; R161-F178 HydrophobicContact CB-CE2 3.66Å; R161-F178 HydrophobicContact CB-CG 3.81Å; R161-F178 HydrophobicContact CB-CZ 3.56Å; R161-F178 HydrophobicContact CG-CD1 4.36Å; R161-F178 HydrophobicContact CG-CE1 3.81Å; R161-F178 HydrophobicContact CG-CE2 4.32Å; R161-F178 HydrophobicContact CG-CZ 3.79Å; I162-F178 HydrophobicContact CD1-CB 4.43Å; I162-F178 HydrophobicContact CG1-CB 3.58Å; V174-F178 HydrophobicContact CG1-CD2 3.7Å; V174-F178 HydrophobicContact CG1-CE2 3.39Å; V174-F178 VanDerWaalsContact O-CD2 3.23Å; V174-F178 WeakPolarHBondContact O-CD2 3.27Å; V174-F178 PolarHBondContact O-N 2.69Å; V174-F178 VanDerWaalsContact O-N 3.08Å; L175-F178 PolarHBondContact O-N 3.09Å; L175-F178 VanDerWaalsContact O-N 3.16Å; V176-F178 PolarHBondContact O-N 3.12Å; F178-M181 PolarHBondContact O-N 3.49Å; F178-T182 VanDerWaalsContact O-CB 3.32Å; F178-T182 WeakPolarHBondContact O-CB 3.42Å; F178-T182 PolarHBondContact O-N 3.49Å; F178-T182 PolarHBondContact O-OG1 3.2Å
179V89.2Confident85.9Confident59 Ų5946 Ų4636%0.35825%0.245SC..Hα-helixtrans-62.8-50.8173.8171.30000110.4I162 L175 V176 R177 M181 T182 L183I162-V179 HydrophobicContact CD1-CB 4.46Å; I162-V179 HydrophobicContact CD1-CG2 3.82Å; I162-V179 HydrophobicContact CG1-CG2 4.17Å; L175-V179 WeakPolarHBondContact O-CB 3.43Å; L175-V179 VanDerWaalsContact O-CG2 3.28Å; L175-V179 WeakPolarHBondContact O-CG2 3.32Å; L175-V179 PolarHBondContact O-N 3.16Å; V176-V179 PolarHBondContact O-N 3.08Å; R177-V179 PolarHBondContact O-N 3.4Å; V179-M181 VanDerWaalsContact C-N 3.33Å; V179-M181 PolarHBondContact O-N 3.42Å; V179-T182 PolarHBondContact O-N 2.92Å; V179-L183 HydrophobicContact CG1-CD1 4.14Å; V179-L183 WeakPolarHBondContact O-CG 3.34Å; V179-L183 PolarHBondContact O-N 3.46Å
180A87.6Confident86.1Confident30 Ų3048.6 Ų48.625%0.24826%0.257CS..Hα-helixtrans-58.5-45.3177.700000111.7V176 R177 T182 L183 L184V176-A180 VanDerWaalsContact O-CB 3.27Å; V176-A180 WeakPolarHBondContact O-CB 3.41Å; V176-A180 PolarHBondContact O-N 3.36Å; R177-A180 PolarHBondContact O-N 3.4Å; A180-T182 PolarHBondContact O-N 3.49Å; A180-L183 PolarHBondContact O-N 2.95Å; A180-L184 WeakPolarHBondContact O-CG 3.33Å; A180-L184 PolarHBondContact O-N 3.08Å; A180-L184 VanDerWaalsContact O-N 3.08Å
181M87.8Confident86.2Confident17 Ų1747.3 Ų47.38%0.08424%0.241CC..Hα-helixtrans-64.6-39.6177.2-67.6-56.3146.800112.5T123 A127 R177 F178 V179 L184 N185T123-M181 HydrophobicContact CG2-CE 4.15Å; T123-M181 WeakPolarHBondContact O-CE 3.19Å; A127-M181 HydrophobicContact CB-CE 4.31Å; R177-M181 WeakPolarHBondContact O-CB 3.41Å; R177-M181 VanDerWaalsContact O-CG 3.23Å; R177-M181 WeakPolarHBondContact O-CG 3.49Å; R177-M181 PolarHBondContact O-N 3.46Å; F178-M181 PolarHBondContact O-N 3.49Å; V179-M181 VanDerWaalsContact C-N 3.33Å; V179-M181 PolarHBondContact O-N 3.42Å; M181-L184 PolarHBondContact O-N 2.85Å; M181-N185 WeakPolarHBondContact O-CB 3.24Å; M181-N185 PolarHBondContact O-N 3.46Å; M181-N185 PolarHBondContact O-ND2 2.94Å; M181-N185 VanDerWaalsContact O-ND2 3.14Å
