A0A077ZHI8_TRITR Loading...

TrkA N and Na H Exchanger domain containing prote in

AlphaFold DB , UniProt , Accession A0A077ZHI8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 558 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
1M40.5Very low73.4Confident235 Ų235100.6 Ų100.6100%1.15854%0.538SS*.  0120.40-66.2-169.2-8800105.9H3M1-H3 PolarHBondContact O-N 2.81Å
2H50Low74.9Confident194 Ų19498.8 Ų98.890%0.89853%0.532SS*.  trans-29.3115.5-160.1-69.6-82.5000113.5A4H2-A4 PolarHBondContact O-N 2.92Å
3H49.8Very low76.1Confident182 Ų18292.5 Ų92.584%0.84351%0.505SS*.  trans-60.791.9161.8-77.1-63.5000105.9M1 T5M1-H3 PolarHBondContact O-N 2.81Å; H3-T5 PolarHBondContact O-N 2.88Å
4A63.4Low77.2Confident84 Ų8485.9 Ų85.969%0.69447%0.47SS*.  trans-57.7115.3168.900000104.8H2 P6H2-A4 PolarHBondContact O-N 2.92Å; A4-P6 WeakPolarHBondContact O-CD 3.35Å
5T80.3Confident78.2Confident62 Ų6284.4 Ų84.438%0.3846%0.46SS..  trans-10161.9174.446.10000107.7H3 L7 I8 T9H3-T5 PolarHBondContact O-N 2.88Å; T5-L7 PolarHBondContact O-N 2.64Å; T5-L7 VanDerWaalsContact O-N 3.09Å; T5-I8 HydrophobicContact CG2-CD1 4.04Å; T5-I8 PolarHBondContact O-N 2.85Å; T5-T9 PolarHBondContact O-N 3.43Å; T5-T9 PolarHBondContact O-OG1 3.17Å
6P84.3Confident79.3Confident51 Ų5183.9 Ų83.933%0.33146%0.46SS..Hα-helixtrans-57-35.1-168.626-36.4000111.6A4 T9 T10 D53 L56A4-P6 WeakPolarHBondContact O-CD 3.35Å; P6-T9 WeakPolarHBondContact CA-OG1 2.96Å; P6-T9 PolarHBondContact O-OG1 3.12Å; P6-T10 WeakPolarHBondContact O-CB 3.25Å; P6-T10 PolarHBondContact O-N 2.8Å; P6-T10 PolarHBondContact O-OG1 3.46Å; P6-D53 HydrophobicContact CB-CB 4.43Å; P6-L56 HydrophobicContact CB-CD1 4Å; P6-L56 HydrophobicContact CG-CD1 4.04Å
7L85.4Confident80.2Confident81 Ų8181.8 Ų81.842%0.42445%0.448SS..Hα-helixtrans-62.4-52.2174.5-173.669.7000112.1T5 T9 T10 I11 L56 L60T5-L7 PolarHBondContact O-N 2.64Å; T5-L7 VanDerWaalsContact O-N 3.09Å; L7-T9 PolarHBondContact O-N 3.41Å; L7-T10 PolarHBondContact O-N 3.11Å; L7-I11 HydrophobicContact CD1-CD1 4.05Å; L7-I11 HydrophobicContact CG-CD1 3.95Å; L7-I11 WeakPolarHBondContact O-CG1 3.31Å; L7-I11 PolarHBondContact O-N 2.96Å; L7-L56 HydrophobicContact CB-CD1 4.04Å; L7-L56 HydrophobicContact CD1-CD1 4.24Å; L7-L56 HydrophobicContact CD1-CD2 4.49Å; L7-L60 HydrophobicContact CD1-CD1 4.04Å; L7-L60 HydrophobicContact CD1-CD2 4.23Å; L7-L60 HydrophobicContact CD1-CG 4.36Å
8I88.5Confident81Confident99 Ų9977.2 Ų77.251%0.50842%0.423SS..Hα-helixtrans-64.3-44.4-178.8-57.5179.4000109.9T5 T10 I11 V12T5-I8 HydrophobicContact CG2-CD1 4.04Å; T5-I8 PolarHBondContact O-N 2.85Å; I8-T10 VanDerWaalsContact C-N 3.32Å; I8-T10 PolarHBondContact O-N 3.07Å; I8-I11 PolarHBondContact O-N 3.06Å; I8-V12 HydrophobicContact CG2-CG2 3.93Å; I8-V12 VanDerWaalsContact O-CB 3.25Å; I8-V12 WeakPolarHBondContact O-CB 3.34Å; I8-V12 VanDerWaalsContact O-CG2 3.25Å; I8-V12 WeakPolarHBondContact O-CG2 3.24Å; I8-V12 PolarHBondContact O-N 3.39Å
9T87.5Confident81.7Confident62 Ų6279.9 Ų79.938%0.3843%0.431SS..Hα-helixtrans-64.4-37.7178.252.20000111.8T5 P6 L7 G13 F50T5-T9 PolarHBondContact O-N 3.43Å; T5-T9 PolarHBondContact O-OG1 3.17Å; P6-T9 WeakPolarHBondContact CA-OG1 2.96Å; P6-T9 PolarHBondContact O-OG1 3.12Å; L7-T9 PolarHBondContact O-N 3.41Å; T9-G13 VanDerWaalsContact O-CA 3.32Å; T9-G13 WeakPolarHBondContact O-CA 2.98Å; T9-G13 PolarHBondContact O-N 3.45Å; T9-F50 WeakPolarHBondContact O-CZ 3.24Å
10T87.3Confident82.5Confident8 Ų880.7 Ų80.75%0.04943%0.433CS..Hα-helixtrans-66.9-48.2177.1-63.70000111.4P6 L7 I8 G14 A52 D53 A57 L60P6-T10 WeakPolarHBondContact O-CB 3.25Å; P6-T10 PolarHBondContact O-N 2.8Å; P6-T10 PolarHBondContact O-OG1 3.46Å; L7-T10 PolarHBondContact O-N 3.11Å; I8-T10 VanDerWaalsContact C-N 3.32Å; I8-T10 PolarHBondContact O-N 3.07Å; T10-G14 WeakPolarHBondContact O-CA 3.26Å; T10-G14 PolarHBondContact O-N 3.22Å; T10-A52 HydrophobicContact CG2-CB 3.92Å; T10-D53 PolarHBondContact OG1-N 2.91Å; T10-D53 VanDerWaalsContact OG1-N 3.13Å; T10-A57 HydrophobicContact CG2-CB 4.13Å; T10-L60 HydrophobicContact CG2-CD1 4.23Å
11I90.4Very high83.1Confident49 Ų4978.3 Ų78.325%0.25142%0.421SS..Hα-helixtrans-64.5-53.8178.5-66.9170.5000110.6L7 I8 G14 L15 L60 L284L7-I11 HydrophobicContact CD1-CD1 4.05Å; L7-I11 HydrophobicContact CG-CD1 3.95Å; L7-I11 WeakPolarHBondContact O-CG1 3.31Å; L7-I11 PolarHBondContact O-N 2.96Å; I8-I11 PolarHBondContact O-N 3.06Å; I11-G14 PolarHBondContact O-N 2.83Å; I11-L15 HydrophobicContact CG2-CD1 3.75Å; I11-L15 HydrophobicContact CG2-CG 4.4Å; I11-L15 WeakPolarHBondContact O-CB 3.25Å; I11-L15 VanDerWaalsContact O-CG 3.25Å; I11-L15 WeakPolarHBondContact O-CG 3.49Å; I11-L15 PolarHBondContact O-N 3.5Å; I11-L60 HydrophobicContact CD1-CD1 4.08Å; I11-L60 HydrophobicContact CD1-CD2 4.06Å; I11-L60 HydrophobicContact CG1-CD1 3.49Å; I11-L60 VanDerWaalsContact CG1-CD1 3.49Å; I11-L60 HydrophobicContact CG1-CD2 4.29Å; I11-L284 HydrophobicContact CG1-CD1 4.47Å
12V91.8Very high85.7Confident78 Ų7867.3 Ų67.347%0.47337%0.367SS..Hα-helixtrans-65.4-46.3-176.8175.10000110.5I8 L15 V16I8-V12 HydrophobicContact CG2-CG2 3.93Å; I8-V12 VanDerWaalsContact O-CB 3.25Å; I8-V12 WeakPolarHBondContact O-CB 3.34Å; I8-V12 VanDerWaalsContact O-CG2 3.25Å; I8-V12 WeakPolarHBondContact O-CG2 3.24Å; I8-V12 PolarHBondContact O-N 3.39Å; V12-L15 PolarHBondContact O-N 3.44Å; V12-V16 HydrophobicContact CG1-CG2 4.13Å; V12-V16 VanDerWaalsContact O-CB 3.28Å; V12-V16 WeakPolarHBondContact O-CB 3.28Å; V12-V16 WeakPolarHBondContact O-CG2 3.3Å; V12-V16 PolarHBondContact O-N 2.86Å
13G90.4Very high87.8Confident17 Ų1763.3 Ų63.318%0.17535%0.35CS..Hα-helixtrans-60.9-47.7178.100000111.9T9 L17T9-G13 VanDerWaalsContact O-CA 3.32Å; T9-G13 WeakPolarHBondContact O-CA 2.98Å; T9-G13 PolarHBondContact O-N 3.45Å; G13-L17 WeakPolarHBondContact O-CB 3.47Å; G13-L17 VanDerWaalsContact O-CG 3.3Å; G13-L17 WeakPolarHBondContact O-CG 3.48Å; G13-L17 PolarHBondContact O-N 3.4Å
14G90.8Very high90Very high1 Ų159.1 Ų59.11%0.0133%0.334CS..Hα-helixtrans-60.5-49.8177.100000112.7T10 I11 A18T10-G14 WeakPolarHBondContact O-CA 3.26Å; T10-G14 PolarHBondContact O-N 3.22Å; I11-G14 PolarHBondContact O-N 2.83Å; G14-A18 WeakPolarHBondContact O-CB 3.45Å; G14-A18 PolarHBondContact O-N 3.19Å
15L93.2Very high91.3Very high63 Ų6355.6 Ų55.633%0.3330%0.304SS..Hα-helixtrans-66.2-41.7180-69.8176.2000112.8I11 V12 A18 F19 V283 L284I11-L15 HydrophobicContact CG2-CD1 3.75Å; I11-L15 HydrophobicContact CG2-CG 4.4Å; I11-L15 WeakPolarHBondContact O-CB 3.25Å; I11-L15 VanDerWaalsContact O-CG 3.25Å; I11-L15 WeakPolarHBondContact O-CG 3.49Å; I11-L15 PolarHBondContact O-N 3.5Å; V12-L15 PolarHBondContact O-N 3.44Å; L15-A18 PolarHBondContact O-N 2.88Å; L15-F19 VanDerWaalsContact O-CB 3.28Å; L15-F19 WeakPolarHBondContact O-CB 3.33Å; L15-F19 PolarHBondContact O-N 3.48Å; L15-V283 HydrophobicContact CD2-CB 4.11Å; L15-V283 HydrophobicContact CD2-CG1 3.83Å; L15-L284 HydrophobicContact CD2-CD2 3.86Å; L15-L284 HydrophobicContact CD2-CG 4.11Å; L15-L284 HydrophobicContact CG-CD2 3.84Å
16V94.7Very high91.8Very high76 Ų7657.5 Ų57.546%0.46131%0.312SS..Hα-helixtrans-66.1-45.7179.1169.90000110.8V12 F19 I20V12-V16 HydrophobicContact CG1-CG2 4.13Å; V12-V16 VanDerWaalsContact O-CB 3.28Å; V12-V16 WeakPolarHBondContact O-CB 3.28Å; V12-V16 WeakPolarHBondContact O-CG2 3.3Å; V12-V16 PolarHBondContact O-N 2.86Å; V16-F19 PolarHBondContact O-N 3.32Å; V16-I20 HydrophobicContact CG1-CD1 3.9Å; V16-I20 VanDerWaalsContact O-CG1 3.31Å; V16-I20 WeakPolarHBondContact O-CG1 3.49Å; V16-I20 PolarHBondContact O-N 3.37Å
17L94.4Very high92.1Very high48 Ų4863.4 Ų63.425%0.25133%0.333SS..Hα-helixtrans-62.7-44.8176.1-73.8170.8000111.2G13 F19 I20 L21 A39 A43 F50G13-L17 WeakPolarHBondContact O-CB 3.47Å; G13-L17 VanDerWaalsContact O-CG 3.3Å; G13-L17 WeakPolarHBondContact O-CG 3.48Å; G13-L17 PolarHBondContact O-N 3.4Å; L17-F19 VanDerWaalsContact C-N 3.34Å; L17-F19 PolarHBondContact O-N 3.09Å; L17-I20 PolarHBondContact O-N 2.9Å; L17-L21 WeakPolarHBondContact O-CB 3.36Å; L17-L21 WeakPolarHBondContact O-CG 3.41Å; L17-L21 PolarHBondContact O-N 3.02Å; L17-A39 HydrophobicContact CB-CB 3.79Å; L17-A43 HydrophobicContact CD1-CB 4.1Å; L17-F50 HydrophobicContact CD1-CD1 4.42Å
18A94.5Very high92.2Very high0 Ų065 Ų650%034%0.341CS..Hα-helixtrans-63.3-38.1177.500000112.6G14 L15 G22 Y36 A39 V283 V287G14-A18 WeakPolarHBondContact O-CB 3.45Å; G14-A18 PolarHBondContact O-N 3.19Å; L15-A18 PolarHBondContact O-N 2.88Å; A18-G22 VanDerWaalsContact O-CA 3.28Å; A18-G22 WeakPolarHBondContact O-CA 3.26Å; A18-G22 PolarHBondContact O-N 3.14Å; A18-Y36 HydrophobicContact CB-CD1 3.76Å; A18-Y36 HydrophobicContact CB-CE1 4.48Å; A18-Y36 HydrophobicContact CB-CG 4.41Å; A18-Y36 WeakPolarHBondContact O-CD1 3.45Å; A18-Y36 WeakPolarHBondContact O-CE1 3.47Å; A18-A39 HydrophobicContact CB-CB 4.01Å; A18-V283 HydrophobicContact CB-CG1 3.28Å; A18-V287 HydrophobicContact CB-CG2 3.8Å
19F96.1Very high92Very high129 Ų12971 Ų7157%0.56636%0.357SS*.Hα-helixtrans-63-49.6174.2171.9-106.2000111.5L15 V16 L17 M23L15-F19 VanDerWaalsContact O-CB 3.28Å; L15-F19 WeakPolarHBondContact O-CB 3.33Å; L15-F19 PolarHBondContact O-N 3.48Å; V16-F19 PolarHBondContact O-N 3.32Å; L17-F19 VanDerWaalsContact C-N 3.34Å; L17-F19 PolarHBondContact O-N 3.09Å; F19-M23 HydrophobicContact CE1-CE 4.32Å; F19-M23 HydrophobicContact CE2-CE 3.56Å; F19-M23 HydrophobicContact CZ-CE 3.4Å; F19-M23 VanDerWaalsContact CZ-CE 3.4Å; F19-M23 HydrophobicContact CZ-SD 4.33Å; F19-M23 VanDerWaalsContact O-CB 3.25Å; F19-M23 WeakPolarHBondContact O-CB 3.37Å; F19-M23 PolarHBondContact O-N 3.28Å
20I96.9Very high91.8Very high95 Ų9569.8 Ų69.849%0.48735%0.348SS..Hα-helixtrans-62.3-50.9-179.1-67166.9000110.7V16 L17 M23 L24V16-I20 HydrophobicContact CG1-CD1 3.9Å; V16-I20 VanDerWaalsContact O-CG1 3.31Å; V16-I20 WeakPolarHBondContact O-CG1 3.49Å; V16-I20 PolarHBondContact O-N 3.37Å; L17-I20 PolarHBondContact O-N 2.9Å; I20-M23 PolarHBondContact O-N 2.95Å; I20-L24 PolarHBondContact O-N 2.54Å
21L96Very high91.6Very high31 Ų3170.3 Ų70.316%0.16235%0.352CS..Hα-helixtrans-73.6-33.4-177.8-67.8179.8000112.6L17 L24 A25 G35 L38 A39 L42L17-L21 WeakPolarHBondContact O-CB 3.36Å; L17-L21 WeakPolarHBondContact O-CG 3.41Å; L17-L21 PolarHBondContact O-N 3.02Å; L21-L24 HydrophobicContact CD2-CD2 4.43Å; L21-L24 PolarHBondContact O-N 3.31Å; L21-A25 WeakPolarHBondContact O-CB 3.37Å; L21-A25 PolarHBondContact O-N 3.35Å; L21-G35 VanDerWaalsContact CB-O 3.31Å; L21-G35 WeakPolarHBondContact CB-O 3.33Å; L21-L38 HydrophobicContact CD1-CB 4.03Å; L21-A39 HydrophobicContact CD1-CB 3.93Å; L21-L42 HydrophobicContact CD1-CD1 3.81Å
22G93.9Very high91.5Very high4 Ų469 Ų694%0.04135%0.347CS..Hα-helixtrans-64.1-41.7172.200000111.8A18 L24 A25 N26A18-G22 VanDerWaalsContact O-CA 3.28Å; A18-G22 WeakPolarHBondContact O-CA 3.26Å; A18-G22 PolarHBondContact O-N 3.14Å; G22-L24 VanDerWaalsContact C-N 3.34Å; G22-A25 PolarHBondContact O-N 2.76Å; G22-N26 WeakPolarHBondContact O-CB 3.42Å; G22-N26 PolarHBondContact O-N 3.33Å
23M95.1Very high91.2Very high110 Ų11065.5 Ų65.554%0.54233%0.325SS..Hα-helixtrans-65.4-38.5173.7-173.4168.3-74.600111.8F19 I20 N26 K27F19-M23 HydrophobicContact CE1-CE 4.32Å; F19-M23 HydrophobicContact CE2-CE 3.56Å; F19-M23 HydrophobicContact CZ-CE 3.4Å; F19-M23 VanDerWaalsContact CZ-CE 3.4Å; F19-M23 HydrophobicContact CZ-SD 4.33Å; F19-M23 VanDerWaalsContact O-CB 3.25Å; F19-M23 WeakPolarHBondContact O-CB 3.37Å; F19-M23 PolarHBondContact O-N 3.28Å; I20-M23 PolarHBondContact O-N 2.95Å; M23-N26 PolarHBondContact O-N 2.85Å; M23-K27 WeakPolarHBondContact O-CB 3.47Å; M23-K27 PolarHBondContact O-N 3.18Å
24L95.6Very high91.1Very high94 Ų9464.9 Ų64.949%0.49232%0.318SS..Hα-helixtrans-64.3-45174-174.362.8000111.7I20 L21 G22 K27 L28I20-L24 PolarHBondContact O-N 2.54Å; L21-L24 HydrophobicContact CD2-CD2 4.43Å; L21-L24 PolarHBondContact O-N 3.31Å; G22-L24 VanDerWaalsContact C-N 3.34Å; L24-K27 PolarHBondContact O-N 2.95Å; L24-L28 HydrophobicContact CG-CD1 4.5Å; L24-L28 WeakPolarHBondContact O-CG 3.39Å; L24-L28 PolarHBondContact O-N 3.33Å; L24-L28 VanDerWaalsContact O-N 3.11Å
25A91.1Very high91.1Very high9 Ų964.9 Ų64.97%0.07432%0.318CS..Hα-helixtrans-60.5-46.5175.700000111.5L21 G22 K27 L28 R29 I30L21-A25 WeakPolarHBondContact O-CB 3.37Å; L21-A25 PolarHBondContact O-N 3.35Å; G22-A25 PolarHBondContact O-N 2.76Å; A25-K27 VanDerWaalsContact C-N 3.33Å; A25-K27 PolarHBondContact O-N 3.38Å; A25-L28 CarbonylContact O-C 3.54Å; A25-L28 WeakPolarHBondContact O-CA 3.18Å; A25-L28 PolarHBondContact O-N 3.21Å; A25-R29 PolarHBondContact O-N 2.84Å; A25-I30 CarbonylContact C-O 3.59Å; A25-I30 PolarHBondContact O-N 3.05Å
26N89.3Confident91.1Very high103 Ų10364.1 Ų64.155%0.55131%0.311SS*.Hα-helixtrans-60.1-42.2176.5-170.245.2000112G22 M23 L28 R29 P32G22-N26 WeakPolarHBondContact O-CB 3.42Å; G22-N26 PolarHBondContact O-N 3.33Å; M23-N26 PolarHBondContact O-N 2.85Å; N26-L28 PolarHBondContact O-N 3.33Å; N26-R29 WeakPolarHBondContact O-CA 3.46Å; N26-R29 PolarHBondContact O-N 3.28Å; N26-P32 HydrophobicContact CB-CG 4.35Å
27K91.3Very high90.9Very high175 Ų17560.5 Ų60.576%0.76129%0.289SS*.Hα-helixtrans-61.5-31.5175.6-173.6176.8-179.2179.80112.5M23 L24 A25 R29M23-K27 WeakPolarHBondContact O-CB 3.47Å; M23-K27 PolarHBondContact O-N 3.18Å; L24-K27 PolarHBondContact O-N 2.95Å; A25-K27 VanDerWaalsContact C-N 3.33Å; A25-K27 PolarHBondContact O-N 3.38Å; K27-R29 PolarHBondContact O-N 2.81Å
28L88.6Confident90.8Very high113 Ų11361.8 Ų61.859%0.59230%0.296SS*.THydrogen-bonded Turntrans-82.94.3174.6-64.2172.6000113.3L24 A25 N26 I30L24-L28 HydrophobicContact CG-CD1 4.5Å; L24-L28 WeakPolarHBondContact O-CG 3.39Å; L24-L28 PolarHBondContact O-N 3.33Å; L24-L28 VanDerWaalsContact O-N 3.11Å; A25-L28 CarbonylContact O-C 3.54Å; A25-L28 WeakPolarHBondContact O-CA 3.18Å; A25-L28 PolarHBondContact O-N 3.21Å; N26-L28 PolarHBondContact O-N 3.33Å; L28-I30 VanDerWaalsContact C-N 3.25Å; L28-I30 HydrophobicContact CB-CD1 4.12Å; L28-I30 HydrophobicContact CB-CG1 4.23Å; L28-I30 PolarHBondContact O-N 3.43Å
29R83.6Confident90.8Very high225 Ų22561.8 Ų61.885%0.84930%0.296SS*.THydrogen-bonded Turntrans59.831.9-174.6-54.9-178179.5176.8-2.3113.6A25 N26 K27A25-R29 PolarHBondContact O-N 2.84Å; N26-R29 WeakPolarHBondContact O-CA 3.46Å; N26-R29 PolarHBondContact O-N 3.28Å; K27-R29 PolarHBondContact O-N 2.81Å
30I82.3Confident90.6Very high38 Ų3855.6 Ų55.620%0.19527%0.269CS..SBendtrans-106.2151.1173-54.6171.9000107.9A25 L28 V34 M378A25-I30 CarbonylContact C-O 3.59Å; A25-I30 PolarHBondContact O-N 3.05Å; L28-I30 VanDerWaalsContact C-N 3.25Å; L28-I30 HydrophobicContact CB-CD1 4.12Å; L28-I30 HydrophobicContact CB-CG1 4.23Å; L28-I30 PolarHBondContact O-N 3.43Å; I30-V34 HydrophobicContact CG2-CB 4.12Å; I30-V34 HydrophobicContact CG2-CG2 3.75Å; I30-M378 HydrophobicContact CD1-CE 4.43Å; I30-M378 HydrophobicContact CG2-CG 4.23Å
31S83.3Confident90.4Very high18 Ų1851.7 Ų51.713%0.12625%0.249CC..  trans-51.9129.4175.6178.10000111.5L33 V34S31-L33 PolarHBondContact O-N 3.34Å; S31-L33 PolarHBondContact OG-N 2.81Å; S31-V34 WeakPolarHBondContact O-CB 3.36Å; S31-V34 PolarHBondContact O-N 3.15Å
32P88.3Confident90.2Very high22 Ų2254.4 Ų54.414%0.14326%0.264CS..Hα-helixtrans-53.7-25.3175.8-28.234.7000114.2N26 V34 G35 Y36N26-P32 HydrophobicContact CB-CG 4.35Å; P32-V34 PolarHBondContact O-N 3.47Å; P32-G35 WeakPolarHBondContact O-CA 3.23Å; P32-G35 PolarHBondContact O-N 2.96Å; P32-Y36 HydrophobicContact CB-CE1 4.24Å; P32-Y36 HydrophobicContact CB-CE2 4.16Å; P32-Y36 WeakPolarHBondContact O-CD1 3.4Å; P32-Y36 PolarHBondContact O-N 3.08Å; P32-Y36 VanDerWaalsContact O-N 3.1Å
33L85.7Confident90.1Very high5 Ų554.2 Ų54.23%0.02626%0.262CS..Hα-helixtrans-54.8-36.2176-63.4-177.4000112.7S31 G35 Y36 L37 V130 V131 F286S31-L33 PolarHBondContact O-N 3.34Å; S31-L33 PolarHBondContact OG-N 2.81Å; L33-G35 VanDerWaalsContact C-N 3.31Å; L33-G35 PolarHBondContact O-N 2.8Å; L33-Y36 HydrophobicContact CD2-CD2 3.87Å; L33-Y36 HydrophobicContact CD2-CE2 4.06Å; L33-Y36 PolarHBondContact O-N 2.78Å; L33-L37 WeakPolarHBondContact O-CG 3.21Å; L33-L37 PolarHBondContact O-N 3Å; L33-V130 HydrophobicContact CD1-CB 4.34Å; L33-V130 HydrophobicContact CD1-CG1 4.14Å; L33-V131 HydrophobicContact CD1-CG2 3.59Å; L33-F286 HydrophobicContact CD1-CZ 4.37Å; L33-F286 HydrophobicContact CD2-CD2 3.72Å; L33-F286 HydrophobicContact CD2-CE1 4.34Å; L33-F286 HydrophobicContact CD2-CE2 3.36Å; L33-F286 HydrophobicContact CD2-CG 4.39Å; L33-F286 HydrophobicContact CD2-CZ 3.71Å
34V87.8Confident89.8Confident4 Ų449 Ų492%0.02424%0.236CC..Hα-helixtrans-63.4-41.6176178.90000110.3I30 S31 P32 Y36 L37 L38 I377 M378I30-V34 HydrophobicContact CG2-CB 4.12Å; I30-V34 HydrophobicContact CG2-CG2 3.75Å; S31-V34 WeakPolarHBondContact O-CB 3.36Å; S31-V34 PolarHBondContact O-N 3.15Å; P32-V34 PolarHBondContact O-N 3.47Å; V34-Y36 VanDerWaalsContact C-N 3.32Å; V34-Y36 PolarHBondContact O-N 3.27Å; V34-L37 PolarHBondContact O-N 3.33Å; V34-L38 HydrophobicContact CG1-CD1 4.08Å; V34-L38 HydrophobicContact CG1-CG 4.38Å; V34-L38 WeakPolarHBondContact O-CB 3.42Å; V34-L38 VanDerWaalsContact O-CG 3.26Å; V34-L38 WeakPolarHBondContact O-CG 3.47Å; V34-L38 PolarHBondContact O-N 3.31Å; V34-I377 HydrophobicContact CG2-CB 4.29Å; V34-I377 HydrophobicContact CG2-CG2 3.66Å; V34-M378 HydrophobicContact CB-CG 4.19Å; V34-M378 HydrophobicContact CG1-CG 3.51Å; V34-M378 HydrophobicContact CG1-SD 3.76Å; V34-M378 HydrophobicContact CG2-CG 3.59Å
35G92.3Very high89.4Confident1 Ų147.8 Ų47.81%0.0123%0.234CC..Hα-helixtrans-62.8-38.2175.400000112.6L21 P32 L33 L38 A39L21-G35 VanDerWaalsContact CB-O 3.31Å; L21-G35 WeakPolarHBondContact CB-O 3.33Å; P32-G35 WeakPolarHBondContact O-CA 3.23Å; P32-G35 PolarHBondContact O-N 2.96Å; L33-G35 VanDerWaalsContact C-N 3.31Å; L33-G35 PolarHBondContact O-N 2.8Å; G35-L38 PolarHBondContact O-N 3.05Å; G35-A39 WeakPolarHBondContact O-CB 3.42Å; G35-A39 PolarHBondContact O-N 3.43Å
36Y91.8Very high89.1Confident47 Ų4751.1 Ų51.118%0.18425%0.247CC..Hα-helixtrans-68.1-42.5176.9-50.1-24.9000111.9A18 P32 L33 V34 A39 G40 V283 F286A18-Y36 HydrophobicContact CB-CD1 3.76Å; A18-Y36 HydrophobicContact CB-CE1 4.48Å; A18-Y36 HydrophobicContact CB-CG 4.41Å; A18-Y36 WeakPolarHBondContact O-CD1 3.45Å; A18-Y36 WeakPolarHBondContact O-CE1 3.47Å; P32-Y36 HydrophobicContact CB-CE1 4.24Å; P32-Y36 HydrophobicContact CB-CE2 4.16Å; P32-Y36 WeakPolarHBondContact O-CD1 3.4Å; P32-Y36 PolarHBondContact O-N 3.08Å; P32-Y36 VanDerWaalsContact O-N 3.1Å; L33-Y36 HydrophobicContact CD2-CD2 3.87Å; L33-Y36 HydrophobicContact CD2-CE2 4.06Å; L33-Y36 PolarHBondContact O-N 2.78Å; V34-Y36 VanDerWaalsContact C-N 3.32Å; V34-Y36 PolarHBondContact O-N 3.27Å; Y36-A39 WeakPolarHBondContact O-CB 3.5Å; Y36-A39 PolarHBondContact O-N 3.06Å; Y36-G40 PolarHBondContact O-N 3.14Å; Y36-G40 VanDerWaalsContact O-N 3.09Å; Y36-V283 HydrophobicContact CD1-CG1 4.32Å; Y36-V283 HydrophobicContact CD1-CG2 4.46Å; Y36-V283 HydrophobicContact CD2-CG2 3.98Å; Y36-V283 HydrophobicContact CE1-CG2 4.24Å; Y36-V283 HydrophobicContact CE2-CG2 3.77Å; Y36-V283 HydrophobicContact CG-CG1 4.32Å; Y36-V283 HydrophobicContact CG-CG2 4.34Å; Y36-F286 HydrophobicContact CD2-CD2 4.2Å
37L90.8Very high88.9Confident0 Ų047.3 Ų47.30%023%0.228CC..Hα-helixtrans-62.6-46.2174.2-72.9165.2000111.1L33 V34 A39 G40 V41 F286 V289 G290 F349 I374L33-L37 WeakPolarHBondContact O-CG 3.21Å; L33-L37 PolarHBondContact O-N 3Å; V34-L37 PolarHBondContact O-N 3.33Å; L37-A39 VanDerWaalsContact C-N 3.28Å; L37-A39 PolarHBondContact O-N 3.25Å; L37-G40 CarbonylContact O-C 3.53Å; L37-G40 WeakPolarHBondContact O-CA 3.27Å; L37-G40 PolarHBondContact O-N 2.92Å; L37-V41 WeakPolarHBondContact O-CG2 3.41Å; L37-V41 PolarHBondContact O-N 2.96Å; L37-F286 HydrophobicContact CD2-CB 4.42Å; L37-F286 HydrophobicContact CD2-CD1 4.28Å; L37-F286 HydrophobicContact CG-CB 4.46Å; L37-F286 HydrophobicContact CG-CD1 4.42Å; L37-V289 HydrophobicContact CD2-CB 4.22Å; L37-V289 HydrophobicContact CD2-CG1 3.88Å; L37-G290 WeakPolarHBondContact O-CA 3.39Å; L37-F349 HydrophobicContact CD1-CZ 4.24Å; L37-F349 HydrophobicContact CD2-CZ 4.35Å; L37-I374 HydrophobicContact CB-CD1 4.39Å; L37-I374 HydrophobicContact CB-CG1 4.22Å; L37-I374 HydrophobicContact CD1-CG1 3.77Å; L37-I374 HydrophobicContact CG-CG1 4.48Å
38L92.7Very high88.4Confident74 Ų7445.5 Ų45.539%0.38723%0.234SC..Hα-helixtrans-62.6-33.7175.9-70.9175.6000112.6L21 V34 G35 G40 V41 L42L21-L38 HydrophobicContact CD1-CB 4.03Å; V34-L38 HydrophobicContact CG1-CD1 4.08Å; V34-L38 HydrophobicContact CG1-CG 4.38Å; V34-L38 WeakPolarHBondContact O-CB 3.42Å; V34-L38 VanDerWaalsContact O-CG 3.26Å; V34-L38 WeakPolarHBondContact O-CG 3.47Å; V34-L38 PolarHBondContact O-N 3.31Å; G35-L38 PolarHBondContact O-N 3.05Å; L38-G40 VanDerWaalsContact C-N 3.28Å; L38-G40 PolarHBondContact O-N 3.42Å; L38-V41 PolarHBondContact O-N 3.19Å; L38-L42 WeakPolarHBondContact O-CG 3.43Å; L38-L42 PolarHBondContact O-N 3.03Å
39A93.7Very high88.1Confident0 Ų043.1 Ų43.10%024%0.236CC..Hα-helixtrans-61.7-40.4171.400000111.2L17 A18 L21 G35 Y36 L37 L42 A43 V287L17-A39 HydrophobicContact CB-CB 3.79Å; A18-A39 HydrophobicContact CB-CB 4.01Å; L21-A39 HydrophobicContact CD1-CB 3.93Å; G35-A39 WeakPolarHBondContact O-CB 3.42Å; G35-A39 PolarHBondContact O-N 3.43Å; Y36-A39 WeakPolarHBondContact O-CB 3.5Å; Y36-A39 PolarHBondContact O-N 3.06Å; L37-A39 VanDerWaalsContact C-N 3.28Å; L37-A39 PolarHBondContact O-N 3.25Å; A39-L42 PolarHBondContact O-N 3.46Å; A39-A43 WeakPolarHBondContact O-CB 3.24Å; A39-A43 PolarHBondContact O-N 3.13Å; A39-V287 HydrophobicContact CB-CG2 4.14Å
40G92.7Very high88Confident0 Ų036.7 Ų36.70%022%0.215CC..Hα-helixtrans-59.8-46.4169.600000113.6Y36 L37 L38 L42 A43 G44 V287 G290 M291Y36-G40 PolarHBondContact O-N 3.14Å; Y36-G40 VanDerWaalsContact O-N 3.09Å; L37-G40 CarbonylContact O-C 3.53Å; L37-G40 WeakPolarHBondContact O-CA 3.27Å; L37-G40 PolarHBondContact O-N 2.92Å; L38-G40 VanDerWaalsContact C-N 3.28Å; L38-G40 PolarHBondContact O-N 3.42Å; G40-L42 VanDerWaalsContact C-N 3.33Å; G40-L42 PolarHBondContact O-N 2.94Å; G40-A43 CarbonylContact O-C 3.52Å; G40-A43 PolarHBondContact O-N 3.19Å; G40-G44 WeakPolarHBondContact O-CA 3.47Å; G40-G44 PolarHBondContact O-N 3.14Å; G40-V287 WeakPolarHBondContact CA-O 3.36Å; G40-G290 CarbonylContact C-O 3.59Å; G40-G290 CarbonylContact O-C 3.03Å; G40-M291 VanDerWaalsContact O-CA 3.27Å; G40-M291 WeakPolarHBondContact O-CA 3.24Å; G40-M291 VanDerWaalsContact O-CG 3.26Å; G40-M291 WeakPolarHBondContact O-CG 3.15Å; G40-M291 PolarHBondContact O-N 2.82Å
41V91.9Very high88.1Confident13 Ų1338.2 Ų38.28%0.07923%0.225CC..Hα-helixtrans-59.1-45.7178-179.60000110.8L37 L38 G44 T47 G290 F293 P295L37-V41 WeakPolarHBondContact O-CG2 3.41Å; L37-V41 PolarHBondContact O-N 2.96Å; L38-V41 PolarHBondContact O-N 3.19Å; V41-G44 PolarHBondContact O-N 3.28Å; V41-T47 HydrophobicContact CG1-CG2 3.87Å; V41-T47 VanDerWaalsContact O-CG2 3.25Å; V41-T47 WeakPolarHBondContact O-CG2 3.08Å; V41-T47 PolarHBondContact O-OG1 3.4Å; V41-G290 WeakPolarHBondContact CA-O 3.27Å; V41-G290 PolarHBondContact N-O 2.88Å; V41-F293 HydrophobicContact CG1-CD1 4.41Å; V41-F293 HydrophobicContact CG2-CB 4.17Å; V41-F293 HydrophobicContact CG2-CD1 3.71Å; V41-F293 HydrophobicContact CG2-CG 4.41Å; V41-P295 HydrophobicContact CG1-CG 4.37Å
42L92.9Very high88Confident88 Ų8837.5 Ų37.546%0.46122%0.221SC..Hα-helixtrans-69.1-31177-68-171.9000113.6L21 L38 A39 G40 G44 T47L21-L42 HydrophobicContact CD1-CD1 3.81Å; L38-L42 WeakPolarHBondContact O-CG 3.43Å; L38-L42 PolarHBondContact O-N 3.03Å; A39-L42 PolarHBondContact O-N 3.46Å; G40-L42 VanDerWaalsContact C-N 3.33Å; G40-L42 PolarHBondContact O-N 2.94Å; L42-G44 VanDerWaalsContact C-N 3.3Å; L42-T47 WeakPolarHBondContact CA-OG1 3.24Å; L42-T47 PolarHBondContact O-OG1 2.82Å
43A90.8Very high87.8Confident0 Ų039 Ų390%023%0.228CC..THydrogen-bonded Turntrans-88.4117600000113.1L17 A39 G40 F50 V51 A52 M291L17-A43 HydrophobicContact CD1-CB 4.1Å; A39-A43 WeakPolarHBondContact O-CB 3.24Å; A39-A43 PolarHBondContact O-N 3.13Å; G40-A43 CarbonylContact O-C 3.52Å; G40-A43 PolarHBondContact O-N 3.19Å; A43-F50 WeakPolarHBondContact CA-O 3.44Å; A43-F50 HydrophobicContact CB-CD1 4.38Å; A43-V51 WeakPolarHBondContact O-CA 3.28Å; A43-A52 HydrophobicContact CB-CB 4.34Å; A43-A52 PolarHBondContact O-N 3.38Å; A43-M291 HydrophobicContact CB-CG 4.49Å
44G88.9Confident87.6Confident1 Ų142.7 Ų42.71%0.0125%0.251CS..SBendtrans-92.6163.6-174.100000113.3G40 V41 L42 F46 T47G40-G44 WeakPolarHBondContact O-CA 3.47Å; G40-G44 PolarHBondContact O-N 3.14Å; V41-G44 PolarHBondContact O-N 3.28Å; L42-G44 VanDerWaalsContact C-N 3.3Å; G44-F46 PolarHBondContact O-N 3.21Å; G44-T47 PolarHBondContact O-N 2.97Å
45P87Confident87.4Confident68 Ų6850.3 Ų50.344%0.44228%0.283SS..THydrogen-bonded Turntrans-66.4-15.6-178.728.2-36.7000114.4V51 T54 M291P45-V51 HydrophobicContact CB-CG1 4.42Å; P45-T54 HydrophobicContact CG-CG2 4.48Å; P45-M291 WeakPolarHBondContact CD-O 3.09Å
46F85.2Confident87Confident78 Ų7852.1 Ų52.134%0.34229%0.293SS..THydrogen-bonded Turntrans-88.9-2.5-176.4-54-72.1000114.1G44 F293 D294G44-F46 PolarHBondContact O-N 3.21Å; F46-F293 WeakPolarHBondContact CD2-O 3.25Å; F46-D294 HydrophobicContact CD1-CB 3.87Å; F46-D294 HydrophobicContact CD2-CB 4.15Å; F46-D294 HydrophobicContact CE1-CB 4.05Å; F46-D294 HydrophobicContact CE2-CB 4.31Å; F46-D294 HydrophobicContact CG-CB 3.94Å; F46-D294 HydrophobicContact CZ-CB 4.26Å
47T85.6Confident86.7Confident24 Ų2450.2 Ų50.215%0.14729%0.286CS..SBendtrans-123.8145.9175.166.30000111.1V41 L42 G44 G49 P295V41-T47 HydrophobicContact CG1-CG2 3.87Å; V41-T47 VanDerWaalsContact O-CG2 3.25Å; V41-T47 WeakPolarHBondContact O-CG2 3.08Å; V41-T47 PolarHBondContact O-OG1 3.4Å; L42-T47 WeakPolarHBondContact CA-OG1 3.24Å; L42-T47 PolarHBondContact O-OG1 2.82Å; G44-T47 PolarHBondContact O-N 2.97Å; T47-G49 PolarHBondContact O-N 3.16Å; T47-P295 HydrophobicContact CG2-CG 4.42Å
48P80.2Confident86.3Confident137 Ų13752.4 Ų52.489%0.8930%0.301SS*.SBendtrans-70.6127.9177.528.3-33.4000110.2
49G82.7Confident85.9Confident63 Ų6354.6 Ų54.665%0.64931%0.309SS*.SBendtrans151.2-152176.500000114.1T47 V51T47-G49 PolarHBondContact O-N 3.16Å; G49-V51 PolarHBondContact O-N 3.19Å
50F81.4Confident85.5Confident90 Ų9055.4 Ų55.440%0.39531%0.313SS..  trans-65.4120170.7169.7-98.2000109T9 L17 A43 A52T9-F50 WeakPolarHBondContact O-CZ 3.24Å; L17-F50 HydrophobicContact CD1-CD1 4.42Å; A43-F50 WeakPolarHBondContact CA-O 3.44Å; A43-F50 HydrophobicContact CB-CD1 4.38Å; F50-A52 HydrophobicContact CE1-CB 4.11Å
51V84.2Confident85.1Confident69 Ų6955.8 Ų55.842%0.41832%0.316SS..  trans-106.9117.4174.9-177.50000107.9A43 P45 G49A43-V51 WeakPolarHBondContact O-CA 3.28Å; P45-V51 HydrophobicContact CB-CG1 4.42Å; G49-V51 PolarHBondContact O-N 3.19Å
52A81.9Confident84.8Confident3 Ų359.7 Ų59.73%0.02533%0.334CS..  trans-65155.1172.600000110.6T10 A43 F50 T54 M291T10-A52 HydrophobicContact CG2-CB 3.92Å; A43-A52 HydrophobicContact CB-CB 4.34Å; A43-A52 PolarHBondContact O-N 3.38Å; F50-A52 HydrophobicContact CE1-CB 4.11Å; A52-T54 PolarHBondContact O-N 3.18Å; A52-T54 VanDerWaalsContact O-N 3.11Å; A52-M291 HydrophobicContact CB-CE 3.55Å; A52-M291 HydrophobicContact CB-SD 3.7Å; A52-M291 WeakPolarHBondContact O-CE 3.37Å
53D83.6Confident84.7Confident55 Ų5558.4 Ų58.429%0.29433%0.327SS..  trans-64.9116-178.1-170.7-47.1000110.1P6 T10 K55 L56 A57P6-D53 HydrophobicContact CB-CB 4.43Å; T10-D53 PolarHBondContact OG1-N 2.91Å; T10-D53 VanDerWaalsContact OG1-N 3.13Å; D53-K55 PolarHBondContact O-N 2.94Å; D53-K55 WeakPolarHBondContact OD1-CB 3.41Å; D53-K55 PolarHBondContact OD1-N 3.24Å; D53-L56 HydrophobicContact CB-CB 4.12Å; D53-L56 HydrophobicContact CB-CD1 4.17Å; D53-L56 HydrophobicContact CB-CG 4.31Å; D53-L56 PolarHBondContact O-N 2.96Å; D53-L56 PolarHBondContact OD1-N 3.46Å; D53-A57 VanDerWaalsContact O-CB 3.28Å; D53-A57 WeakPolarHBondContact O-CB 3.27Å; D53-A57 PolarHBondContact O-N 2.78Å
54T81.1Confident84.6Confident82 Ų8258.4 Ų58.450%0.50333%0.327SS..THydrogen-bonded Turntrans-72.3-7.7-174.553.90000113.9P45 A52 P58 M291P45-T54 HydrophobicContact CG-CG2 4.48Å; A52-T54 PolarHBondContact O-N 3.18Å; A52-T54 VanDerWaalsContact O-N 3.11Å; T54-P58 VanDerWaalsContact O-CD 3.25Å; T54-P58 WeakPolarHBondContact O-CD 3.38Å; T54-P58 WeakPolarHBondContact O-CG 3.1Å; T54-M291 HydrophobicContact CG2-CE 4.1Å
55K83.6Confident84.3Confident163 Ų16359.1 Ų59.171%0.70933%0.331SS*.THydrogen-bonded Turntrans-95.2-43.5171.6-62.5-175.3179.4-175.50111.8D53 P58D53-K55 PolarHBondContact O-N 2.94Å; D53-K55 WeakPolarHBondContact OD1-CB 3.41Å; D53-K55 PolarHBondContact OD1-N 3.24Å; K55-P58 WeakPolarHBondContact O-CD 3.22Å
56L84.7Confident84.5Confident40 Ų4056.3 Ų56.321%0.20931%0.312CS..Hα-helixtrans-76.6-33.5-178.3-64.6174.1000113P6 L7 D53 E59 L60P6-L56 HydrophobicContact CB-CD1 4Å; P6-L56 HydrophobicContact CG-CD1 4.04Å; L7-L56 HydrophobicContact CB-CD1 4.04Å; L7-L56 HydrophobicContact CD1-CD1 4.24Å; L7-L56 HydrophobicContact CD1-CD2 4.49Å; D53-L56 HydrophobicContact CB-CB 4.12Å; D53-L56 HydrophobicContact CB-CD1 4.17Å; D53-L56 HydrophobicContact CB-CG 4.31Å; D53-L56 PolarHBondContact O-N 2.96Å; D53-L56 PolarHBondContact OD1-N 3.46Å; L56-E59 PolarHBondContact O-N 2.85Å; L56-L60 WeakPolarHBondContact O-CG 3.48Å; L56-L60 PolarHBondContact O-N 3.36Å
57A84.3Confident84.8Confident6 Ų652.9 Ų52.95%0.0530%0.298CS..Hα-helixtrans-60.5-45.5-179.900000112.5T10 D53 L60 A61 S288 M291T10-A57 HydrophobicContact CG2-CB 4.13Å; D53-A57 VanDerWaalsContact O-CB 3.28Å; D53-A57 WeakPolarHBondContact O-CB 3.27Å; D53-A57 PolarHBondContact O-N 2.78Å; A57-L60 PolarHBondContact O-N 2.8Å; A57-A61 WeakPolarHBondContact O-CB 3.36Å; A57-A61 PolarHBondContact O-N 3.44Å; A57-S288 PolarHBondContact O-OG 3.49Å; A57-M291 HydrophobicContact CB-CE 3.93Å; A57-M291 HydrophobicContact CB-SD 3.61Å
58P82.8Confident84.7Confident47 Ų4752.4 Ų52.431%0.30529%0.294SS..Hα-helixtrans-59.4-42.7172.3-27.836000114.4T54 K55 L60 A61 E62T54-P58 VanDerWaalsContact O-CD 3.25Å; T54-P58 WeakPolarHBondContact O-CD 3.38Å; T54-P58 WeakPolarHBondContact O-CG 3.1Å; K55-P58 WeakPolarHBondContact O-CD 3.22Å; P58-L60 VanDerWaalsContact C-N 3.34Å; P58-L60 PolarHBondContact O-N 2.86Å; P58-A61 CarbonylContact O-C 3.4Å; P58-A61 WeakPolarHBondContact O-CA 3.15Å; P58-A61 VanDerWaalsContact O-CB 3.28Å; P58-A61 WeakPolarHBondContact O-CB 3.14Å; P58-A61 PolarHBondContact O-N 3.4Å; P58-A61 VanDerWaalsContact O-N 3.11Å; P58-E62 PolarHBondContact O-N 3.25Å
59E85.3Confident84.9Confident119 Ų11945.9 Ų45.956%0.55625%0.252SS*.Hα-helixtrans-63.1-40.2177.5-68.8178.2-171.900111.9L56 A61 E62 L63L56-E59 PolarHBondContact O-N 2.85Å; E59-A61 VanDerWaalsContact C-N 3.31Å; E59-E62 WeakPolarHBondContact O-CB 3.23Å; E59-E62 PolarHBondContact O-N 2.86Å; E59-L63 PolarHBondContact O-N 3.3Å