182T88.3Confident85.9Confident19 Ų1946.2 Ų46.212%0.11724%0.236CC..Hα-helixtrans-63.6-46.2178.7-57.30000110.8T155 C158 I162 F178 V179 A180 L184 N185 F186T155-T182 HydrophobicContact CG2-CG2 4.04Å; C158-T182 WeakPolarHBondContact CB-OG1 3.41Å; I162-T182 WeakPolarHBondContact CD1-OG1 3.43Å; F178-T182 VanDerWaalsContact O-CB 3.32Å; F178-T182 WeakPolarHBondContact O-CB 3.42Å; F178-T182 PolarHBondContact O-N 3.49Å; F178-T182 PolarHBondContact O-OG1 3.2Å; V179-T182 PolarHBondContact O-N 2.92Å; A180-T182 PolarHBondContact O-N 3.49Å; T182-L184 PolarHBondContact O-N 3.49Å; T182-N185 PolarHBondContact O-N 2.87Å; T182-F186 WeakPolarHBondContact O-CB 3.36Å; T182-F186 PolarHBondContact O-N 3Å
183L89.8Confident85.7Confident114 Ų11442.5 Ų42.560%0.59722%0.218SC*.Hα-helixtrans-61.4-45.6178.3-69.1173.1000111.8V179 A180 F186 W187V179-L183 HydrophobicContact CG1-CD1 4.14Å; V179-L183 WeakPolarHBondContact O-CG 3.34Å; V179-L183 PolarHBondContact O-N 3.46Å; A180-L183 PolarHBondContact O-N 2.95Å; L183-F186 PolarHBondContact O-N 3.49Å; L183-W187 WeakPolarHBondContact O-CB 3.46Å; L183-W187 PolarHBondContact O-N 2.85Å
184L85.2Confident85.7Confident24 Ų2445.8 Ų45.813%0.12623%0.229CC..Hα-helixtrans-66.5-45178.2-69.8173.3000112.1A127 K130 L131 A180 M181 T182 F186 W187 V188A127-L184 VanDerWaalsContact CA-CD1 3.48Å; A127-L184 HydrophobicContact CB-CD1 3.57Å; K130-L184 HydrophobicContact CB-CB 4.24Å; K130-L184 HydrophobicContact CB-CD1 4.27Å; L131-L184 HydrophobicContact CD2-CD2 3.47Å; L131-L184 VanDerWaalsContact CD2-CD2 3.47Å; L131-L184 HydrophobicContact CG-CD2 3.79Å; A180-L184 WeakPolarHBondContact O-CG 3.33Å; A180-L184 PolarHBondContact O-N 3.08Å; A180-L184 VanDerWaalsContact O-N 3.08Å; M181-L184 PolarHBondContact O-N 2.85Å; T182-L184 PolarHBondContact O-N 3.49Å; L184-F186 VanDerWaalsContact C-N 3.3Å; L184-F186 PolarHBondContact O-N 3.47Å; L184-W187 PolarHBondContact O-N 2.95Å; L184-V188 WeakPolarHBondContact O-CG2 3.31Å; L184-V188 PolarHBondContact O-N 2.99Å
185N87.3Confident85.2Confident8 Ų847.6 Ų47.64%0.04324%0.236CC..Hα-helixtrans-62.7-39.9177.6-71.7-25.9000111.4W151 T155 M181 T182 V188 L189W151-N185 HydrophobicContact CE3-CB 4.14Å; W151-N185 HydrophobicContact CZ3-CB 4.44Å; W151-N185 WeakPolarHBondContact CZ3-OD1 3.16Å; T155-N185 WeakPolarHBondContact OG1-CB 3.38Å; M181-N185 WeakPolarHBondContact O-CB 3.24Å; M181-N185 PolarHBondContact O-N 3.46Å; M181-N185 PolarHBondContact O-ND2 2.94Å; M181-N185 VanDerWaalsContact O-ND2 3.14Å; T182-N185 PolarHBondContact O-N 2.87Å; N185-V188 PolarHBondContact O-N 3.38Å; N185-L189 WeakPolarHBondContact O-CB 3.41Å; N185-L189 PolarHBondContact O-N 3.41Å
186F86.9Confident84.6Confident105 Ų10549.6 Ų49.646%0.46124%0.244SC..Hα-helixtrans-66.1-42.1176.6-174.3-109.6000112T155 T182 L183 L184 V188 L189 L190T155-F186 HydrophobicContact CG2-CB 4.15Å; T155-F186 HydrophobicContact CG2-CD2 4.29Å; T182-F186 WeakPolarHBondContact O-CB 3.36Å; T182-F186 PolarHBondContact O-N 3Å; L183-F186 PolarHBondContact O-N 3.49Å; L184-F186 VanDerWaalsContact C-N 3.3Å; L184-F186 PolarHBondContact O-N 3.47Å; F186-V188 PolarHBondContact O-N 2.87Å; F186-L189 WeakPolarHBondContact O-CB 3.36Å; F186-L189 PolarHBondContact O-N 2.94Å; F186-L190 HydrophobicContact CD1-CD1 3.94Å; F186-L190 HydrophobicContact CD1-CG 4.37Å; F186-L190 HydrophobicContact CE1-CD1 3.51Å; F186-L190 HydrophobicContact CE1-CD2 4.49Å; F186-L190 HydrophobicContact CE1-CG 4.06Å; F186-L190 HydrophobicContact CZ-CD1 3.99Å; F186-L190 HydrophobicContact CZ-CD2 4.12Å; F186-L190 HydrophobicContact CZ-CG 4.12Å; F186-L190 WeakPolarHBondContact O-CG 3.37Å; F186-L190 PolarHBondContact O-N 3.04Å
187W85.6Confident84Confident128 Ų12853.7 Ų53.749%0.48525%0.25SC..Hα-helixtrans-59.8-48.3174.8-164.8-41.4000111.1L134 W138 L183 L184 L189 L190 T191L134-W187 HydrophobicContact CD2-CD2 4.14Å; L134-W187 HydrophobicContact CD2-CG 3.92Å; W138-W187 AromaticContact CH2-CZ2 3.92Å; W138-W187 HydrophobicContact CH2-CZ2 3.92Å; W138-W187 AromaticContact CH2-NE1 3.92Å; W138-W187 HydrophobicContact CZ2-CZ2 4.38Å; W138-W187 AromaticContact CZ2-NE1 3.57Å; L183-W187 WeakPolarHBondContact O-CB 3.46Å; L183-W187 PolarHBondContact O-N 2.85Å; L184-W187 PolarHBondContact O-N 2.95Å; W187-L189 VanDerWaalsContact C-N 3.31Å; W187-L189 PolarHBondContact O-N 3.43Å; W187-L190 PolarHBondContact O-N 3.45Å; W187-T191 PolarHBondContact O-N 3.49Å; W187-T191 PolarHBondContact O-OG1 2.99Å
188V82.3Confident83.3Confident2 Ų259.9 Ų59.91%0.01227%0.273CS..Hα-helixtrans-60.5-44177.6176.10000110.6L134 M137 W151 L184 N185 F186 L190 T191 V192L134-V188 HydrophobicContact CB-CG2 4.18Å; L134-V188 HydrophobicContact CD1-CG2 4.17Å; M137-V188 HydrophobicContact CE-CG1 3.9Å; W151-V188 HydrophobicContact CD2-CB 4.02Å; W151-V188 HydrophobicContact CD2-CG1 3.47Å; W151-V188 VanDerWaalsContact CD2-CG1 3.47Å; W151-V188 VanDerWaalsContact CE2-CG1 3.42Å; W151-V188 HydrophobicContact CE3-CB 3.67Å; W151-V188 HydrophobicContact CE3-CG1 3.65Å; W151-V188 HydrophobicContact