60L85.3Confident85.3Confident18 Ų1843 Ų439%0.09422%0.221CC..Hα-helixtrans-66.6-35.1173.3-70.5170000112.1L7 T10 I11 L56 A57 P58 E62 L63 G64 L284L7-L60 HydrophobicContact CD1-CD1 4.04Å; L7-L60 HydrophobicContact CD1-CD2 4.23Å; L7-L60 HydrophobicContact CD1-CG 4.36Å; T10-L60 HydrophobicContact CG2-CD1 4.23Å; I11-L60 HydrophobicContact CD1-CD1 4.08Å; I11-L60 HydrophobicContact CD1-CD2 4.06Å; I11-L60 HydrophobicContact CG1-CD1 3.49Å; I11-L60 VanDerWaalsContact CG1-CD1 3.49Å; I11-L60 HydrophobicContact CG1-CD2 4.29Å; L56-L60 WeakPolarHBondContact O-CG 3.48Å; L56-L60 PolarHBondContact O-N 3.36Å; A57-L60 PolarHBondContact O-N 2.8Å; P58-L60 VanDerWaalsContact C-N 3.34Å; P58-L60 PolarHBondContact O-N 2.86Å; L60-E62 VanDerWaalsContact C-N 3.32Å; L60-L63 PolarHBondContact O-N 3.31Å; L60-G64 PolarHBondContact O-N 2.96Å; L60-L284 HydrophobicContact CB-CD1 4.4Å
61A83.6Confident85.5Confident8 Ų838.9 Ų38.97%0.06620%0.204CC..Hα-helixtrans-65.3-36.4175.400000111.7A57 P58 E59 L63 G64 V65 F285A57-A61 WeakPolarHBondContact O-CB 3.36Å; A57-A61 PolarHBondContact O-N 3.44Å; P58-A61 CarbonylContact O-C 3.4Å; P58-A61 WeakPolarHBondContact O-CA 3.15Å; P58-A61 VanDerWaalsContact O-CB 3.28Å; P58-A61 WeakPolarHBondContact O-CB 3.14Å; P58-A61 PolarHBondContact O-N 3.4Å; P58-A61 VanDerWaalsContact O-N 3.11Å; E59-A61 VanDerWaalsContact C-N 3.31Å; A61-L63 VanDerWaalsContact C-N 3.34Å; A61-L63 PolarHBondContact O-N 3.44Å; A61-G64 CarbonylContact O-C 3.48Å; A61-G64 WeakPolarHBondContact O-CA 3.49Å; A61-G64 PolarHBondContact O-N 2.91Å; A61-V65 WeakPolarHBondContact O-CG2 3.18Å; A61-V65 PolarHBondContact O-N 3.36Å; A61-F285 HydrophobicContact CB-CB 4.26Å; A61-F285 HydrophobicContact CB-CD2 4.08Å
62E85.5Confident85.2Confident95 Ų9536.7 Ų36.744%0.44419%0.191SC..Hα-helixtrans-60.9-40.9174.4-72.9178.8-179.900112.1P58 E59 L60 G64 V65 I66P58-E62 PolarHBondContact O-N 3.25Å; E59-E62 WeakPolarHBondContact O-CB 3.23Å; E59-E62 PolarHBondContact O-N 2.86Å; L60-E62 VanDerWaalsContact C-N 3.32Å; E62-G64 VanDerWaalsContact C-N 3.29Å; E62-G64 PolarHBondContact O-N 3.29Å; E62-V65 PolarHBondContact O-N 3.34Å; E62-I66 WeakPolarHBondContact O-CG1 3.24Å; E62-I66 PolarHBondContact O-N 3.46Å
63L90.3Very high85.4Confident60 Ų6036.5 Ų36.531%0.31419%0.189SC..Hα-helixtrans-61-39.7171.6-68.4174.8000111.8E59 L60 A61 I66 L67 L236 F281E59-L63 PolarHBondContact O-N 3.3Å; L60-L63 PolarHBondContact O-N 3.31Å; A61-L63 VanDerWaalsContact C-N 3.34Å; A61-L63 PolarHBondContact O-N 3.44Å; L63-I66 HydrophobicContact CD2-CD1 4.48Å; L63-I66 PolarHBondContact O-N 2.81Å; L63-L67 WeakPolarHBondContact O-CG 3.29Å; L63-L67 PolarHBondContact O-N 2.75Å; L63-L236 HydrophobicContact CD2-CD2 3.73Å; L63-F281 HydrophobicContact CB-CD1 3.76Å; L63-F281 HydrophobicContact CB-CE1 3.98Å; L63-F281 HydrophobicContact CD1-CD1 4.41Å; L63-F281 HydrophobicContact CD1-CE1 3.78Å
64G88.5Confident85.5Confident0 Ų034.3 Ų34.30%018%0.178CC..Hα-helixtrans-59.5-46.5171.800000112.8L60 A61 E62 I66 L67 L68 F281L60-G64 PolarHBondContact O-N 2.96Å; A61-G64 CarbonylContact O-C 3.48Å; A61-G64 WeakPolarHBondContact O-CA 3.49Å; A61-G64 PolarHBondContact O-N 2.91Å; E62-G64 VanDerWaalsContact C-N 3.29Å; E62-G64 PolarHBondContact O-N 3.29Å; G64-I66 PolarHBondContact O-N 3.24Å; G64-L67 PolarHBondContact O-N 2.87Å; G64-L68 VanDerWaalsContact O-CB 3.24Å; G64-L68 WeakPolarHBondContact O-CB 3.41Å; G64-L68 WeakPolarHBondContact O-CG 3.5Å; G64-L68 PolarHBondContact O-N 3.06Å; G64-F281 WeakPolarHBondContact CA-O 3.19Å
65V83.9Confident85.1Confident16 Ų1635.4 Ų35.410%0.09718%0.177CC..Hα-helixtrans-60.4-45.9175.2174.80000110.7A61 E62 L67 L68 M69 A251 F285 I350A61-V65 WeakPolarHBondContact O-CG2 3.18Å; A61-V65 PolarHBondContact O-N 3.36Å; E62-V65 PolarHBondContact O-N 3.34Å; V65-L67 PolarHBondContact O-N 3.18Å; V65-L68 PolarHBondContact O-N 2.97Å; V65-M69 HydrophobicContact CG1-CG 3.88Å; V65-M69 VanDerWaalsContact O-CB 3.28Å; V65-M69 WeakPolarHBondContact O-CB 3.02Å; V65-M69 WeakPolarHBondContact O-CG 3.1Å; V65-M69 PolarHBondContact O-N 2.88Å; V65-A251 HydrophobicContact CG1-CB 4.14Å; V65-F285 HydrophobicContact CG2-CD2 3.37Å; V65-F285 HydrophobicContact CG2-CE2 3.42Å; V65-F285 VanDerWaalsContact CG2-CE2 3.42Å; V65-F285 HydrophobicContact CG2-CG 4.23Å; V65-F285 HydrophobicContact CG2-CZ 4.31Å; V65-I350 HydrophobicContact CB-CD1 4.41Å; V65-I350 HydrophobicContact CG1-CD1 3.67Å; V65-I350 HydrophobicContact CG2-CD1 3.78Å; V65-I350 HydrophobicContact CG2-CG1 4.05Å
66I90.6Very high84.7Confident9 Ų928.3 Ų28.35%0.04615%0.146CC..Hα-helixtrans-57.4-52178.6-69.7162.5000110.6E62 L63 G64 L68 M69 F70 L236 A239 F250 A254E62-I66 WeakPolarHBondContact O-CG1 3.24Å; E62-I66 PolarHBondContact O-N 3.46Å; L63-I66 HydrophobicContact CD2-CD1 4.48Å; L63-I66 PolarHBondContact O-N 2.81Å; G64-I66 PolarHBondContact O-N 3.24Å; I66-L68 PolarHBondContact O-N 3.14Å; I66-M69 PolarHBondContact O-N 3.34Å; I66-F70 VanDerWaalsContact O-CB 3.26Å; I66-F70 WeakPolarHBondContact O-CB 3.42Å; I66-F70 PolarHBondContact O-N 3.33Å; I66-L236 HydrophobicContact CB-CD2 4.34Å; I66-L236 HydrophobicContact CD1-CD2 4.34Å; I66-L236 HydrophobicContact CG2-CD2 3.74Å; I66-A239 HydrophobicContact CD1-CB 4.17Å; I66-A239 HydrophobicContact CG1-CB 3.99Å; I66-A239 HydrophobicContact CG2-CB 3.76Å; I66-F250 HydrophobicContact CD1-CB 4.07Å; I66-F250 HydrophobicContact CD1-CD1 3.89Å; I66-F250 HydrophobicContact CD1-CG 4.04Å; I66-F250 HydrophobicContact CG1-CB 3.74Å; I66-F250 HydrophobicContact CG1-CD1 4.44Å; I66-F250 HydrophobicContact CG1-CG 4.27Å; I66-A254 HydrophobicContact CB-CB 4.4Å; I66-A254 HydrophobicContact CG2-CB 3.85Å; I66-A254 VanDerWaalsContact O-CB 3.23Å; I66-A254 WeakPolarHBondContact O-CB 3.44Å
67L90.7Very high84.1Confident7 Ų727.5 Ų27.54%0.03714%0.143CC..Hα-helixtrans-67.6-36.3-178.2-66.4172.9000112.2L63 G64 V65 G71 L232 L277 R278 F281L63-L67 WeakPolarHBondContact O-CG 3.29Å; L63-L67 PolarHBondContact O-N 2.75Å; G64-L67 PolarHBondContact O-N 2.87Å; V65-L67 PolarHBondContact O-N 3.18Å; L67-G71 PolarHBondContact O-N 3.37Å; L67-L232 HydrophobicContact CD2-CD2 3.85Å; L67-L277 HydrophobicContact CD1-CB 4.4Å; L67-R278 HydrophobicContact CB-CB 4.22Å; L67-R278 HydrophobicContact CB-CG 4.3Å; L67-R278 WeakPolarHBondContact O-CG 3.34Å; L67-F281 HydrophobicContact CD1-CB 3.88Å; L67-F281 HydrophobicContact CD1-CD2 3.66Å; L67-F281 HydrophobicContact CD1-CE2 4.4Å; L67-F281 HydrophobicContact CD1-CG 3.88Å
68L84Confident83.5Confident13 Ų1330.8 Ų30.87%0.06816%0.16CC..Hα-helixtrans-62.4-50.7174-79172.1000111.1G64 V65 I66 F70 G71 V72 R278 A282 F285G64-L68 VanDerWaalsContact O-CB 3.24Å; G64-L68 WeakPolarHBondContact O-CB 3.41Å; G64-L68 WeakPolarHBondContact O-CG 3.5Å; G64-L68 PolarHBondContact O-N 3.06Å; V65-L68 PolarHBondContact O-N 2.97Å; I66-L68 PolarHBondContact O-N 3.14Å; L68-F70 VanDerWaalsContact C-N 3.32Å; L68-F70 PolarHBondContact O-N 3.16Å; L68-G71 CarbonylContact O-C 3.59Å; L68-G71 WeakPolarHBondContact O-CA 3.43Å; L68-G71 PolarHBondContact O-N 2.97Å; L68-V72 WeakPolarHBondContact O-CG2 3.46Å; L68-V72 PolarHBondContact O-N 2.89Å; L68-R278 HydrophobicContact CD2-CG 4.11Å; L68-A282 HydrophobicContact CD1-CB 3.83Å; L68-A282 HydrophobicContact CD2-CB 3.62Å; L68-A282 HydrophobicContact CG-CB 3.81Å; L68-F285 HydrophobicContact CD1-CD1 4.04Å; L68-F285 HydrophobicContact CD1-CG 4.48Å
69M85.3Confident83Confident1 Ų136.7 Ų36.71%0.00518%0.181CC..Hα-helixtrans-66-35.7-179.4-66.9-62.4100.900112.2V65 I66 V72 G73 A251 A254 F255 E346 F347V65-M69 HydrophobicContact CG1-CG 3.88Å; V65-M69 VanDerWaalsContact O-CB 3.28Å; V65-M69 WeakPolarHBondContact O-CB 3.02Å; V65-M69 WeakPolarHBondContact O-CG 3.1Å; V65-M69 PolarHBondContact O-N 2.88Å; I66-M69 PolarHBondContact O-N 3.34Å; M69-V72 HydrophobicContact CE-CG2 4.02Å; M69-V72 PolarHBondContact O-N 3.46Å; M69-G73 PolarHBondContact O-N 3.02Å; M69-A251 HydrophobicContact CB-CB 4.48Å; M69-A251 HydrophobicContact CG-CB 3.73Å; M69-A251 HydrophobicContact SD-CB 4.35Å; M69-A254 HydrophobicContact CB-CB 3.96Å; M69-F255 WeakPolarHBondContact O-CA 3.26Å; M69-E346 HydrophobicContact CE-CG 4.36Å; M69-F347 HydrophobicContact CE-CE1 4.21Å; M69-F347 HydrophobicContact CE-CE2 3.82Å; M69-F347 HydrophobicContact CE-CZ 3.6Å; M69-F347 HydrophobicContact SD-CE1 3.49Å; M69-F347 WeakPolarHBondContact SD-CE1 3.32Å; M69-F347 HydrophobicContact SD-CE2 4.01Å; M69-F347 HydrophobicContact SD-CZ 3.15Å; M69-F347 WeakPolarHBondContact SD-CZ 3.46Å
70F90.5Very high82.3Confident2 Ų235.1 Ų35.11%0.00918%0.176CC..Hα-helixtrans-60.6-45.7168.5178-104.2000111.7I66 L68 V72 G73 L74 V231 A235 A254 A257 L261 T274I66-F70 VanDerWaalsContact O-CB 3.26Å; I66-F70 WeakPolarHBondContact O-CB 3.42Å; I66-F70 PolarHBondContact O-N 3.33Å; L68-F70 VanDerWaalsContact C-N 3.32Å; L68-F70 PolarHBondContact O-N 3.16Å; F70-V72 PolarHBondContact O-N 3.26Å; F70-G73 PolarHBondContact O-N 3.31Å; F70-L74 HydrophobicContact CD1-CD1 3.89Å; F70-L74 HydrophobicContact CD1-CG 4.46Å; F70-L74 HydrophobicContact CE1-CD1 3.41Å; F70-L74 VanDerWaalsContact CE1-CD1 3.41Å; F70-L74 HydrophobicContact CE1-CG 4.1Å; F70-L74 HydrophobicContact CZ-CD1 3.92Å; F70-L74 HydrophobicContact CZ-CD2 4.38Å; F70-L74 HydrophobicContact CZ-CG 4.2Å; F70-L74 WeakPolarHBondContact O-CG 3.47Å; F70-L74 PolarHBondContact O-N 3.46Å; F70-V231 HydrophobicContact CE1-CG1 3.67Å; F70-V231 HydrophobicContact CZ-CG1 3.56Å; F70-A235 HydrophobicContact CB-CB 4.08Å; F70-A235 HydrophobicContact CD1-CB 3.91Å; F70-A235 HydrophobicContact CD2-CB 3.52Å; F70-A235 HydrophobicContact CE1-CB 4.18Å; F70-A235 HydrophobicContact CE2-CB 3.83Å; F70-A235 HydrophobicContact CG-CB 3.55Å; F70-A235 HydrophobicContact CZ-CB 4.13Å; F70-A254 WeakPolarHBondContact CA-O 3.33Å; F70-A254 HydrophobicContact CB-CB 4.23Å; F70-A257 HydrophobicContact CD2-CB 4.06Å; F70-A257 HydrophobicContact CE2-CB 4.21Å; F70-L261 HydrophobicContact CE2-CD2 4.26Å; F70-L261 HydrophobicContact CZ-CD2 3.63Å; F70-T274 HydrophobicContact CE1-CG2 4.1Å
71G85.5Confident82Confident3 Ų335.2 Ų35.23%0.03118%0.177CC..Hα-helixtrans-57.9-45.6173.100000112.6L67 L68 G73 L74 H75L67-G71 PolarHBondContact O-N 3.37Å; L68-G71 CarbonylContact O-C 3.59Å; L68-G71 WeakPolarHBondContact O-CA 3.43Å; L68-G71 PolarHBondContact O-N 2.97Å; G71-G73 VanDerWaalsContact C-N 3.34Å; G71-G73 PolarHBondContact O-N 2.9Å; G71-L74 WeakPolarHBondContact O-CB 3.42Å; G71-L74 PolarHBondContact O-N 2.86Å; G71-H75 PolarHBondContact O-N 2.9Å; G71-H75 PolarHBondContact O-ND1 3.27Å
72V78.3Confident82Confident23 Ų2340.7 Ų40.714%0.13920%0.202CC..Hα-helixtrans-60.9-45175.5175.90000110.4L68 M69 F70 L74 H75 F76 F255L68-V72 WeakPolarHBondContact O-CG2 3.46Å; L68-V72 PolarHBondContact O-N 2.89Å; M69-V72 HydrophobicContact CE-CG2 4.02Å; M69-V72 PolarHBondContact O-N 3.46Å; F70-V72 PolarHBondContact O-N 3.26Å; V72-L74 VanDerWaalsContact C-N 3.27Å; V72-L74 PolarHBondContact O-N 3.24Å; V72-H75 CarbonylContact O-C 3.44Å; V72-H75 PolarHBondContact O-N 2.81Å; V72-F76 PolarHBondContact O-N 3.37Å; V72-F255 HydrophobicContact CB-CD2 4.47Å; V72-F255 HydrophobicContact CG1-CD2 4.1Å; V72-F255 HydrophobicContact CG1-CE2 3.98Å
73G86.1Confident81.8Confident0 Ų039.5 Ų39.50%021%0.209CC..Hα-helixtrans-58-38.1174.800000113M69 F70 G71 H75 F76 F255 G258 M259M69-G73 PolarHBondContact O-N 3.02Å; F70-G73 PolarHBondContact O-N 3.31Å; G71-G73 VanDerWaalsContact C-N 3.34Å; G71-G73 PolarHBondContact O-N 2.9Å; G73-H75 VanDerWaalsContact C-N 3.31Å; G73-H75 PolarHBondContact O-N 3.34Å; G73-F76 WeakPolarHBondContact O-CB 3.38Å; G73-F76 PolarHBondContact O-N 3.4Å; G73-F255 WeakPolarHBondContact CA-O 3.16Å; G73-G258 CarbonylContact O-C 3.49Å; G73-M259 VanDerWaalsContact O-CA 3.24Å; G73-M259 WeakPolarHBondContact O-CA 3.47Å; G73-M259 PolarHBondContact O-N 2.62Å
74L84.6Confident81.4Confident9 Ų937 Ų375%0.04720%0.196CC..Hα-helixtrans-65.9-30.4175.6-76173000113.6F70 G71 V72 G258 L261 N262 A271F70-L74 HydrophobicContact CD1-CD1 3.89Å; F70-L74 HydrophobicContact CD1-CG 4.46Å; F70-L74 HydrophobicContact CE1-CD1 3.41Å; F70-L74 VanDerWaalsContact CE1-CD1 3.41Å; F70-L74 HydrophobicContact CE1-CG 4.1Å; F70-L74 HydrophobicContact CZ-CD1 3.92Å; F70-L74 HydrophobicContact CZ-CD2 4.38Å; F70-L74 HydrophobicContact CZ-CG 4.2Å; F70-L74 WeakPolarHBondContact O-CG 3.47Å; F70-L74 PolarHBondContact O-N 3.46Å; G71-L74 WeakPolarHBondContact O-CB 3.42Å; G71-L74 PolarHBondContact O-N 2.86Å; V72-L74 VanDerWaalsContact C-N 3.27Å; V72-L74 PolarHBondContact O-N 3.24Å; L74-G258 WeakPolarHBondContact CD2-O 3.31Å; L74-L261 HydrophobicContact CD2-CB 3.87Å; L74-L261 HydrophobicContact CD2-CD2 3.97Å; L74-L261 HydrophobicContact CD2-CG 3.86Å; L74-N262 PolarHBondContact O-ND2 3.08Å; L74-N262 PolarHBondContact O-OD1 3.48Å; L74-A271 HydrophobicContact CD1-CB 4.1Å
75H74.4Confident81.4Confident105 Ų10542 Ų4249%0.48622%0.218SC..Hα-helixtrans-90.7-5.7177.3-63.682.6000112.4G71 V72 G73 S77G71-H75 PolarHBondContact O-N 2.9Å; G71-H75 PolarHBondContact O-ND1 3.27Å; V72-H75 CarbonylContact O-C 3.44Å; V72-H75 PolarHBondContact O-N 2.81Å; G73-H75 VanDerWaalsContact C-N 3.31Å; G73-H75 PolarHBondContact O-N 3.34Å; H75-S77 PolarHBondContact O-N 3.15Å
76F74.3Confident81.6Confident13 Ų1345.6 Ų45.66%0.05724%0.24CC..  trans-73101.5177.2-177-87.2000110V72 G73 L78 L81 I155 F255 M259 N262V72-F76 PolarHBondContact O-N 3.37Å; G73-F76 WeakPolarHBondContact O-CB 3.38Å; G73-F76 PolarHBondContact O-N 3.4Å; F76-L78 HydrophobicContact CD1-CD2 4.46Å; F76-L78 HydrophobicContact CD1-CG 4.27Å; F76-L78 HydrophobicContact CE1-CD2 3.35Å; F76-L78 HydrophobicContact CE1-CG 3.55Å; F76-L78 HydrophobicContact CZ-CD2 3.74Å; F76-L78 HydrophobicContact CZ-CG 4.42Å; F76-L81 HydrophobicContact CZ-CD2 4.4Å; F76-I155 HydrophobicContact CD2-CB 4.38Å; F76-I155 HydrophobicContact CD2-CD1 4.48Å; F76-I155 HydrophobicContact CD2-CG1 4.25Å; F76-I155 HydrophobicContact CD2-CG2 3.35Å; F76-I155 HydrophobicContact CE2-CB 4.47Å; F76-I155 HydrophobicContact CE2-CG2 3.1Å; F76-I155 HydrophobicContact CZ-CG2 4.16Å; F76-F255 HydrophobicContact CB-CE2 4.38Å; F76-F255 HydrophobicContact CB-CZ 4.44Å; F76-F255 HydrophobicContact CD2-CE2 4.1Å; F76-F255 AromaticContact CD2-CZ 3.62Å; F76-F255 HydrophobicContact CD2-CZ 3.62Å; F76-F255 AromaticContact CE2-CZ 3.93Å; F76-F255 HydrophobicContact CE2-CZ 3.93Å; F76-F255 HydrophobicContact CG-CE2 4.45Å; F76-F255 HydrophobicContact CG-CZ 4.07Å; F76-M259 HydrophobicContact CD1-CE 3.6Å; F76-M259 HydrophobicContact CD1-CG 3.82Å; F76-M259 HydrophobicContact CD1-SD 4Å; F76-M259 HydrophobicContact CE1-CE 3.46Å; F76-M259 VanDerWaalsContact CE1-CE 3.46Å; F76-M259 HydrophobicContact CE1-CG 4.24Å; F76-M259 HydrophobicContact CE1-SD 3.82Å; F76-M259 HydrophobicContact CE2-CE 4.39Å; F76-M259 HydrophobicContact CG-CE 4.13Å; F76-M259 HydrophobicContact CZ-CE 3.92Å; F76-N262 PolarHBondContact O-ND2 3.15Å
77S71.3Confident81.5Confident23 Ų2346 Ų4616%0.16124%0.242CC..  trans-97.3110.1170.6174.70000109.8H75 K79 D80 L81H75-S77 PolarHBondContact O-N 3.15Å; S77-K79 PolarHBondContact O-N 3.36Å; S77-K79 PolarHBondContact OG-N 2.69Å; S77-D80 WeakPolarHBondContact CB-OD2 3.47Å; S77-D80 PolarHBondContact O-N 2.88Å; S77-D80 VanDerWaalsContact O-N 3.17Å; S77-D80 PolarHBondContact OG-N 3.47Å; S77-D80 PolarHBondContact OG-OD1 3.35Å; S77-D80 PolarHBondContact OG-OD2 3.32Å; S77-L81 PolarHBondContact O-N 2.85Å; S77-L81 VanDerWaalsContact O-N 3.1Å