CE3-CG2 4.35Å; W151-V188 HydrophobicContact CG-CG1 4.06Å; W151-V188 HydrophobicContact CH2-CB 3.93Å; W151-V188 HydrophobicContact CH2-CG1 3.58Å; W151-V188 HydrophobicContact CH2-CG2 3.85Å; W151-V188 HydrophobicContact CZ2-CB 4.37Å; W151-V188 HydrophobicContact CZ2-CG1 3.54Å; W151-V188 HydrophobicContact CZ3-CB 3.59Å; W151-V188 HydrophobicContact CZ3-CG1 3.67Å; W151-V188 HydrophobicContact CZ3-CG2 3.75Å; L184-V188 WeakPolarHBondContact O-CG2 3.31Å; L184-V188 PolarHBondContact O-N 2.99Å; N185-V188 PolarHBondContact O-N 3.38Å; F186-V188 PolarHBondContact O-N 2.87Å; V188-L190 PolarHBondContact O-N 3.03Å; V188-T191 WeakPolarHBondContact O-CB 3.31Å; V188-T191 PolarHBondContact O-N 3.29Å; V188-T191 VanDerWaalsContact O-N 3.16Å; V188-V192 HydrophobicContact CG1-CG2 4.25Å; V188-V192 WeakPolarHBondContact O-CG2 3.32Å; V188-V192 PolarHBondContact O-N 2.6Å
189L84.3Confident82.3Confident24 Ų2467.4 Ų67.413%0.12630%0.301CS..Hα-helixtrans-56.8-49.6176.4177.863.2000112.4A148 W151 N185 F186 W187 T191 V192 I193A148-L189 HydrophobicContact CB-CD1 4.16Å; A148-L189 WeakPolarHBondContact O-CD1 3.13Å; W151-L189 HydrophobicContact CB-CB 4.1Å; W151-L189 HydrophobicContact CB-CD1 4.08Å; N185-L189 WeakPolarHBondContact O-CB 3.41Å; N185-L189 PolarHBondContact O-N 3.41Å; F186-L189 WeakPolarHBondContact O-CB 3.36Å; F186-L189 PolarHBondContact O-N 2.94Å; W187-L189 VanDerWaalsContact C-N 3.31Å; W187-L189 PolarHBondContact O-N 3.43Å; L189-T191 PolarHBondContact O-N 3.01Å; L189-V192 PolarHBondContact O-N 3.37Å; L189-I193 HydrophobicContact CD1-CD1 3.97Å; L189-I193 HydrophobicContact CD1-CG1 4.33Å; L189-I193 HydrophobicContact CG-CD1 3.95Å; L189-I193 WeakPolarHBondContact O-CG1 3.47Å; L189-I193 PolarHBondContact O-N 3.01Å
190L85.4Confident80.9Confident90 Ų9068 Ų6847%0.47131%0.308SS..Hα-helixtrans-58.3-40.8177.3-72.4178.7000111.6F186 W187 V188 I193 Y194F186-L190 HydrophobicContact CD1-CD1 3.94Å; F186-L190 HydrophobicContact CD1-CG 4.37Å; F186-L190 HydrophobicContact CE1-CD1 3.51Å; F186-L190 HydrophobicContact CE1-CD2 4.49Å; F186-L190 HydrophobicContact CE1-CG 4.06Å; F186-L190 HydrophobicContact CZ-CD1 3.99Å; F186-L190 HydrophobicContact CZ-CD2 4.12Å; F186-L190 HydrophobicContact CZ-CG 4.12Å; F186-L190 WeakPolarHBondContact O-CG 3.37Å; F186-L190 PolarHBondContact O-N 3.04Å; W187-L190 PolarHBondContact O-N 3.45Å; V188-L190 PolarHBondContact O-N 3.03Å; L190-I193 PolarHBondContact O-N 2.92Å; L190-Y194 WeakPolarHBondContact O-CB 3.32Å; L190-Y194 PolarHBondContact O-N 3.47Å