78L72.8Confident81.4Confident76 Ų7645.6 Ų45.640%0.39824%0.24SC..Hα-helixtrans-56-33.6171.5-79172.1000111.8F76 M82F76-L78 HydrophobicContact CD1-CD2 4.46Å; F76-L78 HydrophobicContact CD1-CG 4.27Å; F76-L78 HydrophobicContact CE1-CD2 3.35Å; F76-L78 HydrophobicContact CE1-CG 3.55Å; F76-L78 HydrophobicContact CZ-CD2 3.74Å; F76-L78 HydrophobicContact CZ-CG 4.42Å; L78-M82 WeakPolarHBondContact O-CB 3.44Å; L78-M82 WeakPolarHBondContact O-CG 3.36Å; L78-M82 PolarHBondContact O-N 2.83Å
79K71.9Confident81.8Confident171 Ų17148.1 Ų48.174%0.74325%0.253SS*.Hα-helixtrans-65.9-43.4179.6-64.8-179.2-179.7177.70110.9S77 M82 A83S77-K79 PolarHBondContact O-N 3.36Å; S77-K79 PolarHBondContact OG-N 2.69Å; K79-M82 WeakPolarHBondContact O-CB 3.24Å; K79-M82 PolarHBondContact O-N 2.97Å; K79-A83 PolarHBondContact O-N 3.04Å
80D70.1Confident82.2Confident85 Ų8550.6 Ų50.646%0.45527%0.269SS..Hα-helixtrans-69.7-42.5-177.7-55.7-0.3000109.9S77 M82 A83 V84S77-D80 WeakPolarHBondContact CB-OD2 3.47Å; S77-D80 PolarHBondContact O-N 2.88Å; S77-D80 VanDerWaalsContact O-N 3.17Å; S77-D80 PolarHBondContact OG-N 3.47Å; S77-D80 PolarHBondContact OG-OD1 3.35Å; S77-D80 PolarHBondContact OG-OD2 3.32Å; D80-M82 VanDerWaalsContact C-N 3.31Å; D80-M82 PolarHBondContact O-N 3.4Å; D80-A83 WeakPolarHBondContact O-CB 3.25Å; D80-A83 PolarHBondContact O-N 3.43Å; D80-A83 VanDerWaalsContact O-N 3.15Å; D80-V84 PolarHBondContact O-N 3.46Å
81L79.8Confident82.3Confident20 Ų2050.5 Ų50.511%0.10527%0.268CS..Hα-helixtrans-59.9-41.8172.1179.463.3000111.6F76 S77 A83 V84 K85 A88 I89 G152 I155 V156F76-L81 HydrophobicContact CZ-CD2 4.4Å; S77-L81 PolarHBondContact O-N 2.85Å; S77-L81 VanDerWaalsContact O-N 3.1Å; L81-A83 VanDerWaalsContact C-N 3.26Å; L81-A83 PolarHBondContact O-N 3.48Å; L81-V84 CarbonylContact O-C 3.5Å; L81-V84 PolarHBondContact O-N 3.47Å; L81-K85 WeakPolarHBondContact O-CA 3.46Å; L81-K85 WeakPolarHBondContact O-CB 3.42Å; L81-K85 PolarHBondContact O-N 3.43Å; L81-A88 HydrophobicContact CD1-CB 4.41Å; L81-I89 HydrophobicContact CD1-CG1 4.35Å; L81-G152 WeakPolarHBondContact CD1-O 3.31Å; L81-I155 HydrophobicContact CD1-CG2 4.3Å; L81-I155 HydrophobicContact CD2-CG2 4Å; L81-V156 HydrophobicContact CD1-CG2 3.68Å
82M84.5Confident82.6Confident123 Ų12350.3 Ų50.361%0.60627%0.267SS*.Hα-helixtrans-63.9-30.2177.6-79.4-179.368.600113L78 K79 D80 K85L78-M82 WeakPolarHBondContact O-CB 3.44Å; L78-M82 WeakPolarHBondContact O-CG 3.36Å; L78-M82 PolarHBondContact O-N 2.83Å; K79-M82 WeakPolarHBondContact O-CB 3.24Å; K79-M82 PolarHBondContact O-N 2.97Å; D80-M82 VanDerWaalsContact C-N 3.31Å; D80-M82 PolarHBondContact O-N 3.4Å; M82-K85 WeakPolarHBondContact O-CD 3.48Å; M82-K85 WeakPolarHBondContact O-CG 3.42Å
83A79.5Confident83.4Confident70 Ų7053.7 Ų53.758%0.57928%0.283SS*.Hα-helixtrans-68.1-35.2177.400000112.4K79 D80 L81K79-A83 PolarHBondContact O-N 3.04Å; D80-A83 WeakPolarHBondContact O-CB 3.25Å; D80-A83 PolarHBondContact O-N 3.43Å; D80-A83 VanDerWaalsContact O-N 3.15Å; L81-A83 VanDerWaalsContact C-N 3.26Å; L81-A83 PolarHBondContact O-N 3.48Å
84V82Confident83.9Confident9 Ų955.3 Ų55.36%0.05530%0.296CS..Hα-helixtrans-11011.5-178.6-61.90000114.1D80 L81 T86 I87 A88 Q148 I149D80-V84 PolarHBondContact O-N 3.46Å; L81-V84 CarbonylContact O-C 3.5Å; L81-V84 PolarHBondContact O-N 3.47Å; V84-T86 PolarHBondContact O-N 3.5Å; V84-I87 PolarHBondContact O-N 3.13Å; V84-A88 HydrophobicContact CB-CB 4.41Å; V84-A88 HydrophobicContact CG2-CB 3.84Å; V84-A88 WeakPolarHBondContact O-CB 3.45Å; V84-A88 PolarHBondContact O-N 3.4Å; V84-Q148 HydrophobicContact CG1-CB 4.01Å; V84-I149 HydrophobicContact CB-CG1 4.26Å; V84-I149 HydrophobicContact CG1-CG1 3.85Å
85K89Confident84.4Confident104 Ų10454.9 Ų54.945%0.45229%0.294SS..Hα-helixtrans-55.4-30.7-171.370.4-175.5178.7-174.20114.8L81 M82 I87 I89 P90L81-K85 WeakPolarHBondContact O-CA 3.46Å; L81-K85 WeakPolarHBondContact O-CB 3.42Å; L81-K85 PolarHBondContact O-N 3.43Å; M82-K85 WeakPolarHBondContact O-CD 3.48Å; M82-K85 WeakPolarHBondContact O-CG 3.42Å; K85-I87 VanDerWaalsContact C-N 3.26Å; K85-I87 PolarHBondContact O-N 2.73Å; K85-I89 HydrophobicContact CB-CD1 3.83Å; K85-I89 HydrophobicContact CB-CG1 4.37Å; K85-I89 WeakPolarHBondContact O-CB 3.35Å; K85-I89 PolarHBondContact O-N 2.83Å; K85-P90 WeakPolarHBondContact O-CD 3.46Å
86T87.8Confident85.4Confident92 Ų9250.4 Ų50.456%0.56427%0.273SS*.Hα-helixtrans-69-25.6-177.147.80000112.6V84 P90V84-T86 PolarHBondContact O-N 3.5Å; T86-P90 WeakPolarHBondContact O-CG 3.27Å
87I88.2Confident86.4Confident16 Ų1652.1 Ų52.18%0.08229%0.29CS..Hα-helixtrans-108.4-48.1179-58.8120.9000110.3V84 K85 G91 I149 W153 F327 H329V84-I87 PolarHBondContact O-N 3.13Å; K85-I87 VanDerWaalsContact C-N 3.26Å; K85-I87 PolarHBondContact O-N 2.73Å; I87-G91 VanDerWaalsContact O-CA 3.29Å; I87-G91 WeakPolarHBondContact O-CA 3.24Å; I87-G91 PolarHBondContact O-N 3.21Å; I87-I149 HydrophobicContact CG2-CG2 4.05Å; I87-W153 HydrophobicContact CG2-CZ3 4.47Å; I87-F327 HydrophobicContact CG1-CB 4.02Å; I87-F327 HydrophobicContact CG1-CG 4.21Å; I87-F327 HydrophobicContact CG2-CB 4.48Å; I87-F327 HydrophobicContact CG2-CD2 4.21Å; I87-F327 HydrophobicContact CG2-CG 4.47Å; I87-H329 WeakPolarHBondContact CD1-NE2 3.47Å; I87-H329 WeakPolarHBondContact CG1-NE2 3.44Å
88A89.1Confident87.6Confident0 Ų053.7 Ų53.70%030%0.299CS..Hα-helixtrans-63-46.8-172.800000113L81 V84 A92L81-A88 HydrophobicContact CD1-CB 4.41Å; V84-A88 HydrophobicContact CB-CB 4.41Å; V84-A88 HydrophobicContact CG2-CB 3.84Å; V84-A88 WeakPolarHBondContact O-CB 3.45Å; V84-A88 PolarHBondContact O-N 3.4Å; A88-A92 WeakPolarHBondContact O-CB 3.22Å; A88-A92 PolarHBondContact O-N 3.14Å
89I92.2Very high88.7Confident66 Ų6650.1 Ų50.134%0.33828%0.28SS..Hα-helixtrans-66.6-59.5-177.6-59.3177.1000112L81 K85 G91 I93 V156L81-I89 HydrophobicContact CD1-CG1 4.35Å; K85-I89 HydrophobicContact CB-CD1 3.83Å; K85-I89 HydrophobicContact CB-CG1 4.37Å; K85-I89 WeakPolarHBondContact O-CB 3.35Å; K85-I89 PolarHBondContact O-N 2.83Å; I89-G91 VanDerWaalsContact C-N 3.29Å; I89-G91 PolarHBondContact O-N 3.18Å; I89-I93 HydrophobicContact CG2-CD1 3.88Å; I89-I93 WeakPolarHBondContact O-CG1 3.14Å; I89-I93 PolarHBondContact O-N 3Å; I89-I93 VanDerWaalsContact O-N 3.13Å; I89-V156 HydrophobicContact CB-CG2 4.48Å; I89-V156 HydrophobicContact CG1-CG2 3.89Å
90P93.4Very high89.8Confident52 Ų5242.7 Ų42.734%0.33825%0.249SC..Hα-helixtrans-66.8-34-179.426.6-34.1000111.9K85 T86 A94 F327K85-P90 WeakPolarHBondContact O-CD 3.46Å; T86-P90 WeakPolarHBondContact O-CG 3.27Å; P90-A94 WeakPolarHBondContact O-CB 3.39Å; P90-A94 PolarHBondContact O-N 3.44Å; P90-F327 HydrophobicContact CB-CZ 3.97Å; P90-F327 HydrophobicContact CG-CE1 4.2Å; P90-F327 HydrophobicContact CG-CE2 4.3Å; P90-F327 HydrophobicContact CG-CZ 3.64Å
91G92.7Very high91.1Very high0 Ų043.8 Ų43.80%025%0.254CS..Hα-helixtrans-59.8-54.517600000112.3I87 I89 A94 Q95 W153 L323I87-G91 VanDerWaalsContact O-CA 3.29Å; I87-G91 WeakPolarHBondContact O-CA 3.24Å; I87-G91 PolarHBondContact O-N 3.21Å; I89-G91 VanDerWaalsContact C-N 3.29Å; I89-G91 PolarHBondContact O-N 3.18Å; G91-A94 PolarHBondContact O-N 2.82Å; G91-Q95 WeakPolarHBondContact O-CB 3.33Å; G91-Q95 PolarHBondContact O-N 2.94Å; G91-W153 WeakPolarHBondContact O-CZ2 3.32Å; G91-L323 WeakPolarHBondContact O-CD1 3.48Å
92A93.3Very high91.9Very high0 Ų045.7 Ų45.70%026%0.264CS..Hα-helixtrans-62.4-46179.700000112.1A88 A94 Q95 I96 W153 V156 E157A88-A92 WeakPolarHBondContact O-CB 3.22Å; A88-A92 PolarHBondContact O-N 3.14Å; A92-A94 VanDerWaalsContact C-N 3.34Å; A92-A94 PolarHBondContact O-N 2.87Å; A92-Q95 PolarHBondContact O-N 3.45Å; A92-I96 WeakPolarHBondContact O-CB 3.35Å; A92-I96 WeakPolarHBondContact O-CD1 3.4Å; A92-I96 WeakPolarHBondContact O-CG1 3.41Å; A92-I96 PolarHBondContact O-N 3.48Å; A92-W153 HydrophobicContact CB-CD2 4.27Å; A92-W153 HydrophobicContact CB-CG 4.08Å; A92-V156 HydrophobicContact CB-CB 3.67Å; A92-V156 HydrophobicContact CB-CG1 3.59Å; A92-E157 HydrophobicContact CB-CG 4.21Å
93I95Very high92.5Very high94 Ų9439.9 Ų39.948%0.48224%0.236SC..Hα-helixtrans-60.4-44.7178.4-66.4170.3000111.1I89 I96 A97 V156I89-I93 HydrophobicContact CG2-CD1 3.88Å; I89-I93 WeakPolarHBondContact O-CG1 3.14Å; I89-I93 PolarHBondContact O-N 3Å; I89-I93 VanDerWaalsContact O-N 3.13Å; I93-I96 PolarHBondContact O-N 2.86Å; I93-A97 WeakPolarHBondContact O-CB 3.35Å; I93-A97 PolarHBondContact O-N 3.24Å; I93-V156 HydrophobicContact CG1-CG1 4.4Å
94A95.3Very high93.3Very high33 Ų3338.7 Ų38.727%0.27322%0.219SC..Hα-helixtrans-66.8-42.2179.100000111.9P90 G91 A92 A97 V98 L323P90-A94 WeakPolarHBondContact O-CB 3.39Å; P90-A94 PolarHBondContact O-N 3.44Å; G91-A94 PolarHBondContact O-N 2.82Å; A92-A94 VanDerWaalsContact C-N 3.34Å; A92-A94 PolarHBondContact O-N 2.87Å; A94-A97 PolarHBondContact O-N 3.12Å; A94-V98 WeakPolarHBondContact O-CG2 3.48Å; A94-V98 PolarHBondContact O-N 3.28Å; A94-L323 HydrophobicContact CB-CD1 3.74Å; A94-L323 HydrophobicContact CB-CD2 3.84Å; A94-L323 HydrophobicContact CB-CG 4.47Å
95Q95.1Very high94Very high0 Ų040.9 Ų40.90%024%0.238CC..Hα-helixtrans-66-39.9176.7172.1-80-26.900111.7G91 A92 A97 V98 A99 S125 W153 E157 K316 A319 L323G91-Q95 WeakPolarHBondContact O-CB 3.33Å; G91-Q95 PolarHBondContact O-N 2.94Å; A92-Q95 PolarHBondContact O-N 3.45Å; Q95-A97 VanDerWaalsContact C-N 3.32Å; Q95-A97 PolarHBondContact O-N 3.31Å; Q95-V98 PolarHBondContact O-N 3.48Å; Q95-A99 WeakPolarHBondContact O-CB 3.16Å; Q95-A99 PolarHBondContact O-N 3.39Å; Q95-S125 PolarHBondContact NE2-O 2.82Å; Q95-W153 HydrophobicContact CB-CZ2 3.69Å; Q95-W153 HydrophobicContact CG-CZ2 4.31Å; Q95-E157 PolarHBondContact OE1-OE1 3.25Å; Q95-E157 VanDerWaalsContact OE1-OE1 3.13Å; Q95-K316 HydrophobicContact CG-CB 4.2Å; Q95-A319 HydrophobicContact CG-CB 4.47Å; Q95-L323 HydrophobicContact CB-CD1 4.08Å
96I95.5Very high94.3Very high11 Ų1136.9 Ų36.96%0.05622%0.221CC..Hα-helixtrans-59.9-45.7174.4-69.7163000109.9A92 I93 V98 A99 T100 L122 E157 V160 M161A92-I96 WeakPolarHBondContact O-CB 3.35Å; A92-I96 WeakPolarHBondContact O-CD1 3.4Å; A92-I96 WeakPolarHBondContact O-CG1 3.41Å; A92-I96 PolarHBondContact O-N 3.48Å; I93-I96 PolarHBondContact O-N 2.86Å; I96-V98 PolarHBondContact O-N 2.81Å; I96-A99 PolarHBondContact O-N 3.42Å; I96-T100 VanDerWaalsContact O-CB 3.24Å; I96-T100 WeakPolarHBondContact O-CB 3.36Å; I96-T100 PolarHBondContact O-N 3.48Å; I96-T100 PolarHBondContact O-OG1 3Å; I96-L122 HydrophobicContact CG2-CD2 4.04Å; I96-E157 HydrophobicContact CD1-CG 4.15Å; I96-E157 HydrophobicContact CG1-CG 4.33Å; I96-V160 HydrophobicContact CD1-CB 3.92Å; I96-V160 HydrophobicContact CD1-CG1 3.98Å; I96-V160 HydrophobicContact CD1-CG2 4.04Å; I96-M161 HydrophobicContact CD1-CE 4.21Å; I96-M161 HydrophobicContact CG1-CE 4.45Å; I96-M161 HydrophobicContact CG2-CE 4.26Å
97A96.3Very high94.7Very high49 Ų4932.6 Ų32.641%0.40520%0.195SC..Hα-helixtrans-60-45.9176.500000111.6I93 A94 Q95 T100 L101I93-A97 WeakPolarHBondContact O-CB 3.35Å; I93-A97 PolarHBondContact O-N 3.24Å; A94-A97 PolarHBondContact O-N 3.12Å; Q95-A97 VanDerWaalsContact C-N 3.32Å; Q95-A97 PolarHBondContact O-N 3.31Å; A97-T100 PolarHBondContact O-N 3Å; A97-L101 WeakPolarHBondContact O-CB 3.28Å; A97-L101 VanDerWaalsContact O-CG 3.25Å; A97-L101 WeakPolarHBondContact O-CG 3.49Å; A97-L101 PolarHBondContact O-N 3.39Å
98V95.6Very high95Very high57 Ų5735 Ų3535%0.34522%0.218SC..Hα-helixtrans-63.4-47.9178.2173.10000111.5A94 Q95 I96 T100 L101 L102 A319A94-V98 WeakPolarHBondContact O-CG2 3.48Å; A94-V98 PolarHBondContact O-N 3.28Å; Q95-V98 PolarHBondContact O-N 3.48Å; I96-V98 PolarHBondContact O-N 2.81Å; V98-T100 VanDerWaalsContact C-N 3.29Å; V98-T100 PolarHBondContact O-N 3.16Å; V98-L101 PolarHBondContact O-N 3.04Å; V98-L102 HydrophobicContact CG1-CD1 4.1Å; V98-L102 HydrophobicContact CG1-CG 4.43Å; V98-L102 WeakPolarHBondContact O-CG 3.18Å; V98-L102 PolarHBondContact O-N 3.09Å; V98-A319 HydrophobicContact CB-CB 4.02Å; V98-A319 HydrophobicContact CG1-CB 3.75Å; V98-A319 HydrophobicContact CG2-CB 4.33Å
99A95.6Very high95.3Very high0 Ų040.9 Ų40.90%025%0.253CS..Hα-helixtrans-61-40.5177.500000111.5Q95 I96 L102 G103 K316Q95-A99 WeakPolarHBondContact O-CB 3.16Å; Q95-A99 PolarHBondContact O-N 3.39Å; I96-A99 PolarHBondContact O-N 3.42Å; A99-L102 PolarHBondContact O-N 3.46Å; A99-G103 PolarHBondContact O-N 2.92Å; A99-K316 HydrophobicContact CB-CB 4.14Å
100T96.6Very high95.4Very high15 Ų1540.3 Ų40.39%0.09225%0.25CS..Hα-helixtrans-63.6-45.9176.7-560000111.2I96 A97 V98 L102 G103 M104 L122I96-T100 VanDerWaalsContact O-CB 3.24Å; I96-T100 WeakPolarHBondContact O-CB 3.36Å; I96-T100 PolarHBondContact O-N 3.48Å; I96-T100 PolarHBondContact O-OG1 3Å; A97-T100 PolarHBondContact O-N 3Å; V98-T100 VanDerWaalsContact C-N 3.29Å; V98-T100 PolarHBondContact O-N 3.16Å; T100-L102 PolarHBondContact O-N 3.37Å; T100-G103 PolarHBondContact O-N 2.92Å; T100-M104 HydrophobicContact CG2-CG 4.4Å; T100-M104 HydrophobicContact CG2-SD 4.07Å; T100-M104 WeakPolarHBondContact O-CB 3.21Å; T100-M104 VanDerWaalsContact O-CG 3.24Å; T100-M104 WeakPolarHBondContact O-CG 3.34Å; T100-M104 PolarHBondContact O-N 3.4Å; T100-L122 HydrophobicContact CG2-CG 4.23Å
101L97Very high95.3Very high108 Ų10841.1 Ų41.157%0.56527%0.268SS*.Hα-helixtrans-62.6-40.2176.4-72.4171.5000112.5A97 V98 M104 A105A97-L101 WeakPolarHBondContact O-CB 3.28Å; A97-L101 VanDerWaalsContact O-CG 3.25Å; A97-L101 WeakPolarHBondContact O-CG 3.49Å; A97-L101 PolarHBondContact O-N 3.39Å; V98-L101 PolarHBondContact O-N 3.04Å; L101-M104 HydrophobicContact CD2-SD 4.27Å; L101-M104 PolarHBondContact O-N 3.06Å; L101-A105 WeakPolarHBondContact O-CB 3.07Å; L101-A105 PolarHBondContact O-N 3.22Å
102L96.5Very high95.4Very high61 Ų6143.6 Ų43.632%0.31928%0.277SS..Hα-helixtrans-64.7-41.9174.9-70175000111.6V98 A99 T100 A105 L106 I311V98-L102 HydrophobicContact CG1-CD1 4.1Å; V98-L102 HydrophobicContact CG1-CG 4.43Å; V98-L102 WeakPolarHBondContact O-CG 3.18Å; V98-L102 PolarHBondContact O-N 3.09Å; A99-L102 PolarHBondContact O-N 3.46Å; T100-L102 PolarHBondContact O-N 3.37Å; L102-A105 PolarHBondContact O-N 3.13Å; L102-L106 PolarHBondContact O-N 3.32Å; L102-I311 HydrophobicContact CB-CD1 4.29Å; L102-I311 HydrophobicContact CB-CG1 4.23Å; L102-I311 HydrophobicContact CB-CG2 3.81Å; L102-I311 HydrophobicContact CD1-CG2 4.23Å
103G96.6Very high95.4Very high0 Ų046.5 Ų46.50%030%0.298CS..Hα-helixtrans-64.1-42.1173.800000112.8A99 T100 A105 L106 S107A99-G103 PolarHBondContact O-N 2.92Å; T100-G103 PolarHBondContact O-N 2.92Å; G103-A105 VanDerWaalsContact C-N 3.33Å; G103-A105 PolarHBondContact O-N 3.19Å; G103-L106 PolarHBondContact O-N 2.89Å; G103-S107 VanDerWaalsContact O-CB 3.22Å; G103-S107 WeakPolarHBondContact O-CB 3.49Å; G103-S107 PolarHBondContact O-N 3.09Å
104M96.9Very high95.3Very high45 Ų4547.8 Ų47.822%0.22231%0.305CS..Hα-helixtrans-60.9-41.3173.3-72.2169.872.200111.7T100 L101 S107 A108 L114 G117 I118T100-M104 HydrophobicContact CG2-CG 4.4Å; T100-M104 HydrophobicContact CG2-SD 4.07Å; T100-M104 WeakPolarHBondContact O-CB 3.21Å; T100-M104 VanDerWaalsContact O-CG 3.24Å; T100-M104 WeakPolarHBondContact O-CG 3.34Å; T100-M104 PolarHBondContact O-N 3.4Å; L101-M104 HydrophobicContact CD2-SD 4.27Å; L101-M104 PolarHBondContact O-N 3.06Å; M104-S107 WeakPolarHBondContact O-CB 3.39Å; M104-S107 PolarHBondContact O-N 3.49Å; M104-A108 WeakPolarHBondContact O-CB 3.25Å; M104-A108 PolarHBondContact O-N 3.37Å; M104-L114 HydrophobicContact CE-CD1 3.38Å; M104-L114 HydrophobicContact CE-CG 4.24Å; M104-G117 WeakPolarHBondContact CG-O 3.45Å; M104-I118 HydrophobicContact CE-CD1 4.44Å; M104-I118 HydrophobicContact CE-CG1 3.88Å; M104-I118 HydrophobicContact CG-CG1 4.13Å; M104-I118 HydrophobicContact SD-CG1 3.72Å
105A96.6Very high95.1Very high55 Ų5548.2 Ų48.246%0.45530%0.301SS..Hα-helixtrans-63.1-45.1176.500000111.6L101 L102 G103 A108 V109L101-A105 WeakPolarHBondContact O-CB 3.07Å; L101-A105 PolarHBondContact O-N 3.22Å; L102-A105 PolarHBondContact O-N 3.13Å; G103-A105 VanDerWaalsContact C-N 3.33Å; G103-A105 PolarHBondContact O-N 3.19Å; A105-A108 PolarHBondContact O-N 2.87Å; A105-V109 WeakPolarHBondContact O-CG2 3.22Å; A105-V109 PolarHBondContact O-N 2.93Å; A105-V109 VanDerWaalsContact O-N 3.15Å
106L95.8Very high95.1Very high21 Ų2148.9 Ų48.911%0.1131%0.306CS..Hα-helixtrans-64.1-43.1175.3-179.155.3000111.5L102 G103 A108 V109 L110 F120 A307 I311L102-L106 PolarHBondContact O-N 3.32Å; G103-L106 PolarHBondContact O-N 2.89Å; L106-A108 VanDerWaalsContact C-N 3.32Å; L106-A108 PolarHBondContact O-N 3.2Å; L106-V109 WeakPolarHBondContact O-CB 3.2Å; L106-V109 PolarHBondContact O-N 2.88Å; L106-V109 VanDerWaalsContact O-N 3.15Å; L106-L110 HydrophobicContact CD1-CD1 4.38Å; L106-L110 HydrophobicContact CD1-CG 4.39Å; L106-L110 HydrophobicContact CG-CD1 4.17Å; L106-L110 WeakPolarHBondContact O-CG 3.33Å; L106-L110 PolarHBondContact O-N 2.92Å; L106-F120 HydrophobicContact CD2-CE1 4.03Å; L106-F120 HydrophobicContact CD2-CZ 4.37Å; L106-F120 HydrophobicContact CG-CE1 4.37Å; L106-A307 HydrophobicContact CD1-CB 3.81Å; L106-A307 HydrophobicContact CD2-CB 3.87Å; L106-I311 HydrophobicContact CB-CD1 3.88Å; L106-I311 HydrophobicContact CD2-CD1 3.72Å; L106-I311 HydrophobicContact CG-CD1 4.43Å
107S96Very high95.2Very high1 Ų148.4 Ų48.41%0.00730%0.303CS..Hα-helixtrans-58.1-41.8175.4178.60000112.3G103 M104 L110 G111 W112 G117G103-S107 VanDerWaalsContact O-CB 3.22Å; G103-S107 WeakPolarHBondContact O-CB 3.49Å; G103-S107 PolarHBondContact O-N 3.09Å; M104-S107 WeakPolarHBondContact O-CB 3.39Å; M104-S107 PolarHBondContact O-N 3.49Å; S107-L110 CarbonylContact O-C 3.55Å; S107-L110 PolarHBondContact O-N 3.21Å; S107-G111 PolarHBondContact O-N 2.81Å; S107-G111 VanDerWaalsContact O-N 3.16Å; S107-W112 PolarHBondContact O-N 3.33Å; S107-W112 VanDerWaalsContact OG-CB 3.24Å; S107-W112 WeakPolarHBondContact OG-CB 3.42Å; S107-G117 WeakPolarHBondContact OG-CA 3.28Å; S107-G117 PolarHBondContact OG-N 3.25Å
108A95Very high95.2Very high68 Ų6848.4 Ų48.456%0.56230%0.296SS*.Hα-helixtrans-64.3-39.417600000112M104 A105 L106 L110 G111M104-A108 WeakPolarHBondContact O-CB 3.25Å; M104-A108 PolarHBondContact O-N 3.37Å; A105-A108 PolarHBondContact O-N 2.87Å; L106-A108 VanDerWaalsContact C-N 3.32Å; L106-A108 PolarHBondContact O-N 3.2Å; A108-L110 VanDerWaalsContact C-N 3.29Å; A108-L110 PolarHBondContact O-N 3.42Å; A108-G111 PolarHBondContact O-N 3.38Å; A108-G111 VanDerWaalsContact O-N 3.13Å
109V94.6Very high95.2Very high123 Ų12345.7 Ų45.775%0.74528%0.28SS*.Hα-helixtrans-65.2-34174.31740000111.7A105 L106 G111A105-V109 WeakPolarHBondContact O-CG2 3.22Å; A105-V109 PolarHBondContact O-N 2.93Å; A105-V109 VanDerWaalsContact O-N 3.15Å; L106-V109 WeakPolarHBondContact O-CB 3.2Å; L106-V109 PolarHBondContact O-N 2.88Å; L106-V109 VanDerWaalsContact O-N 3.15Å; V109-G111 PolarHBondContact O-N 2.82Å
110L93.4Very high95.2Very high54 Ų5445.7 Ų45.728%0.28328%0.28SS..THydrogen-bonded Turntrans-78.9-1.2175.3-63.9174000113.6L106 S107 A108 W112 A304 L368L106-L110 HydrophobicContact CD1-CD1 4.38Å; L106-L110 HydrophobicContact CD1-CG 4.39Å; L106-L110 HydrophobicContact CG-CD1 4.17Å; L106-L110 WeakPolarHBondContact O-CG 3.33Å; L106-L110 PolarHBondContact O-N 2.92Å; S107-L110 CarbonylContact O-C 3.55Å; S107-L110 PolarHBondContact O-N 3.21Å; A108-L110 VanDerWaalsContact C-N 3.29Å; A108-L110 PolarHBondContact O-N 3.42Å; L110-W112 HydrophobicContact CB-CD2 4.11Å; L110-W112 HydrophobicContact CB-CG 4.39Å; L110-W112 HydrophobicContact CB-CZ2 4.33Å; L110-W112 HydrophobicContact CD1-CE3 4.32Å; L110-W112 HydrophobicContact CD1-CH2 3.63Å; L110-W112 HydrophobicContact CD1-CZ2 3.86Å; L110-W112 HydrophobicContact CD1-CZ3 3.87Å; L110-A304 HydrophobicContact CD1-CB 4.5Å; L110-A304 HydrophobicContact CD2-CB 4.08Å; L110-L368 HydrophobicContact CD1-CD1 3.81Å
111G92.4Very high95.2Very high68 Ų6845 Ų4570%0.70128%0.275SS*.THydrogen-bonded Turntrans76.321.6177.800000114.4S107 A108 V109S107-G111 PolarHBondContact O-N 2.81Å; S107-G111 VanDerWaalsContact O-N 3.16Å; A108-G111 PolarHBondContact O-N 3.38Å; A108-G111 VanDerWaalsContact O-N 3.13Å; V109-G111 PolarHBondContact O-N 2.82Å
112W94.2Very high95.2Very high53 Ų5341 Ų4120%0.20125%0.254CS..  trans-88.6161.3179.3-64.2-12.4000112.5S107 L110 T116 F120 P362 A364 L368S107-W112 PolarHBondContact O-N 3.33Å; S107-W112 VanDerWaalsContact OG-CB 3.24Å; S107-W112 WeakPolarHBondContact OG-CB 3.42Å; L110-W112 HydrophobicContact CB-CD2 4.11Å; L110-W112 HydrophobicContact CB-CG 4.39Å; L110-W112 HydrophobicContact CB-CZ2 4.33Å; L110-W112 HydrophobicContact CD1-CE3 4.32Å; L110-W112 HydrophobicContact CD1-CH2 3.63Å; L110-W112 HydrophobicContact CD1-CZ2 3.86Å; L110-W112 HydrophobicContact CD1-CZ3 3.87Å; W112-T116 HydrophobicContact CB-CG2 3.76Å; W112-T116 HydrophobicContact CD2-CG2 3.96Å; W112-T116 HydrophobicContact CE3-CG2 3.75Å; W112-T116 HydrophobicContact CG-CG2 3.99Å; W112-F120 HydrophobicContact CZ3-CD1 4.39Å; W112-F120 HydrophobicContact CZ3-CD2 4.16Å; W112-F120 HydrophobicContact CZ3-CE2 4.37Å; W112-F120 HydrophobicContact CZ3-CG 4.17Å; W112-P362 HydrophobicContact CD2-CG 4.02Å; W112-P362 HydrophobicContact CG-CG 4.44Å; W112-P362 HydrophobicContact CH2-CG 4.46Å; W112-P362 HydrophobicContact CZ2-CG 3.97Å; W112-A364 HydrophobicContact CZ2-CB 3.91Å; W112-L368 HydrophobicContact CH2-CD1 3.79Å
113S92.8Very high95.2Very high61 Ų6138 Ų3843%0.42724%0.239SC..  trans-64.3159.9179.282.60000112.2M115 T116 G117S113-M115 VanDerWaalsContact C-N 3.26Å; S113-M115 PolarHBondContact O-N 3.44Å; S113-T116 WeakPolarHBondContact O-CB 3.24Å; S113-T116 PolarHBondContact O-N 3.42Å; S113-T116 WeakPolarHBondContact OG-CB 3.34Å; S113-T116 PolarHBondContact OG-N 3.31Å; S113-T116 PolarHBondContact OG-OG1 2.92Å; S113-G117 PolarHBondContact O-N 3.38Å
114L92.9Very high95.1Very high120 Ų12038 Ų3863%0.62824%0.239SC*.Hα-helixtrans-56.4-42.6175.5-174.571.2000111.7M104 G117 I118M104-L114 HydrophobicContact CE-CD1 3.38Å; M104-L114 HydrophobicContact CE-CG 4.24Å; L114-G117 WeakPolarHBondContact O-CA 3.17Å; L114-G117 PolarHBondContact O-N 3.11Å; L114-G117 VanDerWaalsContact O-N 3.14Å; L114-I118 HydrophobicContact CG-CD1 4.33Å; L114-I118 WeakPolarHBondContact O-CG1 3.47Å; L114-I118 PolarHBondContact O-N 3.22Å
115M92.4Very high95Very high42 Ų4235.9 Ų35.921%0.20723%0.228CC..Hα-helixtrans-69.6-39.3-178.3-68.8-61.1-59.100111.8S113 G117 I118 V119 V171 M175S113-M115 VanDerWaalsContact C-N 3.26Å; S113-M115 PolarHBondContact O-N 3.44Å; M115-G117 VanDerWaalsContact C-N 3.25Å; M115-G117 PolarHBondContact O-N 2.88Å; M115-I118 PolarHBondContact O-N 3.11Å; M115-I118 HydrophobicContact SD-CD1 3.82Å; M115-V119 WeakPolarHBondContact O-CG2 3.25Å; M115-V119 PolarHBondContact O-N 3.23Å; M115-V171 HydrophobicContact CE-CG1 3.43Å; M115-V171 VanDerWaalsContact CE-CG1 3.43Å; M115-M175 HydrophobicContact CB-CE 3.79Å; M115-M175 HydrophobicContact CB-SD 3.89Å; M115-M175 HydrophobicContact CE-SD 3.83Å; M115-M175 HydrophobicContact CG-CE 3.53Å; M115-M175 HydrophobicContact CG-SD 3.52Å; M115-M175 VanDerWaalsContact CG-SD 3.52Å; M115-M175 HydrophobicContact SD-SD 4.33Å
116T95.1Very high94.8Very high14 Ų1433.3 Ų33.39%0.08621%0.207CC..Hα-helixtrans-57.6-41.7168.9-56.40000111.5W112 S113 V119 F120 L360 L361 P362W112-T116 HydrophobicContact CB-CG2 3.76Å; W112-T116 HydrophobicContact CD2-CG2 3.96Å; W112-T116 HydrophobicContact CE3-CG2 3.75Å; W112-T116 HydrophobicContact CG-CG2 3.99Å; S113-T116 WeakPolarHBondContact O-CB 3.24Å; S113-T116 PolarHBondContact O-N 3.42Å; S113-T116 WeakPolarHBondContact OG-CB 3.34Å; S113-T116 PolarHBondContact OG-N 3.31Å; S113-T116 PolarHBondContact OG-OG1 2.92Å; T116-V119 PolarHBondContact O-N 3.42Å; T116-F120 WeakPolarHBondContact O-CB 3.49Å; T116-F120 PolarHBondContact O-N 2.94Å; T116-L360 WeakPolarHBondContact CA-O 3.35Å; T116-L360 VanDerWaalsContact CB-O 3.27Å; T116-L360 WeakPolarHBondContact CB-O 3.4Å; T116-L360 WeakPolarHBondContact CG2-O 3.49Å; T116-L360 PolarHBondContact OG1-O 3.21Å; T116-L361 HydrophobicContact CG2-CD1 4.12Å; T116-P362 HydrophobicContact CG2-CG 4.19Å
117G96.3Very high94.7Very high1 Ų132.3 Ų32.31%0.0120%0.202CC..Hα-helixtrans-64.4-38.4176.100000113.8M104 S107 S113 L114 M115 G121M104-G117 WeakPolarHBondContact CG-O 3.45Å; S107-G117 WeakPolarHBondContact OG-CA 3.28Å; S107-G117 PolarHBondContact OG-N 3.25Å; S113-G117 PolarHBondContact O-N 3.38Å; L114-G117 WeakPolarHBondContact O-CA 3.17Å; L114-G117 PolarHBondContact O-N 3.11Å; L114-G117 VanDerWaalsContact O-N 3.14Å; M115-G117 VanDerWaalsContact C-N 3.25Å; M115-G117 PolarHBondContact O-N 2.88Å; G117-G121 PolarHBondContact O-N 3.01Å
118I96Very high94.3Very high50 Ų5032.3 Ų32.326%0.25620%0.202SC..Hα-helixtrans-65-50.9175.8-69.2165000110M104 L114 M115 F120 G121 L122M104-I118 HydrophobicContact CE-CD1 4.44Å; M104-I118 HydrophobicContact CE-CG1 3.88Å; M104-I118 HydrophobicContact CG-CG1 4.13Å; M104-I118 HydrophobicContact SD-CG1 3.72Å; L114-I118 HydrophobicContact CG-CD1 4.33Å; L114-I118 WeakPolarHBondContact O-CG1 3.47Å; L114-I118 PolarHBondContact O-N 3.22Å; M115-I118 PolarHBondContact O-N 3.11Å; M115-I118 HydrophobicContact SD-CD1 3.82Å; I118-F120 PolarHBondContact O-N 2.75Å; I118-G121 PolarHBondContact O-N 3.47Å; I118-L122 HydrophobicContact CG2-CD1 3.73Å; I118-L122 HydrophobicContact CG2-CG 4.44Å; I118-L122 WeakPolarHBondContact O-CB 3.47Å; I118-L122 VanDerWaalsContact O-CG 3.27Å; I118-L122 WeakPolarHBondContact O-CG 2.87Å; I118-L122 PolarHBondContact O-N 2.94Å
119V96Very high93.7Very high0 Ų030 Ų300%018%0.18CC..Hα-helixtrans-61.2-46.7179.1178.70000111M115 T116 G121 L122 C123 L168 L360 L361M115-V119 WeakPolarHBondContact O-CG2 3.25Å; M115-V119 PolarHBondContact O-N 3.23Å; T116-V119 PolarHBondContact O-N 3.42Å; V119-G121 PolarHBondContact O-N 3.3Å; V119-L122 PolarHBondContact O-N 3.48Å; V119-C123 PolarHBondContact O-N 3.13Å; V119-C123 PolarHBondContact O-SG 3.39Å; V119-L168 HydrophobicContact CG1-CD2 4.43Å; V119-L168 HydrophobicContact CG2-CD1 3.7Å; V119-L168 HydrophobicContact CG2-CD2 4.38Å; V119-L360 HydrophobicContact CG2-CB 4.01Å; V119-L360 HydrophobicContact CG2-CD1 4.11Å; V119-L361 HydrophobicContact CG1-CB 4.4Å
120F97Very high92.8Very high0 Ų025.9 Ų25.90%016%0.156CC..Hα-helixtrans-59.9-47.3177.3-178-112.3000111.6L106 W112 T116 I118 L122 C123 L124 T308 L361 L368 V369L106-F120 HydrophobicContact CD2-CE1 4.03Å; L106-F120 HydrophobicContact CD2-CZ 4.37Å; L106-F120 HydrophobicContact CG-CE1 4.37Å; W112-F120 HydrophobicContact CZ3-CD1 4.39Å; W112-F120 HydrophobicContact CZ3-CD2 4.16Å; W112-F120 HydrophobicContact CZ3-CE2 4.37Å; W112-F120 HydrophobicContact CZ3-CG 4.17Å; T116-F120 WeakPolarHBondContact O-CB 3.49Å; T116-F120 PolarHBondContact O-N 2.94Å; I118-F120 PolarHBondContact O-N 2.75Å; F120-L122 PolarHBondContact O-N 3.36Å; F120-C123 WeakPolarHBondContact O-CB 3.35Å; F120-C123 PolarHBondContact O-N 3.35Å; F120-L124 HydrophobicContact CD1-CD1 4.25Å; F120-L124 HydrophobicContact CE1-CD1 3.71Å; F120-L124 HydrophobicContact CE1-CG 4.4Å; F120-L124 HydrophobicContact CE2-CD2 4.42Å; F120-L124 HydrophobicContact CZ-CD1 3.95Å; F120-L124 HydrophobicContact CZ-CD2 4.35Å; F120-L124 HydrophobicContact CZ-CG 4.41Å; F120-L124 WeakPolarHBondContact O-CG 3.37Å; F120-L124 PolarHBondContact O-N 2.99Å; F120-L124 VanDerWaalsContact O-N 3.14Å; F120-T308 HydrophobicContact CZ-CG2 3.94Å; F120-L361 HydrophobicContact CB-CD1 3.8Å; F120-L361 HydrophobicContact CD2-CD1 4.19Å; F120-L361 HydrophobicContact CG-CD1 4.46Å; F120-L368 HydrophobicContact CE2-CB 3.88Å; F120-L368 HydrophobicContact CE2-CD1 4.43Å; F120-L368 HydrophobicContact CZ-CB 4.14Å; F120-L368 HydrophobicContact CZ-CD1 4.18Å; F120-V369 HydrophobicContact CD2-CG2 3.75Å; F120-V369 HydrophobicContact CE2-CG2 3.72Å
121G96.7Very high92Very high0 Ų023.8 Ų23.80%015%0.145CC..Hα-helixtrans-64-37.8178.400000113.9G117 I118 V119 L124 S125G117-G121 PolarHBondContact O-N 3.01Å; I118-G121 PolarHBondContact O-N 3.47Å; V119-G121 PolarHBondContact O-N 3.3Å; G121-L124 PolarHBondContact O-N 2.83Å; G121-L124 VanDerWaalsContact O-N 3.15Å; G121-S125 PolarHBondContact O-N 3.24Å
122L96.2Very high91.7Very high23 Ų2320.5 Ų20.512%0.1211%0.112CC..Hα-helixtrans-62.7-42.2172.3-73.1163.8000110.8I96 T100 I118 V119 F120 L124 S125 M161 T164 L351I96-L122 HydrophobicContact CG2-CD2 4.04Å; T100-L122 HydrophobicContact CG2-CG 4.23Å; I118-L122 HydrophobicContact CG2-CD1 3.73Å; I118-L122 HydrophobicContact CG2-CG 4.44Å; I118-L122 WeakPolarHBondContact O-CB 3.47Å; I118-L122 VanDerWaalsContact O-CG 3.27Å; I118-L122 WeakPolarHBondContact O-CG 2.87Å; I118-L122 PolarHBondContact O-N 2.94Å; V119-L122 PolarHBondContact O-N 3.48Å; F120-L122 PolarHBondContact O-N 3.36Å; L122-L124 PolarHBondContact O-N 3.46Å; L122-S125 WeakPolarHBondContact O-CB 3.32Å; L122-S125 PolarHBondContact O-N 3.33Å; L122-S125 PolarHBondContact O-OG 2.93Å; L122-M161 HydrophobicContact CD2-CE 4.26Å; L122-T164 HydrophobicContact CD1-CG2 3.82Å; L122-L351 HydrophobicContact CB-CD2 3.63Å
123C95.9Very high91.1Very high0 Ų019.9 Ų19.90%011%0.112CC..Hα-helixtrans-58.9-34.1173.5-63.70000112.7V119 F120 S125 A348 V369V119-C123 PolarHBondContact O-N 3.13Å; V119-C123 PolarHBondContact O-SG 3.39Å; F120-C123 WeakPolarHBondContact O-CB 3.35Å; F120-C123 PolarHBondContact O-N 3.35Å; C123-S125 VanDerWaalsContact C-N 3.31Å; C123-A348 HydrophobicContact CB-CB 4.39Å; C123-A348 WeakPolarHBondContact O-CB 3.19Å; C123-V369 HydrophobicContact CB-CG1 4.03Å; C123-V369 HydrophobicContact CB-CG2 3.7Å
124L95.8Very high90.1Very high0 Ų021.1 Ų21.10%011%0.107CC..Hα-helixtrans-79.7-13178.7-56.7-171.5000113.7F120 G121 L122 T308 I311 I312 I344 V369F120-L124 HydrophobicContact CD1-CD1 4.25Å; F120-L124 HydrophobicContact CE1-CD1 3.71Å; F120-L124 HydrophobicContact CE1-CG 4.4Å; F120-L124 HydrophobicContact CE2-CD2 4.42Å; F120-L124 HydrophobicContact CZ-CD1 3.95Å; F120-L124 HydrophobicContact CZ-CD2 4.35Å; F120-L124 HydrophobicContact CZ-CG 4.41Å; F120-L124 WeakPolarHBondContact O-CG 3.37Å; F120-L124 PolarHBondContact O-N 2.99Å; F120-L124 VanDerWaalsContact O-N 3.14Å; G121-L124 PolarHBondContact O-N 2.83Å; G121-L124 VanDerWaalsContact O-N 3.15Å; L122-L124 PolarHBondContact O-N 3.46Å; L124-T308 HydrophobicContact CD1-CG2 4.14Å; L124-T308 HydrophobicContact CD2-CG2 3.65Å; L124-I311 HydrophobicContact CD1-CB 4.32Å; L124-I311 HydrophobicContact CD1-CD1 4.4Å; L124-I311 HydrophobicContact CD1-CG2 3.87Å; L124-I312 HydrophobicContact CD2-CD1 4.01Å; L124-I312 HydrophobicContact CD2-CG1 4.09Å; L124-I344 HydrophobicContact CD2-CD1 4.28Å; L124-I344 WeakPolarHBondContact O-CG2 3.33Å; L124-V369 HydrophobicContact CD2-CG2 4.33Å
125S94.9Very high89.3Confident0 Ų015.9 Ų15.90%08%0.082CC..Hα-helixtrans-77.3-33.9-174.370.40000113.7Q95 G121 L122 C123 M161Q95-S125 PolarHBondContact NE2-O 2.82Å; G121-S125 PolarHBondContact O-N 3.24Å; L122-S125 WeakPolarHBondContact O-CB 3.32Å; L122-S125 PolarHBondContact O-N 3.33Å; L122-S125 PolarHBondContact O-OG 2.93Å; C123-S125 VanDerWaalsContact C-N 3.31Å; S125-M161 WeakPolarHBondContact OG-CE 3.48Å