191T81.7Confident79.6Confident11 Ų1169.9 Ų69.97%0.06732%0.32CS..Hα-helixtrans-66.4-44.8179.8-55.70000111.3L134 M137 W138 W187 V188 L189 I193 Y194 Y195L134-T191 HydrophobicContact CD1-CG2 3.98Å; L134-T191 WeakPolarHBondContact CD1-OG1 3.23Å; M137-T191 HydrophobicContact CE-CG2 3.48Å; M137-T191 VanDerWaalsContact CE-CG2 3.48Å; M137-T191 HydrophobicContact SD-CG2 4.29Å; W138-T191 VanDerWaalsContact NE1-CG2 3.31Å; W187-T191 PolarHBondContact O-N 3.49Å; W187-T191 PolarHBondContact O-OG1 2.99Å; V188-T191 WeakPolarHBondContact O-CB 3.31Å; V188-T191 PolarHBondContact O-N 3.29Å; V188-T191 VanDerWaalsContact O-N 3.16Å; L189-T191 PolarHBondContact O-N 3.01Å; T191-I193 PolarHBondContact O-N 2.86Å; T191-Y194 PolarHBondContact O-N 2.98Å; T191-Y195 HydrophobicContact CG2-CD2 3.74Å; T191-Y195 HydrophobicContact CG2-CE2 3.46Å; T191-Y195 VanDerWaalsContact CG2-CE2 3.46Å; T191-Y195 WeakPolarHBondContact O-CD2 3.38Å; T191-Y195 PolarHBondContact O-N 2.9Å; T191-Y195 VanDerWaalsContact O-N 3.07Å
192V80Confident78.1Confident0 Ų072.4 Ų72.40%034%0.339CS..Hα-helixtrans-59.9-47.4175.6173.30000110.8M137 V146 A148 V188 L189 Y194 Y195 Q196M137-V192 HydrophobicContact CE-CG2 4.07Å; M137-V192 HydrophobicContact SD-CG2 3.57Å; M137-V192 VanDerWaalsContact SD-CG2 3.57Å; V146-V192 HydrophobicContact CB-CG2 4.34Å; V146-V192 HydrophobicContact CG1-CG2 3.98Å; V146-V192 WeakPolarHBondContact O-CG1 3.42Å; A148-V192 HydrophobicContact CB-CG1 3.87Å; V188-V192 HydrophobicContact CG1-CG2 4.25Å; V188-V192 WeakPolarHBondContact O-CG2 3.32Å; V188-V192 PolarHBondContact O-N 2.6Å; L189-V192 PolarHBondContact O-N 3.37Å; V192-Y194 VanDerWaalsContact C-N 3.31Å; V192-Y194 PolarHBondContact O-N 3.48Å; V192-Y195 PolarHBondContact O-N 3.19Å; V192-Q196 HydrophobicContact CG1-CG 4.28Å; V192-Q196 WeakPolarHBondContact O-CB 3.44Å; V192-Q196 VanDerWaalsContact O-CG 3.32Å; V192-Q196 WeakPolarHBondContact O-CG 3.27Å; V192-Q196 PolarHBondContact O-N 3.33Å
193I81.6Confident76.6Confident56 Ų5675 Ų7529%0.28736%0.358SS..Hα-helixtrans-60.4-42.4178.6-68.2169.1000110.8A148 L189 L190 T191 R197A148-I193 HydrophobicContact CB-CG1 4.35Å; L189-I193 HydrophobicContact CD1-CD1 3.97Å; L189-I193 HydrophobicContact CD1-CG1 4.33Å; L189-I193 HydrophobicContact CG-CD1 3.95Å; L189-I193 WeakPolarHBondContact O-CG1 3.47Å; L189-I193 PolarHBondContact O-N 3.01Å; L190-I193 PolarHBondContact O-N 2.92Å; T191-I193 PolarHBondContact O-N 2.86Å; I193-R197 HydrophobicContact CG2-CG 4.45Å; I193-R197 WeakPolarHBondContact O-CB 3.19Å; I193-R197 WeakPolarHBondContact O-CG 3.28Å; I193-R197 PolarHBondContact O-N 3.33Å