126T92.6Very high88.8Confident0 Ų014 Ų140%07%0.072CC..PPolyproline II helixtrans-85.6130.4-164.166.80000112M161 I344 F347T126-M161 HydrophobicContact CG2-CB 4.46Å; T126-M161 HydrophobicContact CG2-CE 3.64Å; T126-M161 HydrophobicContact CG2-CG 3.1Å; T126-M161 HydrophobicContact CG2-SD 3.12Å; T126-M161 WeakPolarHBondContact CG2-SD 3.25Å; T126-I344 WeakPolarHBondContact O-CA 3.46Å; T126-I344 VanDerWaalsContact O-CB 3.23Å; T126-I344 WeakPolarHBondContact O-CB 3.18Å; T126-I344 WeakPolarHBondContact O-CG2 3.41Å; T126-F347 HydrophobicContact CG2-CB 4.29Å
127A92.4Very high87.8Confident1 Ų118.3 Ų18.31%0.0089%0.092CC..PPolyproline II helixtrans-86.9155.3170.500000112.9L154 E157 L341 Q343A127-L154 HydrophobicContact CB-CD2 3.55Å; A127-E157 PolarHBondContact N-OE2 3.47Å; A127-L341 HydrophobicContact CB-CD2 3.8Å; A127-Q343 VanDerWaalsContact CA-O 3.25Å; A127-Q343 WeakPolarHBondContact CA-O 3.34Å
128S87.4Confident86.7Confident1 Ų126 Ų261%0.00713%0.127CC..PPolyproline II helixtrans-76.7122.7169.9-1760000110.7L132 Q343 G345 E346S128-L132 PolarHBondContact O-N 3.36Å; S128-Q343 VanDerWaalsContact N-CD 3.34Å; S128-Q343 PolarHBondContact O-NE2 3.25Å; S128-G345 VanDerWaalsContact CB-CA 3.45Å; S128-E346 WeakPolarHBondContact CB-OE2 3.32Å; S128-E346 PolarHBondContact OG-OE2 3.44Å
129T82.8Confident85.7Confident18 Ų1826.8 Ų26.811%0.1113%0.127CC..Hα-helixtrans-65.5-40.6175.7-64.50000111.2V131 L132 L133 L154 D158T129-V131 PolarHBondContact O-N 3.41Å; T129-L132 PolarHBondContact O-N 2.65Å; T129-L133 HydrophobicContact CG2-CD1 3.69Å; T129-L133 HydrophobicContact CG2-CG 4.14Å; T129-L133 WeakPolarHBondContact O-CB 3.29Å; T129-L133 VanDerWaalsContact O-CG 3.31Å; T129-L133 WeakPolarHBondContact O-CG 3.38Å; T129-L133 PolarHBondContact O-N 2.83Å; T129-L154 HydrophobicContact CG2-CD1 4.23Å; T129-D158 PolarHBondContact OG1-OD2 3.07Å; T129-D158 VanDerWaalsContact OG1-OD2 3.04Å
130V75Confident84.7Confident37 Ų3735.3 Ų35.322%0.22417%0.167CC..Hα-helixtrans-63.1-43.3179.7-179.80000112.3L33 R134L33-V130 HydrophobicContact CD1-CB 4.34Å; L33-V130 HydrophobicContact CD1-CG1 4.14Å; V130-R134 WeakPolarHBondContact O-CB 3.44Å; V130-R134 WeakPolarHBondContact O-CG 3.36Å; V130-R134 PolarHBondContact O-N 3.39Å
131V78.2Confident83.8Confident10 Ų1037 Ų376%0.06118%0.176CC..Hα-helixtrans-69.4-40.9-178.4179.10000110.9L33 T129 A135 Q343 I377 N380L33-V131 HydrophobicContact CD1-CG2 3.59Å; T129-V131 PolarHBondContact O-N 3.41Å; V131-A135 WeakPolarHBondContact O-CB 3.26Å; V131-A135 PolarHBondContact O-N 3.17Å; V131-A135 VanDerWaalsContact O-N 3.07Å; V131-Q343 HydrophobicContact CB-CG 4.45Å; V131-Q343 HydrophobicContact CG1-CG 4.1Å; V131-I377 HydrophobicContact CG2-CG1 4.33Å; V131-I377 HydrophobicContact CG2-CG2 4.1Å; V131-N380 WeakPolarHBondContact CG1-ND2 3.18Å
132L85.6Confident82.6Confident0 Ų039.5 Ų39.50%019%0.188CC..Hα-helixtrans-68.5-48.6179.2-178.2151.7000111.6S128 T129 R134 A135 L136 A150 L154 L341S128-L132 PolarHBondContact O-N 3.36Å; T129-L132 PolarHBondContact O-N 2.65Å; L132-R134 VanDerWaalsContact C-N 3.33Å; L132-R134 PolarHBondContact O-N 3.04Å; L132-A135 WeakPolarHBondContact O-CB 3.28Å; L132-A135 PolarHBondContact O-N 3.15Å; L132-A135 VanDerWaalsContact O-N 3.1Å; L132-L136 HydrophobicContact CD2-CD1 3.4Å; L132-L136 VanDerWaalsContact CD2-CD1 3.4Å; L132-L136 HydrophobicContact CD2-CG 3.88Å; L132-L136 HydrophobicContact CG-CD1 4.46Å; L132-L136 WeakPolarHBondContact O-CG 3.1Å; L132-L136 PolarHBondContact O-N 2.9Å; L132-A150 HydrophobicContact CD1-CB 4.24Å; L132-A150 HydrophobicContact CD2-CB 4.35Å; L132-L154 HydrophobicContact CB-CD1 3.87Å; L132-L154 HydrophobicContact CD1-CD1 3.62Å; L132-L154 HydrophobicContact CD1-CD2 4.13Å; L132-L154 HydrophobicContact CD1-CG 3.86Å; L132-L154 HydrophobicContact CD2-CD1 3.56Å; L132-L154 HydrophobicContact CG-CD1 3.85Å; L132-L341 HydrophobicContact CD1-CD2 4Å
133L80.1Confident81.3Confident39 Ų3944.5 Ų44.520%0.20422%0.215CC..Hα-helixtrans-58.4-46.1-179.8-73.8177.2000111.1T129 A135 L136 E137 I151T129-L133 HydrophobicContact CG2-CD1 3.69Å; T129-L133 HydrophobicContact CG2-CG 4.14Å; T129-L133 WeakPolarHBondContact O-CB 3.29Å; T129-L133 VanDerWaalsContact O-CG 3.31Å; T129-L133 WeakPolarHBondContact O-CG 3.38Å; T129-L133 PolarHBondContact O-N 2.83Å; L133-A135 VanDerWaalsContact C-N 3.34Å; L133-A135 PolarHBondContact O-N 3.48Å; L133-L136 PolarHBondContact O-N 2.98Å; L133-E137 WeakPolarHBondContact O-CB 3.12Å; L133-E137 VanDerWaalsContact O-CG 3.3Å; L133-E137 WeakPolarHBondContact O-CG 3.12Å; L133-E137 PolarHBondContact O-N 3.11Å; L133-I151 HydrophobicContact CD2-CD1 3.86Å; L133-I151 HydrophobicContact CD2-CG1 3.79Å
134R72.8Confident80.3Confident87 Ų8745.7 Ų45.733%0.32822%0.224SC..Hα-helixtrans-60.1-42.6174.5-73.8-178176.2-179.50.6112.5V130 L132 L136 E137 E138V130-R134 WeakPolarHBondContact O-CB 3.44Å; V130-R134 WeakPolarHBondContact O-CG 3.36Å; V130-R134 PolarHBondContact O-N 3.39Å; L132-R134 VanDerWaalsContact C-N 3.33Å; L132-R134 PolarHBondContact O-N 3.04Å; R134-L136 VanDerWaalsContact C-N 3.32Å; R134-L136 PolarHBondContact O-N 3.33Å; R134-E137 PolarHBondContact O-N 2.8Å; R134-E138 WeakPolarHBondContact O-CB 3.31Å; R134-E138 VanDerWaalsContact O-CG 3.27Å; R134-E138 WeakPolarHBondContact O-CG 3.35Å; R134-E138 PolarHBondContact O-N 3.06Å
135A76.9Confident79.4Confident11 Ų1149.8 Ų49.89%0.09124%0.243CC..Hα-helixtrans-63.9-36.9177.600000112.3V131 L132 L133 R139 F384V131-A135 WeakPolarHBondContact O-CB 3.26Å; V131-A135 PolarHBondContact O-N 3.17Å; V131-A135 VanDerWaalsContact O-N 3.07Å; L132-A135 WeakPolarHBondContact O-CB 3.28Å; L132-A135 PolarHBondContact O-N 3.15Å; L132-A135 VanDerWaalsContact O-N 3.1Å; L133-A135 VanDerWaalsContact C-N 3.34Å; L133-A135 PolarHBondContact O-N 3.48Å; A135-R139 WeakPolarHBondContact O-CD 3.15Å; A135-R139 VanDerWaalsContact O-CG 3.24Å; A135-R139 WeakPolarHBondContact O-CG 3.46Å; A135-F384 HydrophobicContact CB-CD2 4.47Å; A135-F384 HydrophobicContact CB-CE2 3.93Å; A135-F384 HydrophobicContact CB-CZ 4.17Å
136L80.1Confident78.9Confident1 Ų150.2 Ų50.21%0.00524%0.244CC..Hα-helixtrans-72.3-40.7174.3-66.2-177.6000112.2L132 L133 R134 R139 Q140 L141 I142 A150 I151L132-L136 HydrophobicContact CD2-CD1 3.4Å; L132-L136 VanDerWaalsContact CD2-CD1 3.4Å; L132-L136 HydrophobicContact CD2-CG 3.88Å; L132-L136 HydrophobicContact CG-CD1 4.46Å; L132-L136 WeakPolarHBondContact O-CG 3.1Å; L132-L136 PolarHBondContact O-N 2.9Å; L133-L136 PolarHBondContact O-N 2.98Å; R134-L136 VanDerWaalsContact C-N 3.32Å; R134-L136 PolarHBondContact O-N 3.33Å; L136-R139 CarbonylContact O-C 3.52Å; L136-R139 PolarHBondContact O-N 2.87Å; L136-Q140 PolarHBondContact O-N 3.21Å; L136-L141 HydrophobicContact CB-CB 4.41Å; L136-L141 HydrophobicContact CD2-CB 3.87Å; L136-L141 HydrophobicContact CD2-CD1 4.34Å; L136-L141 PolarHBondContact O-N 2.89Å; L136-I142 HydrophobicContact CB-CG1 4.06Å; L136-A150 HydrophobicContact CD1-CB 4.3Å; L136-I151 HydrophobicContact CD1-CD1 4.31Å; L136-I151 HydrophobicContact CD1-CG1 4.13Å
137E75.2Confident78.4Confident106 Ų10650.2 Ų50.250%0.49524%0.244SC..Hα-helixtrans-57.9-51.7175.8-81.1169.4-175.600111.7L133 R134 R139 Q140 I142L133-E137 WeakPolarHBondContact O-CB 3.12Å; L133-E137 VanDerWaalsContact O-CG 3.3Å; L133-E137 WeakPolarHBondContact O-CG 3.12Å; L133-E137 PolarHBondContact O-N 3.11Å; R134-E137 PolarHBondContact O-N 2.8Å; E137-R139 PolarHBondContact O-N 3.26Å; E137-Q140 PolarHBondContact O-N 2.72Å; E137-I142 HydrophobicContact CB-CD1 4.08Å; E137-I142 HydrophobicContact CG-CD1 3.1Å; E137-I142 HydrophobicContact CG-CG1 3.88Å
138E73.6Confident77.9Confident163 Ų16354.1 Ų54.176%0.76226%0.262SS*.THydrogen-bonded Turntrans-58.1-22.5178.6-74.9174.4-175.500112.7R134R134-E138 WeakPolarHBondContact O-CB 3.31Å; R134-E138 VanDerWaalsContact O-CG 3.27Å; R134-E138 WeakPolarHBondContact O-CG 3.35Å; R134-E138 PolarHBondContact O-N 3.06Å
139R74.8Confident77.8Confident65 Ų6554.1 Ų54.125%0.24526%0.262CS..THydrogen-bonded Turntrans-106.82.1-179-62.8169.8176.6-99.7-29.7113.3A135 L136 E137 L141 F384 E388A135-R139 WeakPolarHBondContact O-CD 3.15Å; A135-R139 VanDerWaalsContact O-CG 3.24Å; A135-R139 WeakPolarHBondContact O-CG 3.46Å; L136-R139 CarbonylContact O-C 3.52Å; L136-R139 PolarHBondContact O-N 2.87Å; E137-R139 PolarHBondContact O-N 3.26Å; R139-L141 HydrophobicContact CB-CB 4.48Å; R139-L141 HydrophobicContact CB-CD1 3.87Å; R139-L141 HydrophobicContact CB-CG 3.82Å; R139-L141 PolarHBondContact O-N 3.06Å; R139-F384 VanDerWaalsContact CZ-CD1 3.47Å; R139-E388 VanDerWaalsContact CZ-CD 3.43Å; R139-E388 IonicContact CZ-OE1 3.49Å; R139-E388 IonicContact CZ-OE2 3.81Å; R139-E388 IonicContact NE-OE1 2.7Å; R139-E388 VanDerWaalsContact NH1-CG 3.3Å; R139-E388 IonicContact NH1-OE1 3.26Å; R139-E388 PolarHBondContact NH1-OE1 2.85Å; R139-E388 IonicContact NH1-OE2 3.01Å; R139-E388 IonicContact NH2-OE1 2.88Å; R139-E388 PolarHBondContact NH2-OE1 3.5Å; R139-E388 IonicContact NH2-OE2 3.92Å; R139-E388 PolarHBondContact NH2-OE2 2.91Å
140Q75.3Confident78.1Confident180 Ų18053.3 Ų53.384%0.84126%0.258SS*.THydrogen-bonded Turntrans55.530.5-175.4-56.4178.2-1600113.6L136 E137L136-Q140 PolarHBondContact O-N 3.21Å; E137-Q140 PolarHBondContact O-N 2.72Å
141L77.4Confident78.6Confident36 Ų3653.1 Ų53.119%0.18826%0.255CS..  trans-95.9-4.6-176.6-67.9178.4000113.9L136 R139 D143 S144 G147 T336L136-L141 HydrophobicContact CB-CB 4.41Å; L136-L141 HydrophobicContact CD2-CB 3.87Å; L136-L141 HydrophobicContact CD2-CD1 4.34Å; L136-L141 PolarHBondContact O-N 2.89Å; R139-L141 HydrophobicContact CB-CB 4.48Å; R139-L141 HydrophobicContact CB-CD1 3.87Å; R139-L141 HydrophobicContact CB-CG 3.82Å; R139-L141 PolarHBondContact O-N 3.06Å; L141-D143 VanDerWaalsContact C-N 3.33Å; L141-D143 PolarHBondContact O-N 3.08Å; L141-S144 VanDerWaalsContact O-CB 3.32Å; L141-S144 WeakPolarHBondContact O-CB 3.49Å; L141-S144 PolarHBondContact O-N 3.18Å; L141-S144 VanDerWaalsContact O-N 3.09Å; L141-S144 PolarHBondContact O-OG 3.37Å; L141-G147 VanDerWaalsContact O-CA 3.24Å; L141-G147 WeakPolarHBondContact O-CA 3.28Å; L141-G147 PolarHBondContact O-N 3.21Å; L141-T336 HydrophobicContact CD1-CG2 4.29Å
142I72.3Confident79Confident52 Ų5252.8 Ų52.827%0.26725%0.253SS..THydrogen-bonded Turntrans-53.5-50-175.8-62.5165.1000111.7L136 E137 S144 I151L136-I142 HydrophobicContact CB-CG1 4.06Å; E137-I142 HydrophobicContact CB-CD1 4.08Å; E137-I142 HydrophobicContact CG-CD1 3.1Å; E137-I142 HydrophobicContact CG-CG1 3.88Å; I142-S144 VanDerWaalsContact C-N 3.26Å; I142-S144 PolarHBondContact O-N 2.73Å; I142-I151 HydrophobicContact CG2-CD1 3.96Å
143D68.8Low79.2Confident128 Ų12852.8 Ų52.868%0.68425%0.253SS*.THydrogen-bonded Turntrans-82.3-6.9-175.4-61.3-44.5000112.8L141L141-D143 VanDerWaalsContact C-N 3.33Å; L141-D143 PolarHBondContact O-N 3.08Å
144S74Confident79.6Confident25 Ų2551.1 Ų51.118%0.17524%0.244CC..SBendtrans-70.7158.6175.977.60000111.2L141 I142 R146 G147 Q148L141-S144 VanDerWaalsContact O-CB 3.32Å; L141-S144 WeakPolarHBondContact O-CB 3.49Å; L141-S144 PolarHBondContact O-N 3.18Å; L141-S144 VanDerWaalsContact O-N 3.09Å; L141-S144 PolarHBondContact O-OG 3.37Å; I142-S144 VanDerWaalsContact C-N 3.26Å; I142-S144 PolarHBondContact O-N 2.73Å; S144-R146 PolarHBondContact O-N 2.99Å; S144-R146 PolarHBondContact OG-N 3.37Å; S144-G147 PolarHBondContact O-N 3.41Å; S144-G147 PolarHBondContact OG-N 2.92Å; S144-Q148 WeakPolarHBondContact O-CG 3.15Å; S144-Q148 PolarHBondContact O-N 3.17Å
145Q78.1Confident80.1Confident85 Ų8547.7 Ų47.740%0.39723%0.232SC..Hα-helixtrans-56.2-36.2173.7-173177.61.800111.8Q148 I149Q145-Q148 PolarHBondContact O-N 2.86Å; Q145-I149 HydrophobicContact CG-CD1 4.13Å; Q145-I149 VanDerWaalsContact O-CG1 3.26Å; Q145-I149 WeakPolarHBondContact O-CG1 3.27Å; Q145-I149 PolarHBondContact O-N 2.89Å
146R83Confident80.7Confident10 Ų1047.6 Ų47.64%0.03823%0.231CC..Hα-helixtrans-65.3-42.9177.3-55.4174-171.6174-6.1111.3S144 I149 A150 R332 T333 E403 E407S144-R146 PolarHBondContact O-N 2.99Å; S144-R146 PolarHBondContact OG-N 3.37Å; R146-I149 PolarHBondContact O-N 3.3Å; R146-A150 WeakPolarHBondContact O-CB 3.32Å; R146-A150 PolarHBondContact O-N 3.02Å; R146-R332 VanDerWaalsContact NH1-CG 3.33Å; R146-T333 HydrophobicContact CG-CG2 4.11Å; R146-E403 IonicContact CZ-OE2 2.98Å; R146-E403 IonicContact NH2-OE2 2.98Å; R146-E403 PolarHBondContact NH2-OE2 3.42Å; R146-E407 IonicContact CZ-OE1 3.76Å; R146-E407 IonicContact CZ-OE2 2.68Å; R146-E407 VanDerWaalsContact CZ-OE2 3.31Å; R146-E407 IonicContact NE-OE1 3.73Å; R146-E407 PolarHBondContact NE-OE1 2.72Å; R146-E407 IonicContact NE-OE2 2.73Å; R146-E407 PolarHBondContact NE-OE2 3.21Å; R146-E407 IonicContact NH1-OE2 3.03Å; R146-E407 VanDerWaalsContact NH2-CD 3.35Å; R146-E407 IonicContact NH2-OE1 2.93Å; R146-E407 PolarHBondContact NH2-OE1 3.13Å; R146-E407 IonicContact NH2-OE2 2.95Å; R146-E407 PolarHBondContact NH2-OE2 3.36Å
147G81.8Confident81.3Confident0 Ų047.5 Ų47.50%023%0.23CC..Hα-helixtrans-63.6-47.2175.700000111.9L141 S144 I149 A150 I151L141-G147 VanDerWaalsContact O-CA 3.24Å; L141-G147 WeakPolarHBondContact O-CA 3.28Å; L141-G147 PolarHBondContact O-N 3.21Å; S144-G147 PolarHBondContact O-N 3.41Å; S144-G147 PolarHBondContact OG-N 2.92Å; G147-I149 PolarHBondContact O-N 2.92Å; G147-A150 PolarHBondContact O-N 3.09Å; G147-I151 WeakPolarHBondContact O-CB 3.28Å; G147-I151 WeakPolarHBondContact O-CG1 3.31Å; G147-I151 PolarHBondContact O-N 2.99Å
148Q82.2Confident81.8Confident82 Ų8242.6 Ų42.638%0.38321%0.207SC..Hα-helixtrans-59.7-42.8176.5-68.2179.87.700112.4V84 S144 Q145 G152V84-Q148 HydrophobicContact CG1-CB 4.01Å; S144-Q148 WeakPolarHBondContact O-CG 3.15Å; S144-Q148 PolarHBondContact O-N 3.17Å; Q145-Q148 PolarHBondContact O-N 2.86Å; Q148-G152 PolarHBondContact O-N 3.36Å
149I86.9Confident82.3Confident1 Ų137.6 Ų37.61%0.00519%0.186CC..Hα-helixtrans-64.2-47176.2-65.6165.4000110.3V84 I87 Q145 R146 G147 G152 W153 T333 I337V84-I149 HydrophobicContact CB-CG1 4.26Å; V84-I149 HydrophobicContact CG1-CG1 3.85Å; I87-I149 HydrophobicContact CG2-CG2 4.05Å; Q145-I149 HydrophobicContact CG-CD1 4.13Å; Q145-I149 VanDerWaalsContact O-CG1 3.26Å; Q145-I149 WeakPolarHBondContact O-CG1 3.27Å; Q145-I149 PolarHBondContact O-N 2.89Å; R146-I149 PolarHBondContact O-N 3.3Å; G147-I149 PolarHBondContact O-N 2.92Å; I149-G152 PolarHBondContact O-N 2.91Å; I149-W153 VanDerWaalsContact O-CB 3.25Å; I149-W153 WeakPolarHBondContact O-CB 3.31Å; I149-W153 PolarHBondContact O-N 3.11Å; I149-T333 HydrophobicContact CD1-CG2 4.31Å; I149-I337 HydrophobicContact CB-CD1 3.98Å; I149-I337 HydrophobicContact CG2-CD1 3.44Å; I149-I337 VanDerWaalsContact CG2-CD1 3.44Å; I149-I337 HydrophobicContact CG2-CG1 4.45Å
150A88.9Confident83.1Confident2 Ų236.3 Ų36.32%0.01719%0.185CC..Hα-helixtrans-62.5-42.8-179.900000112.5L132 L136 R146 G147 W153 L154 I337L132-A150 HydrophobicContact CD1-CB 4.24Å; L132-A150 HydrophobicContact CD2-CB 4.35Å; L136-A150 HydrophobicContact CD1-CB 4.3Å; R146-A150 WeakPolarHBondContact O-CB 3.32Å; R146-A150 PolarHBondContact O-N 3.02Å; G147-A150 PolarHBondContact O-N 3.09Å; A150-W153 WeakPolarHBondContact O-CB 3.29Å; A150-W153 PolarHBondContact O-N 3.46Å; A150-L154 WeakPolarHBondContact O-CG 3.25Å; A150-L154 PolarHBondContact O-N 3.48Å; A150-I337 HydrophobicContact CB-CG1 4.48Å
151I84.2Confident83.7Confident33 Ų3327.9 Ų27.917%0.16915%0.146CC..Hα-helixtrans-66.6-47.5176.4-67.4167.5000110.5L133 L136 I142 G147 W153 L154 I155L133-I151 HydrophobicContact CD2-CD1 3.86Å; L133-I151 HydrophobicContact CD2-CG1 3.79Å; L136-I151 HydrophobicContact CD1-CD1 4.31Å; L136-I151 HydrophobicContact CD1-CG1 4.13Å; I142-I151 HydrophobicContact CG2-CD1 3.96Å; G147-I151 WeakPolarHBondContact O-CB 3.28Å; G147-I151 WeakPolarHBondContact O-CG1 3.31Å; G147-I151 PolarHBondContact O-N 2.99Å; I151-W153 PolarHBondContact O-N 2.9Å; I151-L154 PolarHBondContact O-N 3.24Å; I151-I155 HydrophobicContact CG2-CD1 3.92Å; I151-I155 HydrophobicContact CG2-CG1 4.47Å; I151-I155 WeakPolarHBondContact O-CB 3.39Å; I151-I155 VanDerWaalsContact O-CG1 3.28Å; I151-I155 WeakPolarHBondContact O-CG1 3.43Å; I151-I155 PolarHBondContact O-N 3.45Å
152G86.2Confident83.8Confident2 Ų226.1 Ų26.12%0.02114%0.137CC..Hα-helixtrans-59.6-34.817600000112.5L81 Q148 I149 V156L81-G152 WeakPolarHBondContact CD1-O 3.31Å; Q148-G152 PolarHBondContact O-N 3.36Å; I149-G152 PolarHBondContact O-N 2.91Å; G152-V156 WeakPolarHBondContact O-CG2 3.4Å; G152-V156 PolarHBondContact O-N 3.44Å
153W91.3Very high84.3Confident0 Ų027 Ų270%014%0.141CC..Hα-helixtrans-65.9-50.1175.5-166.3-63000111.8I87 G91 A92 Q95 I149 A150 I151 I155 V156 E157 A320 L323 V324 L341I87-W153 HydrophobicContact CG2-CZ3 4.47Å; G91-W153 WeakPolarHBondContact O-CZ2 3.32Å; A92-W153 HydrophobicContact CB-CD2 4.27Å; A92-W153 HydrophobicContact CB-CG 4.08Å; Q95-W153 HydrophobicContact CB-CZ2 3.69Å; Q95-W153 HydrophobicContact CG-CZ2 4.31Å; I149-W153 VanDerWaalsContact O-CB 3.25Å; I149-W153 WeakPolarHBondContact O-CB 3.31Å; I149-W153 PolarHBondContact O-N 3.11Å; A150-W153 WeakPolarHBondContact O-CB 3.29Å; A150-W153 PolarHBondContact O-N 3.46Å; I151-W153 PolarHBondContact O-N 2.9Å; W153-I155 VanDerWaalsContact C-N 3.26Å; W153-I155 PolarHBondContact O-N 3.23Å; W153-V156 PolarHBondContact O-N 3.25Å; W153-V156 VanDerWaalsContact O-N 3.09Å; W153-E157 PolarHBondContact NE1-OE1 3.48Å; W153-E157 PolarHBondContact O-N 2.95Å; W153-A320 HydrophobicContact CH2-CB 4.33Å; W153-A320 HydrophobicContact CZ2-CB 4.14Å; W153-L323 HydrophobicContact CH2-CB 4.13Å; W153-L323 HydrophobicContact CH2-CD1 4.13Å; W153-L323 HydrophobicContact CZ2-CD1 4.42Å; W153-V324 HydrophobicContact CH2-CG2 4.44Å; W153-V324 HydrophobicContact CZ3-CG2 3.91Å; W153-L341 HydrophobicContact CD2-CD1 4.04Å; W153-L341 HydrophobicContact CG-CD1 4.04Å; W153-L341 HydrophobicContact CZ2-CD1 4.28Å
154L88.3Confident85.3Confident4 Ų421.9 Ų21.92%0.02112%0.115CC..Hα-helixtrans-56.5-42.3174.7-75.2177000112.2A127 T129 L132 A150 I151 V156 E157 D158 L341A127-L154 HydrophobicContact CB-CD2 3.55Å; T129-L154 HydrophobicContact CG2-CD1 4.23Å; L132-L154 HydrophobicContact CB-CD1 3.87Å; L132-L154 HydrophobicContact CD1-CD1 3.62Å; L132-L154 HydrophobicContact CD1-CD2 4.13Å; L132-L154 HydrophobicContact CD1-CG 3.86Å; L132-L154 HydrophobicContact CD2-CD1 3.56Å; L132-L154 HydrophobicContact CG-CD1 3.85Å; A150-L154 WeakPolarHBondContact O-CG 3.25Å; A150-L154 PolarHBondContact O-N 3.48Å; I151-L154 PolarHBondContact O-N 3.24Å; L154-V156 PolarHBondContact O-N 3.15Å; L154-E157 WeakPolarHBondContact O-CB 3.4Å; L154-E157 PolarHBondContact O-N 2.93Å; L154-E157 VanDerWaalsContact O-N 3.09Å; L154-D158 WeakPolarHBondContact O-CB 3.42Å; L154-D158 PolarHBondContact O-N 3.23Å; L154-L341 HydrophobicContact CD2-CD2 3.97Å; L154-L341 HydrophobicContact CG-CD2 4.45Å
155I83.7Confident85.7Confident15 Ų1521 Ų218%0.07711%0.108CC..Hα-helixtrans-56.7-40178.4-77.3171.4000111.2F76 L81 I151 W153 L159F76-I155 HydrophobicContact CD2-CB 4.38Å; F76-I155 HydrophobicContact CD2-CD1 4.48Å; F76-I155 HydrophobicContact CD2-CG1 4.25Å; F76-I155 HydrophobicContact CD2-CG2 3.35Å; F76-I155 HydrophobicContact CE2-CB 4.47Å; F76-I155 HydrophobicContact CE2-CG2 3.1Å; F76-I155 HydrophobicContact CZ-CG2 4.16Å; L81-I155 HydrophobicContact CD1-CG2 4.3Å; L81-I155 HydrophobicContact CD2-CG2 4Å; I151-I155 HydrophobicContact CG2-CD1 3.92Å; I151-I155 HydrophobicContact CG2-CG1 4.47Å; I151-I155 WeakPolarHBondContact O-CB 3.39Å; I151-I155 VanDerWaalsContact O-CG1 3.28Å; I151-I155 WeakPolarHBondContact O-CG1 3.43Å; I151-I155 PolarHBondContact O-N 3.45Å; W153-I155 VanDerWaalsContact C-N 3.26Å; W153-I155 PolarHBondContact O-N 3.23Å; I155-L159 WeakPolarHBondContact O-CB 3.28Å; I155-L159 PolarHBondContact O-N 3.28Å
156V89.4Confident85.7Confident9 Ų917.4 Ų17.46%0.0559%0.092CC..Hα-helixtrans-71.5-41.4177.3178.70000110.8L81 I89 A92 I93 G152 W153 L154 L159 V160L81-V156 HydrophobicContact CD1-CG2 3.68Å; I89-V156 HydrophobicContact CB-CG2 4.48Å; I89-V156 HydrophobicContact CG1-CG2 3.89Å; A92-V156 HydrophobicContact CB-CB 3.67Å; A92-V156 HydrophobicContact CB-CG1 3.59Å; I93-V156 HydrophobicContact CG1-CG1 4.4Å; G152-V156 WeakPolarHBondContact O-CG2 3.4Å; G152-V156 PolarHBondContact O-N 3.44Å; W153-V156 PolarHBondContact O-N 3.25Å; W153-V156 VanDerWaalsContact O-N 3.09Å; L154-V156 PolarHBondContact O-N 3.15Å; V156-L159 PolarHBondContact O-N 3.22Å; V156-V160 HydrophobicContact CG1-CG2 4.44Å; V156-V160 VanDerWaalsContact O-CG2 3.29Å; V156-V160 WeakPolarHBondContact O-CG2 3.12Å; V156-V160 PolarHBondContact O-N 2.85Å
157E91.5Very high85.6Confident0 Ų020.2 Ų20.20%011%0.107CC..Hα-helixtrans-57.1-53.6173.7-68.8-177.1-172.800111.1A92 Q95 I96 A127 W153 L154 L159 V160 M161A92-E157 HydrophobicContact CB-CG 4.21Å; Q95-E157 PolarHBondContact OE1-OE1 3.25Å; Q95-E157 VanDerWaalsContact OE1-OE1 3.13Å; I96-E157 HydrophobicContact CD1-CG 4.15Å; I96-E157 HydrophobicContact CG1-CG 4.33Å; A127-E157 PolarHBondContact N-OE2 3.47Å; W153-E157 PolarHBondContact NE1-OE1 3.48Å; W153-E157 PolarHBondContact O-N 2.95Å; L154-E157 WeakPolarHBondContact O-CB 3.4Å; L154-E157 PolarHBondContact O-N 2.93Å; L154-E157 VanDerWaalsContact O-N 3.09Å; E157-L159 VanDerWaalsContact C-N 3.3Å; E157-L159 PolarHBondContact O-N 3.26Å; E157-V160 PolarHBondContact O-N 2.87Å; E157-V160 VanDerWaalsContact O-N 3.11Å; E157-M161 VanDerWaalsContact O-CG 3.28Å; E157-M161 WeakPolarHBondContact O-CG 3.36Å; E157-M161 PolarHBondContact O-N 3.41Å
158D87Confident85.8Confident2 Ų220.8 Ų20.81%0.01111%0.11CC..Hα-helixtrans-56-44.8179-71.9-5.8000110.9T129 L154 V160 M161 V162 F347T129-D158 PolarHBondContact OG1-OD2 3.07Å; T129-D158 VanDerWaalsContact OG1-OD2 3.04Å; L154-D158 WeakPolarHBondContact O-CB 3.42Å; L154-D158 PolarHBondContact O-N 3.23Å; D158-V160 PolarHBondContact O-N 2.87Å; D158-M161 PolarHBondContact O-N 3.2Å; D158-V162 VanDerWaalsContact O-CG2 3.26Å; D158-V162 WeakPolarHBondContact O-CG2 3.26Å; D158-V162 PolarHBondContact O-N 2.99Å; D158-F347 HydrophobicContact CB-CE2 3.79Å; D158-F347 HydrophobicContact CB-CZ 4.07Å; D158-F347 WeakPolarHBondContact OD1-CD2 3.34Å; D158-F347 WeakPolarHBondContact OD1-CE2 3.34Å
159L83.6Confident85.7Confident58 Ų5819.6 Ų19.630%0.30411%0.11SC..Hα-helixtrans-61.6-45.6176.8-17863.5000112.2I155 V156 E157 M161 V162 L163 F255I155-L159 WeakPolarHBondContact O-CB 3.28Å; I155-L159 PolarHBondContact O-N 3.28Å; V156-L159 PolarHBondContact O-N 3.22Å; E157-L159 VanDerWaalsContact C-N 3.3Å; E157-L159 PolarHBondContact O-N 3.26Å; L159-M161 VanDerWaalsContact C-N 3.26Å; L159-M161 PolarHBondContact O-N 2.98Å; L159-V162 PolarHBondContact O-N 3.16Å; L159-L163 HydrophobicContact CG-CD1 4.47Å; L159-L163 WeakPolarHBondContact O-CG 3.43Å; L159-L163 PolarHBondContact O-N 3.03Å; L159-F255 HydrophobicContact CD1-CE1 4.48Å
160V90.3Very high85.3Confident39 Ų3920.6 Ų20.624%0.23612%0.118CC..Hα-helixtrans-63-36.2177.3175.10000110.6I96 V156 E157 D158 L163 T164I96-V160 HydrophobicContact CD1-CB 3.92Å; I96-V160 HydrophobicContact CD1-CG1 3.98Å; I96-V160 HydrophobicContact CD1-CG2 4.04Å; V156-V160 HydrophobicContact CG1-CG2 4.44Å; V156-V160 VanDerWaalsContact O-CG2 3.29Å; V156-V160 WeakPolarHBondContact O-CG2 3.12Å; V156-V160 PolarHBondContact O-N 2.85Å; E157-V160 PolarHBondContact O-N 2.87Å; E157-V160 VanDerWaalsContact O-N 3.11Å; D158-V160 PolarHBondContact O-N 2.87Å; V160-L163 PolarHBondContact O-N 3.45Å; V160-T164 WeakPolarHBondContact O-CB 3.07Å; V160-T164 PolarHBondContact O-N 3.37Å; V160-T164 PolarHBondContact O-OG1 3.47Å
161M89.2Confident85Confident2 Ų222.6 Ų22.61%0.0113%0.13CC..Hα-helixtrans-71.9-41.6178.4-67-50.9124.800113.6I96 L122 S125 T126 E157 D158 L159 L163 T164 L165 F347 L351I96-M161 HydrophobicContact CD1-CE 4.21Å; I96-M161 HydrophobicContact CG1-CE 4.45Å; I96-M161 HydrophobicContact CG2-CE 4.26Å; L122-M161 HydrophobicContact CD2-CE 4.26Å; S125-M161 WeakPolarHBondContact OG-CE 3.48Å; T126-M161 HydrophobicContact CG2-CB 4.46Å; T126-M161 HydrophobicContact CG2-CE 3.64Å; T126-M161 HydrophobicContact CG2-CG 3.1Å; T126-M161 HydrophobicContact CG2-SD 3.12Å; T126-M161 WeakPolarHBondContact CG2-SD 3.25Å; E157-M161 VanDerWaalsContact O-CG 3.28Å; E157-M161 WeakPolarHBondContact O-CG 3.36Å; E157-M161 PolarHBondContact O-N 3.41Å; D158-M161 PolarHBondContact O-N 3.2Å; L159-M161 VanDerWaalsContact C-N 3.26Å; L159-M161 PolarHBondContact O-N 2.98Å; M161-L163 VanDerWaalsContact C-N 3.27Å; M161-L163 PolarHBondContact O-N 3.46Å; M161-T164 WeakPolarHBondContact O-CB 3.19Å; M161-T164 PolarHBondContact O-N 3.33Å; M161-T164 VanDerWaalsContact O-N 3.13Å; M161-L165 WeakPolarHBondContact O-CG 3.3Å; M161-L165 PolarHBondContact O-N 3.49Å; M161-F347 HydrophobicContact CB-CB 4.15Å; M161-F347 HydrophobicContact CB-CD1 3.73Å; M161-F347 HydrophobicContact CB-CE1 4.25Å; M161-F347 HydrophobicContact CB-CG 3.95Å; M161-F347 HydrophobicContact CG-CB 4.18Å; M161-F347 HydrophobicContact CG-CG 4.38Å; M161-L351 HydrophobicContact SD-CD2 4.31Å
162V79.4Confident85Confident0 Ų021.3 Ų21.30%012%0.124CC..Hα-helixtrans-59.1-44.2173.41750000109.9D158 L159 T164 L165 V166 L252 F347D158-V162 VanDerWaalsContact O-CG2 3.26Å; D158-V162 WeakPolarHBondContact O-CG2 3.26Å; D158-V162 PolarHBondContact O-N 2.99Å; L159-V162 PolarHBondContact O-N 3.16Å; V162-T164 PolarHBondContact O-N 3.2Å; V162-L165 PolarHBondContact O-N 2.88Å; V162-V166 WeakPolarHBondContact O-CG2 3.32Å; V162-V166 PolarHBondContact O-N 3.4Å; V162-L252 HydrophobicContact CG1-CB 3.48Å; V162-L252 VanDerWaalsContact CG1-CB 3.48Å; V162-L252 HydrophobicContact CG1-CD1 3.31Å; V162-L252 HydrophobicContact CG1-CG 3.9Å; V162-F347 HydrophobicContact CG2-CE1 3.68Å; V162-F347 HydrophobicContact CG2-CZ 3.94Å
163L83Confident84.4Confident69 Ų6922.4 Ų22.436%0.36114%0.136SC..Hα-helixtrans-62.6-41.4173.7-69.4173.1000112L159 V160 M161 V166 L167L159-L163 HydrophobicContact CG-CD1 4.47Å; L159-L163 WeakPolarHBondContact O-CG 3.43Å; L159-L163 PolarHBondContact O-N 3.03Å; V160-L163 PolarHBondContact O-N 3.45Å; M161-L163 VanDerWaalsContact C-N 3.27Å; M161-L163 PolarHBondContact O-N 3.46Å; L163-V166 PolarHBondContact O-N 2.87Å; L163-L167 WeakPolarHBondContact O-CB 3.23Å; L163-L167 VanDerWaalsContact O-CG 3.28Å; L163-L167 WeakPolarHBondContact O-CG 3.35Å; L163-L167 PolarHBondContact O-N 3.5Å
164T89.1Confident83.6Confident21 Ų2125.2 Ų25.213%0.12915%0.149CC..Hα-helixtrans-60.6-47.8177.4-62.10000111.2L122 V160 M161 V162 V166 L167 L168 L351L122-T164 HydrophobicContact CD1-CG2 3.82Å; V160-T164 WeakPolarHBondContact O-CB 3.07Å; V160-T164 PolarHBondContact O-N 3.37Å; V160-T164 PolarHBondContact O-OG1 3.47Å; M161-T164 WeakPolarHBondContact O-CB 3.19Å; M161-T164 PolarHBondContact O-N 3.33Å; M161-T164 VanDerWaalsContact O-N 3.13Å; V162-T164 PolarHBondContact O-N 3.2Å; T164-V166 PolarHBondContact O-N 2.83Å; T164-L167 PolarHBondContact O-N 3.43Å; T164-L168 VanDerWaalsContact O-CB 3.24Å; T164-L168 WeakPolarHBondContact O-CB 3.47Å; T164-L168 PolarHBondContact O-N 3.06Å; T164-L351 HydrophobicContact CG2-CD1 3.82Å; T164-L351 HydrophobicContact CG2-CD2 4.21Å
165L82.9Confident82.9Confident7 Ų729.3 Ų29.34%0.03717%0.17CC..Hα-helixtrans-58.8-30178.7-74.6172.2000112.8M161 V162 P169 F347 I350 L351 L354M161-L165 WeakPolarHBondContact O-CG 3.3Å; M161-L165 PolarHBondContact O-N 3.49Å; V162-L165 PolarHBondContact O-N 2.88Å; L165-P169 WeakPolarHBondContact O-CD 3.4Å; L165-F347 HydrophobicContact CD1-CD1 4.2Å; L165-F347 HydrophobicContact CD1-CE1 4.48Å; L165-I350 HydrophobicContact CD1-CG2 3.83Å; L165-I350 HydrophobicContact CD2-CG2 3.83Å; L165-L351 HydrophobicContact CD2-CB 4.13Å; L165-L351 HydrophobicContact CD2-CD1 3.73Å; L165-L351 HydrophobicContact CG-CD1 4.41Å; L165-L354 HydrophobicContact CB-CD2 4.45Å; L165-L354 HydrophobicContact CD2-CB 4.35Å; L165-L354 HydrophobicContact CD2-CD2 3.68Å; L165-L354 WeakPolarHBondContact O-CD2 3.29Å
166V77.1Confident82.3Confident10 Ų1035.7 Ų35.76%0.06120%0.199CC..Hα-helixtrans-83.3-37.9179.6172.60000111.7V162 L163 T164 V196 L252V162-V166 WeakPolarHBondContact O-CG2 3.32Å; V162-V166 PolarHBondContact O-N 3.4Å; L163-V166 PolarHBondContact O-N 2.87Å; T164-V166 PolarHBondContact O-N 2.83Å; V166-V196 HydrophobicContact CG1-CB 4.47Å; V166-V196 HydrophobicContact CG1-CG1 4.42Å; V166-V196 HydrophobicContact CG1-CG2 3.23Å; V166-L252 HydrophobicContact CG2-CB 4.11Å; V166-L252 HydrophobicContact CG2-CD2 3.64Å; V166-L252 HydrophobicContact CG2-CG 4.43Å
167L82.3Confident81Confident68 Ų6839.7 Ų39.736%0.35622%0.217SC..Hα-helixtrans-79.9-26.6179.6-66.2174.8000112.5L163 T164 A170 V171 I193L163-L167 WeakPolarHBondContact O-CB 3.23Å; L163-L167 VanDerWaalsContact O-CG 3.28Å; L163-L167 WeakPolarHBondContact O-CG 3.35Å; L163-L167 PolarHBondContact O-N 3.5Å; T164-L167 PolarHBondContact O-N 3.43Å; L167-A170 WeakPolarHBondContact O-CB 3.26Å; L167-A170 PolarHBondContact O-N 3.32Å; L167-V171 WeakPolarHBondContact O-CG2 3.44Å; L167-V171 PolarHBondContact O-N 3.17Å; L167-I193 HydrophobicContact CD2-CG1 4.12Å
168L86.2Confident79.4Confident12 Ų1243 Ų436%0.06325%0.252CS..Hα-helixtrans-61.4-44.3-174.1-167.369.8000113.6V119 T164 A170 V171 A172 L351 L354 L358 L360V119-L168 HydrophobicContact CG1-CD2 4.43Å; V119-L168 HydrophobicContact CG2-CD1 3.7Å; V119-L168 HydrophobicContact CG2-CD2 4.38Å; T164-L168 VanDerWaalsContact O-CB 3.24Å; T164-L168 WeakPolarHBondContact O-CB 3.47Å; T164-L168 PolarHBondContact O-N 3.06Å; L168-A170 VanDerWaalsContact C-N 3.32Å; L168-A170 PolarHBondContact O-N 3.02Å; L168-V171 PolarHBondContact O-N 3.33Å; L168-A172 WeakPolarHBondContact O-CB 3.41Å; L168-A172 PolarHBondContact O-N 3.06Å; L168-L351 HydrophobicContact CD2-CD1 3.78Å; L168-L354 HydrophobicContact CB-CD2 4.28Å; L168-L354 HydrophobicContact CD2-CD2 4.09Å; L168-L354 HydrophobicContact CD2-CG 4.19Å; L168-L358 HydrophobicContact CB-CD1 4.39Å; L168-L358 HydrophobicContact CD2-CD1 4.13Å; L168-L358 HydrophobicContact CG-CD1 3.9Å; L168-L360 HydrophobicContact CD1-CD1 3.54Å; L168-L360 HydrophobicContact CD2-CD1 4.3Å; L168-L360 HydrophobicContact CG-CD1 3.79Å
169P79.9Confident77.9Confident57 Ų5750.8 Ų50.837%0.3729%0.293SS..Hα-helixtrans-59.9-39.8173.8-23.533.9000113.1L165 A172 G173 L354 L358L165-P169 WeakPolarHBondContact O-CD 3.4Å; P169-A172 PolarHBondContact O-N 2.98Å; P169-G173 PolarHBondContact O-N 3.4Å; P169-L354 HydrophobicContact CG-CD1 4.5Å; P169-L354 HydrophobicContact CG-CD2 4.33Å; P169-L358 HydrophobicContact CB-CD1 4.3Å; P169-L358 HydrophobicContact CB-CD2 4.45Å; P169-L358 HydrophobicContact CG-CD1 4.13Å