194Y81.5Confident74.7Confident117 Ų11777.8 Ų77.846%0.45937%0.365SS..Hα-helixtrans-60.7-47.9178.7179.2-97.4000112.5L190 T191 V192 R198L190-Y194 WeakPolarHBondContact O-CB 3.32Å; L190-Y194 PolarHBondContact O-N 3.47Å; T191-Y194 PolarHBondContact O-N 2.98Å; V192-Y194 VanDerWaalsContact C-N 3.31Å; V192-Y194 PolarHBondContact O-N 3.48Å; Y194-R198 PolarHBondContact O-N 3.18Å; Y194-R198 VanDerWaalsContact O-N 3.14Å; Y194-R198 PolarHBondContact OH-NE 3.25Å; Y194-R198 PolarHBondContact OH-NH1 2.89Å; Y194-R198 PolarHBondContact OH-NH2 3.41Å
195Y75Confident73.1Confident38 Ų3885.3 Ų85.315%0.14940%0.397CS..Hα-helixtrans-68.9-40178.7-76.7-68.3000113M137 W138 K141 A143 T191 V192 R197 R198 R199M137-Y195 HydrophobicContact CG-CD2 4.47Å; M137-Y195 HydrophobicContact CG-CE2 4.49Å; W138-Y195 AromaticContact CD1-CE2 3.78Å; W138-Y195 VanDerWaalsContact CD1-OH 3.3Å; K141-Y195 HydrophobicContact CB-CE1 4.16Å; K141-Y195 HydrophobicContact CG-CE1 4.08Å; A143-Y195 HydrophobicContact CB-CD2 4.48Å; A143-Y195 HydrophobicContact CB-CG 4.35Å; T191-Y195 HydrophobicContact CG2-CD2 3.74Å; T191-Y195 HydrophobicContact CG2-CE2 3.46Å; T191-Y195 VanDerWaalsContact CG2-CE2 3.46Å; T191-Y195 WeakPolarHBondContact O-CD2 3.38Å; T191-Y195 PolarHBondContact O-N 2.9Å; T191-Y195 VanDerWaalsContact O-N 3.07Å; V192-Y195 PolarHBondContact O-N 3.19Å; Y195-R197 VanDerWaalsContact C-N 3.35Å; Y195-R197 PolarHBondContact O-N 2.98Å; Y195-R198 PolarHBondContact O-N 3.18Å; Y195-R199 PolarHBondContact O-N 2.91Å
196Q75.2Confident71.3Confident81 Ų8191.3 Ų91.338%0.37943%0.429SS..Hα-helixtrans-62.3-42176.4-73.1-179-1.700111.7V192 R199 S200V192-Q196 HydrophobicContact CG1-CG 4.28Å; V192-Q196 WeakPolarHBondContact O-CB 3.44Å; V192-Q196 VanDerWaalsContact O-CG 3.32Å; V192-Q196 WeakPolarHBondContact O-CG 3.27Å; V192-Q196 PolarHBondContact O-N 3.33Å; Q196-R199 PolarHBondContact O-N 3.24Å; Q196-S200 PolarHBondContact O-N 2.79Å
197R74.7Confident69.2Low179 Ų17995.6 Ų95.668%0.67546%0.457SS*.Hα-helixtrans-61.5-45.5175.2-77.3-177.9179.8-174.41.2112I193 Y195 R199 S200 S201I193-R197 HydrophobicContact CG2-CG 4.45Å; I193-R197 WeakPolarHBondContact O-CB 3.19Å; I193-R197 WeakPolarHBondContact O-CG 3.28Å; I193-R197 PolarHBondContact O-N 3.33Å; Y195-R197 VanDerWaalsContact C-N 3.35Å; Y195-R197 PolarHBondContact O-N 2.98Å; R197-R199 VanDerWaalsContact C-N 3.35Å; R197-R199 PolarHBondContact O-N 3.4Å; R197-S200 PolarHBondContact O-N 2.85Å; R197-S200 PolarHBondContact O-OG 3.28Å; R197-S201 PolarHBondContact O-N 3.47Å
198R71.6Confident68.3Low148 Ų14894 Ų9456%0.55846%0.455SS*.Hα-helixtrans-60.9-39.4176.3-89.6-175.1163.3-170.5-3.3113.4Y194 Y195 S201 S202Y194-R198 PolarHBondContact O-N 3.18Å; Y194-R198 VanDerWaalsContact O-N 3.14Å; Y194-R198 PolarHBondContact OH-NE 3.25Å; Y194-R198 PolarHBondContact OH-NH1 2.89Å; Y194-R198 PolarHBondContact OH-NH2 3.41Å; Y195-R198 PolarHBondContact O-N 3.18Å; R198-S201 PolarHBondContact O-N 3.01Å; R198-S201 PolarHBondContact O-OG 3.4Å; R198-S202 PolarHBondContact O-N 3.28Å; R198-S202 VanDerWaalsContact O-N 3.1Å
199R66.9Low67.6Low165 Ų16598.8 Ų98.862%0.62348%0.479SS*.Hα-helixtrans-64.9-44.1175.9-167.9171.6-178.9155.4-0.6111.3D142 Y195 Q196 R197 S201 S202 S203D142-R199 IonicContact OD1-NH1 3.27Å; D142-R199 PolarHBondContact OD1-NH1 3.48Å; D142-R199 VanDerWaalsContact OD1-NH1 3.07Å; Y195-R199 PolarHBondContact O-N 2.91Å; Q196-R199 PolarHBondContact O-N 3.24Å; R197-R199 VanDerWaalsContact C-N 3.35Å; R197-R199 PolarHBondContact O-N 3.4Å; R199-S201 VanDerWaalsContact C-N 3.33Å; R199-S201 PolarHBondContact O-N 3.41Å; R199-S202 PolarHBondContact O-N 3.23Å; R199-S203 PolarHBondContact O-N 3.24Å
200S60.4Low66.7Low71 Ų71103 Ų10350%0.49750%0.498SS..Hα-helixtrans-64.1-34.1177.873.70000113.6Q196 R197 K204Q196-S200 PolarHBondContact O-N 2.79Å; R197-S200 PolarHBondContact O-N 2.85Å; R197-S200 PolarHBondContact O-OG 3.28Å; S200-K204 PolarHBondContact O-N 3.08Å
201S59.1Low65.6Low71 Ų71103.8 Ų103.850%0.49750%0.5SS..Hα-helixtrans-76.6-27.317670.20000113.6R197 R198 R199R197-S201 PolarHBondContact O-N 3.47Å; R198-S201 PolarHBondContact O-N 3.01Å; R198-S201 PolarHBondContact O-OG 3.4Å; R199-S201 VanDerWaalsContact C-N 3.33Å; R199-S201 PolarHBondContact O-N 3.41Å
202S58.3Low64.6Low69 Ų69109.6 Ų109.648%0.48353%0.527SS..Hα-helixtrans-72.5-44.7173.9-160.10000110.9R198 R199 K204 K205R198-S202 PolarHBondContact O-N 3.28Å; R198-S202 VanDerWaalsContact O-N 3.1Å; R199-S202 PolarHBondContact O-N 3.23Å; S202-K204 VanDerWaalsContact C-N 3.25Å; S202-K204 PolarHBondContact O-N 3.34Å; S202-K205 PolarHBondContact O-N 2.74Å
203S55.3Low63.5Low75 Ų75116.9 Ų116.952%0.52456%0.562SS.*Hα-helixtrans-64.2-27.7179.3-165.80000113.5R199 K205R199-S203 PolarHBondContact O-N 3.24Å; S203-K205 VanDerWaalsContact C-N 3.29Å
204K51.4Low62.2Low172 Ų172121.2 Ų121.275%0.74858%0.582SS**THydrogen-bonded Turntrans-78.8-7.4175.2-91.8-175.8175.3-177.70114.6S200 S202S200-K204 PolarHBondContact O-N 3.08Å; S202-K204 VanDerWaalsContact C-N 3.25Å; S202-K204 PolarHBondContact O-N 3.34Å
205K51.2Low60.8Low181 Ų181121.5 Ų121.579%0.78759%0.591SS**THydrogen-bonded Turntrans-99.4-12.6-179.1-124-179.5-178.9-175.30112.7S202 S203S202-K205 PolarHBondContact O-N 2.74Å; S203-K205 VanDerWaalsContact C-N 3.29Å
206D49.4Very low59.6Low135 Ų135128.5 Ų128.572%0.72263%0.628SS**  trans-103.70.5-179.8-62.1-32.3000112.4
207D41.4Very low58.2Low195 Ų195132.8 Ų132.8100%1.04365%0.651SS**  trans-107.50168.5-73.3-28.4000109.9

Retrieved 207 of 207 residues in 436.9 ms (Link to these results)

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