170A77.8Confident76.7Confident23 Ų2350.8 Ų50.819%0.1930%0.296CS..Hα-helixtrans-64.1-45.3176.500000111.1L167 L168 A172 G173 M174 T192L167-A170 WeakPolarHBondContact O-CB 3.26Å; L167-A170 PolarHBondContact O-N 3.32Å; L168-A170 VanDerWaalsContact C-N 3.32Å; L168-A170 PolarHBondContact O-N 3.02Å; A170-A172 PolarHBondContact O-N 3.29Å; A170-G173 PolarHBondContact O-N 3.29Å; A170-M174 VanDerWaalsContact O-CG 3.3Å; A170-M174 WeakPolarHBondContact O-CG 3.32Å; A170-M174 PolarHBondContact O-N 3.01Å; A170-M174 VanDerWaalsContact O-N 3.09Å; A170-T192 HydrophobicContact CB-CG2 4.17Å
171V83Confident75.4Confident43 Ų4351.2 Ų51.226%0.26131%0.308SS..Hα-helixtrans-63.4-40.5176.4174.70000111.6M115 L167 L168 M174 M175M115-V171 HydrophobicContact CE-CG1 3.43Å; M115-V171 VanDerWaalsContact CE-CG1 3.43Å; L167-V171 WeakPolarHBondContact O-CG2 3.44Å; L167-V171 PolarHBondContact O-N 3.17Å; L168-V171 PolarHBondContact O-N 3.33Å; V171-M174 WeakPolarHBondContact O-CB 3.27Å; V171-M174 PolarHBondContact O-N 3.29Å; V171-M175 WeakPolarHBondContact O-CG 3.44Å; V171-M175 PolarHBondContact O-N 3.27Å
172A83.1Confident74.4Confident6 Ų660 Ų605%0.0535%0.346CS..Hα-helixtrans-61.8-45.2175.600000111.8L168 P169 A170 M174 M175 E176 L358 L360L168-A172 WeakPolarHBondContact O-CB 3.41Å; L168-A172 PolarHBondContact O-N 3.06Å; P169-A172 PolarHBondContact O-N 2.98Å; A170-A172 PolarHBondContact O-N 3.29Å; A172-M174 VanDerWaalsContact C-N 3.28Å; A172-M174 PolarHBondContact O-N 2.86Å; A172-M175 WeakPolarHBondContact O-CB 3.22Å; A172-M175 PolarHBondContact O-N 2.91Å; A172-E176 PolarHBondContact O-N 3.36Å; A172-E176 VanDerWaalsContact O-N 3.14Å; A172-L358 HydrophobicContact CB-CB 3.93Å; A172-L358 HydrophobicContact CB-CD1 3.98Å; A172-L358 HydrophobicContact CB-CD2 4.11Å; A172-L358 HydrophobicContact CB-CG 4.23Å; A172-L360 HydrophobicContact CB-CD1 3.92Å; A172-L360 HydrophobicContact CB-CD2 4.43Å; A172-L360 HydrophobicContact CB-CG 4.25Å
173G74.4Confident74.1Confident25 Ų2563.5 Ų63.526%0.25838%0.375SS..Hα-helixtrans-59.6-37.7176.400000112.9P169 A170 M175 Q177P169-G173 PolarHBondContact O-N 3.4Å; A170-G173 PolarHBondContact O-N 3.29Å; G173-M175 VanDerWaalsContact C-N 3.27Å; G173-M175 PolarHBondContact O-N 3.2Å; G173-Q177 VanDerWaalsContact O-CG 3.31Å; G173-Q177 WeakPolarHBondContact O-CG 3.36Å; G173-Q177 PolarHBondContact O-N 2.89Å
174M73.3Confident73.6Confident59 Ų5963 Ų6329%0.29138%0.375SS..Hα-helixtrans-63.3-32.6174.5-63.2169.471.600112.7A170 V171 A172 L185 M189A170-M174 VanDerWaalsContact O-CG 3.3Å; A170-M174 WeakPolarHBondContact O-CG 3.32Å; A170-M174 PolarHBondContact O-N 3.01Å; A170-M174 VanDerWaalsContact O-N 3.09Å; V171-M174 WeakPolarHBondContact O-CB 3.27Å; V171-M174 PolarHBondContact O-N 3.29Å; A172-M174 VanDerWaalsContact C-N 3.28Å; A172-M174 PolarHBondContact O-N 2.86Å; M174-L185 HydrophobicContact CB-CD2 3.88Å; M174-L185 HydrophobicContact CE-CB 4.03Å; M174-L185 HydrophobicContact CE-CD1 4.22Å; M174-L185 HydrophobicContact CG-CD2 3.74Å; M174-M189 HydrophobicContact CE-CG 4.32Å; M174-M189 HydrophobicContact CE-SD 3.6Å; M174-M189 HydrophobicContact SD-CE 4.35Å; M174-M189 HydrophobicContact SD-CG 3.71Å; M174-M189 HydrophobicContact SD-SD 3.53Å
175M75.4Confident72.6Confident90 Ų9063.4 Ų63.444%0.44338%0.376SS..Hα-helixtrans-77.9-37.4-178.9-68.5-179.165.400113.2M115 V171 A172 G173 Q177 L360M115-M175 HydrophobicContact CB-CE 3.79Å; M115-M175 HydrophobicContact CB-SD 3.89Å; M115-M175 HydrophobicContact CE-SD 3.83Å; M115-M175 HydrophobicContact CG-CE 3.53Å; M115-M175 HydrophobicContact CG-SD 3.52Å; M115-M175 VanDerWaalsContact CG-SD 3.52Å; M115-M175 HydrophobicContact SD-SD 4.33Å; V171-M175 WeakPolarHBondContact O-CG 3.44Å; V171-M175 PolarHBondContact O-N 3.27Å; A172-M175 WeakPolarHBondContact O-CB 3.22Å; A172-M175 PolarHBondContact O-N 2.91Å; G173-M175 VanDerWaalsContact C-N 3.27Å; G173-M175 PolarHBondContact O-N 3.2Å; M175-Q177 VanDerWaalsContact C-N 3.3Å; M175-Q177 PolarHBondContact O-N 2.99Å; M175-L360 HydrophobicContact CE-CD2 4.33Å; M175-L360 HydrophobicContact SD-CD2 3.73Å
176E70.7Confident72.2Confident150 Ų15065.9 Ų65.970%0.70140%0.398SS*.Hα-helixtrans-67.6-33.4178.7-73.5-167.1157.900112A172 G178A172-E176 PolarHBondContact O-N 3.36Å; A172-E176 VanDerWaalsContact O-N 3.14Å; E176-G178 PolarHBondContact O-N 3.34Å
177Q62.5Low72.4Confident93 Ų9369.6 Ų69.644%0.43542%0.42SS..THydrogen-bonded Turntrans-84.333-175.7-57.8176.86.700113.3G173 M175 D179 V180G173-Q177 VanDerWaalsContact O-CG 3.31Å; G173-Q177 WeakPolarHBondContact O-CG 3.36Å; G173-Q177 PolarHBondContact O-N 2.89Å; M175-Q177 VanDerWaalsContact C-N 3.3Å; M175-Q177 PolarHBondContact O-N 2.99Å; Q177-D179 VanDerWaalsContact C-N 3.27Å; Q177-D179 PolarHBondContact O-N 3.29Å; Q177-V180 HydrophobicContact CB-CG2 3.31Å; Q177-V180 HydrophobicContact CG-CG2 4.31Å; Q177-V180 WeakPolarHBondContact O-CG2 3.45Å; Q177-V180 PolarHBondContact O-N 2.93Å; Q177-V180 VanDerWaalsContact O-N 3.12Å
178G56.6Low71.9Confident70 Ų7069.7 Ų69.772%0.72242%0.421SS*.THydrogen-bonded Turntrans-55.461.7-16800000119.3E176E176-G178 PolarHBondContact O-N 3.34Å
179D56.5Low71.3Confident165 Ų16572.2 Ų72.288%0.88243%0.433SS*.THydrogen-bonded Turntrans-175.314154.9-144.46.5000112.4Q177Q177-D179 VanDerWaalsContact C-N 3.27Å; Q177-D179 PolarHBondContact O-N 3.29Å
180V58.1Low71.4Confident58 Ų5871.5 Ų71.535%0.35244%0.437SS..  trans-76.7135.6179.5-1390000111.4Q177 T184Q177-V180 HydrophobicContact CB-CG2 3.31Å; Q177-V180 HydrophobicContact CG-CG2 4.31Å; Q177-V180 WeakPolarHBondContact O-CG2 3.45Å; Q177-V180 PolarHBondContact O-N 2.93Å; Q177-V180 VanDerWaalsContact O-N 3.12Å; V180-T184 WeakPolarHBondContact CB-OG1 3.27Å; V180-T184 HydrophobicContact CG1-CG2 3.84Å; V180-T184 WeakPolarHBondContact CG1-OG1 3.41Å
181G63Low71.7Confident48 Ų4874.3 Ų74.350%0.49545%0.448SS..  trans-55141.6-17900000112.3A183 T184G181-A183 PolarHBondContact O-N 3.43Å; G181-T184 PolarHBondContact O-N 3.18Å; G181-T184 PolarHBondContact O-OG1 3.43Å
182F68.3Low71.5Confident186 Ų18674 Ų7482%0.81645%0.446SS*.Hα-helixtrans-43.2-29.7177.1-123-89.8000114.1A186F182-A186 VanDerWaalsContact O-CB 3.24Å; F182-A186 WeakPolarHBondContact O-CB 3.37Å; F182-A186 PolarHBondContact O-N 2.81Å
183A72.1Confident71.5Confident74 Ų7477.1 Ų77.161%0.61246%0.461SS*.Hα-helixtrans-64.2-42.7176.900000114G181 V187G181-A183 PolarHBondContact O-N 3.43Å; A183-V187 VanDerWaalsContact O-CG2 3.25Å; A183-V187 WeakPolarHBondContact O-CG2 3.46Å; A183-V187 PolarHBondContact O-N 3.35Å; A183-V187 VanDerWaalsContact O-N 3.07Å
184T72.5Confident72.1Confident59 Ų5977.5 Ų77.536%0.36247%0.465SS..Hα-helixtrans-70.9-42.2179.656.20000110.5V180 G181 A186 V187 D188V180-T184 WeakPolarHBondContact CB-OG1 3.27Å; V180-T184 HydrophobicContact CG1-CG2 3.84Å; V180-T184 WeakPolarHBondContact CG1-OG1 3.41Å; G181-T184 PolarHBondContact O-N 3.18Å; G181-T184 PolarHBondContact O-OG1 3.43Å; T184-A186 VanDerWaalsContact C-N 3.32Å; T184-A186 PolarHBondContact O-N 2.68Å; T184-V187 WeakPolarHBondContact O-CB 3.33Å; T184-V187 PolarHBondContact O-N 3.29Å; T184-V187 VanDerWaalsContact O-N 3.11Å; T184-D188 PolarHBondContact O-N 2.91Å
185L68Low72.8Confident29 Ų2978 Ų7815%0.15247%0.465CS..Hα-helixtrans-61.6-41.4176.3-58175.4000111.5M174 V187 D188 M189M174-L185 HydrophobicContact CB-CD2 3.88Å; M174-L185 HydrophobicContact CE-CB 4.03Å; M174-L185 HydrophobicContact CE-CD1 4.22Å; M174-L185 HydrophobicContact CG-CD2 3.74Å; L185-V187 VanDerWaalsContact C-N 3.31Å; L185-V187 PolarHBondContact O-N 2.9Å; L185-D188 PolarHBondContact O-N 3.5Å; L185-M189 WeakPolarHBondContact O-CB 3.36Å; L185-M189 VanDerWaalsContact O-CG 3.28Å; L185-M189 WeakPolarHBondContact O-CG 3.37Å; L185-M189 PolarHBondContact O-N 3.16Å
186A75.5Confident73.3Confident59 Ų5974.3 Ų74.349%0.48845%0.448SS..Hα-helixtrans-64.7-35.7175.300000112.4F182 T184 G190F182-A186 VanDerWaalsContact O-CB 3.24Å; F182-A186 WeakPolarHBondContact O-CB 3.37Å; F182-A186 PolarHBondContact O-N 2.81Å; T184-A186 VanDerWaalsContact C-N 3.32Å; T184-A186 PolarHBondContact O-N 2.68Å; A186-G190 PolarHBondContact O-N 3.13Å
187V80.2Confident74.2Confident87 Ų8772.2 Ų72.253%0.52744%0.44SS..Hα-helixtrans-68.8-48.4175.21700000110.6A183 T184 L185 G190 I191A183-V187 VanDerWaalsContact O-CG2 3.25Å; A183-V187 WeakPolarHBondContact O-CG2 3.46Å; A183-V187 PolarHBondContact O-N 3.35Å; A183-V187 VanDerWaalsContact O-N 3.07Å; T184-V187 WeakPolarHBondContact O-CB 3.33Å; T184-V187 PolarHBondContact O-N 3.29Å; T184-V187 VanDerWaalsContact O-N 3.11Å; L185-V187 VanDerWaalsContact C-N 3.31Å; L185-V187 PolarHBondContact O-N 2.9Å; V187-G190 CarbonylContact O-C 3.56Å; V187-G190 PolarHBondContact O-N 3.44Å; V187-G190 VanDerWaalsContact O-N 3.17Å; V187-I191 HydrophobicContact CG1-CD1 3.7Å; V187-I191 HydrophobicContact CG1-CG1 4.36Å; V187-I191 VanDerWaalsContact O-CG1 3.25Å; V187-I191 WeakPolarHBondContact O-CG1 3.44Å; V187-I191 PolarHBondContact O-N 2.95Å
188D73.1Confident75.6Confident71 Ų7169.6 Ų69.638%0.3844%0.435SS..Hα-helixtrans-63.8-45.3-179.6-69.7-20.7000111.4T184 L185 G190 I191 T192T184-D188 PolarHBondContact O-N 2.91Å; L185-D188 PolarHBondContact O-N 3.5Å; D188-G190 VanDerWaalsContact C-N 3.33Å; D188-G190 PolarHBondContact O-N 3.42Å; D188-I191 PolarHBondContact O-N 2.89Å; D188-T192 PolarHBondContact O-N 3.09Å; D188-T192 PolarHBondContact O-OG1 3.02Å
189M73.6Confident77.2Confident64 Ų6466.5 Ų66.532%0.31540%0.402SS..Hα-helixtrans-60.9-42.2172.3-71.8-170.683.300111.9M174 L185 I191 T192 I193M174-M189 HydrophobicContact CE-CG 4.32Å; M174-M189 HydrophobicContact CE-SD 3.6Å; M174-M189 HydrophobicContact SD-CE 4.35Å; M174-M189 HydrophobicContact SD-CG 3.71Å; M174-M189 HydrophobicContact SD-SD 3.53Å; L185-M189 WeakPolarHBondContact O-CB 3.36Å; L185-M189 VanDerWaalsContact O-CG 3.28Å; L185-M189 WeakPolarHBondContact O-CG 3.37Å; L185-M189 PolarHBondContact O-N 3.16Å; M189-I191 VanDerWaalsContact C-N 3.3Å; M189-I191 PolarHBondContact O-N 2.93Å; M189-T192 PolarHBondContact O-N 3.04Å; M189-I193 VanDerWaalsContact O-CB 3.26Å; M189-I193 WeakPolarHBondContact O-CB 3.47Å; M189-I193 VanDerWaalsContact O-CG1 3.24Å; M189-I193 WeakPolarHBondContact O-CG1 3.28Å; M189-I193 PolarHBondContact O-N 3.04Å
190G82.8Confident78.8Confident43 Ų4360.9 Ų60.944%0.44337%0.371SS..Hα-helixtrans-62.3-37.6176.800000112.3A186 V187 D188 G194A186-G190 PolarHBondContact O-N 3.13Å; V187-G190 CarbonylContact O-C 3.56Å; V187-G190 PolarHBondContact O-N 3.44Å; V187-G190 VanDerWaalsContact O-N 3.17Å; D188-G190 VanDerWaalsContact C-N 3.33Å; D188-G190 PolarHBondContact O-N 3.42Å; G190-G194 WeakPolarHBondContact O-CA 3.37Å; G190-G194 PolarHBondContact O-N 3.43Å
191I84Confident80.4Confident82 Ų8260.1 Ų60.142%0.42137%0.371SS..Hα-helixtrans-69-50.1175.2-69.1165.3000110.1V187 D188 M189 G194 K195V187-I191 HydrophobicContact CG1-CD1 3.7Å; V187-I191 HydrophobicContact CG1-CG1 4.36Å; V187-I191 VanDerWaalsContact O-CG1 3.25Å; V187-I191 WeakPolarHBondContact O-CG1 3.44Å; V187-I191 PolarHBondContact O-N 2.95Å; D188-I191 PolarHBondContact O-N 2.89Å; M189-I191 VanDerWaalsContact C-N 3.3Å; M189-I191 PolarHBondContact O-N 2.93Å; I191-G194 CarbonylContact O-C 3.53Å; I191-G194 WeakPolarHBondContact O-CA 3.26Å; I191-G194 PolarHBondContact O-N 3.23Å; I191-K195 HydrophobicContact CG2-CD 4.31Å; I191-K195 HydrophobicContact CG2-CG 4.39Å; I191-K195 WeakPolarHBondContact O-CG 3.4Å; I191-K195 PolarHBondContact O-N 2.87Å
192T78.1Confident81.9Confident37 Ų3761.4 Ų61.423%0.22737%0.365CS..Hα-helixtrans-61.3-51.7179.9-57.60000111A170 D188 M189 G194 K195 V196A170-T192 HydrophobicContact CB-CG2 4.17Å; D188-T192 PolarHBondContact O-N 3.09Å; D188-T192 PolarHBondContact O-OG1 3.02Å; M189-T192 PolarHBondContact O-N 3.04Å; T192-G194 PolarHBondContact O-N 2.94Å; T192-K195 PolarHBondContact O-N 3.3Å; T192-K195 VanDerWaalsContact O-N 3.15Å; T192-V196 VanDerWaalsContact O-CG2 3.23Å; T192-V196 WeakPolarHBondContact O-CG2 3.41Å; T192-V196 PolarHBondContact O-N 3.09Å
193I82.2Confident83Confident70 Ų7053.2 Ų53.236%0.35933%0.33SS..Hα-helixtrans-59.9-40.3176.3-66.7169.6000110L167 M189 V196 I197L167-I193 HydrophobicContact CD2-CG1 4.12Å; M189-I193 VanDerWaalsContact O-CB 3.26Å; M189-I193 WeakPolarHBondContact O-CB 3.47Å; M189-I193 VanDerWaalsContact O-CG1 3.24Å; M189-I193 WeakPolarHBondContact O-CG1 3.28Å; M189-I193 PolarHBondContact O-N 3.04Å; I193-V196 PolarHBondContact O-N 2.92Å; I193-I197 HydrophobicContact CG2-CD1 3.65Å; I193-I197 HydrophobicContact CG2-CG1 4.24Å; I193-I197 WeakPolarHBondContact O-CB 3.17Å; I193-I197 VanDerWaalsContact O-CG1 3.26Å; I193-I197 WeakPolarHBondContact O-CG1 3.17Å; I193-I197 PolarHBondContact O-N 3.33Å
194G88.4Confident83.9Confident33 Ų3352.9 Ų52.934%0.3432%0.316SS..Hα-helixtrans-60.1-44.2175.100000113.1G190 I191 T192 I197 A198G190-G194 WeakPolarHBondContact O-CA 3.37Å; G190-G194 PolarHBondContact O-N 3.43Å; I191-G194 CarbonylContact O-C 3.53Å; I191-G194 WeakPolarHBondContact O-CA 3.26Å; I191-G194 PolarHBondContact O-N 3.23Å; T192-G194 PolarHBondContact O-N 2.94Å; G194-I197 PolarHBondContact O-N 3.4Å; G194-A198 WeakPolarHBondContact O-CB 3.49Å; G194-A198 PolarHBondContact O-N 3.35Å
195K88.2Confident84.8Confident70 Ų7056.4 Ų56.430%0.30433%0.332SS..Hα-helixtrans-64.5-41.4175.9-73.7-176.7-176.8-174.70111.5I191 T192 A198 F199 F246 D247I191-K195 HydrophobicContact CG2-CD 4.31Å; I191-K195 HydrophobicContact CG2-CG 4.39Å; I191-K195 WeakPolarHBondContact O-CG 3.4Å; I191-K195 PolarHBondContact O-N 2.87Å; T192-K195 PolarHBondContact O-N 3.3Å; T192-K195 VanDerWaalsContact O-N 3.15Å; K195-A198 PolarHBondContact O-N 3.04Å; K195-F199 WeakPolarHBondContact O-CB 3.33Å; K195-F199 PolarHBondContact O-N 3.37Å; K195-F246 HydrophobicContact CB-CB 4.47Å; K195-F246 WeakPolarHBondContact CB-O 3.14Å; K195-F246 WeakPolarHBondContact CD-O 3.43Å; K195-F246 WeakPolarHBondContact O-CD1 3.09Å; K195-D247 IonicContact NZ-OD2 2.72Å; K195-D247 PolarHBondContact NZ-OD2 3.37Å
196V84.7Confident86Confident12 Ų1258.7 Ų58.77%0.07335%0.347CS..Hα-helixtrans-64.2-48.4176.4177.20000110.9V166 T192 I193 A198 F199 I200 V248 L252V166-V196 HydrophobicContact CG1-CB 4.47Å; V166-V196 HydrophobicContact CG1-CG1 4.42Å; V166-V196 HydrophobicContact CG1-CG2 3.23Å; T192-V196 VanDerWaalsContact O-CG2 3.23Å; T192-V196 WeakPolarHBondContact O-CG2 3.41Å; T192-V196 PolarHBondContact O-N 3.09Å; I193-V196 PolarHBondContact O-N 2.92Å; V196-A198 VanDerWaalsContact C-N 3.3Å; V196-A198 PolarHBondContact O-N 3.3Å; V196-F199 PolarHBondContact O-N 3.01Å; V196-I200 HydrophobicContact CG1-CD1 3.94Å; V196-I200 VanDerWaalsContact O-CG1 3.29Å; V196-I200 WeakPolarHBondContact O-CG1 3.36Å; V196-I200 PolarHBondContact O-N 2.92Å; V196-V248 HydrophobicContact CG2-CG2 3.95Å; V196-L252 HydrophobicContact CG1-CD2 4.1Å
197I88.9Confident86.7Confident106 Ų10656.2 Ų56.254%0.54433%0.327SS..Hα-helixtrans-61.2-41.5175.8-69.7171.7000110.3I193 G194 I200 A201I193-I197 HydrophobicContact CG2-CD1 3.65Å; I193-I197 HydrophobicContact CG2-CG1 4.24Å; I193-I197 WeakPolarHBondContact O-CB 3.17Å; I193-I197 VanDerWaalsContact O-CG1 3.26Å; I193-I197 WeakPolarHBondContact O-CG1 3.17Å; I193-I197 PolarHBondContact O-N 3.33Å; G194-I197 PolarHBondContact O-N 3.4Å; I197-I200 PolarHBondContact O-N 3.07Å; I197-A201 VanDerWaalsContact O-CB 3.22Å; I197-A201 WeakPolarHBondContact O-CB 3.17Å; I197-A201 PolarHBondContact O-N 3.26Å
198A92Very high87.1Confident39 Ų3959 Ų5932%0.32233%0.328SS..Hα-helixtrans-63.6-44.7177.100000111.7G194 K195 V196 A201 I202 F246G194-A198 WeakPolarHBondContact O-CB 3.49Å; G194-A198 PolarHBondContact O-N 3.35Å; K195-A198 PolarHBondContact O-N 3.04Å; V196-A198 VanDerWaalsContact C-N 3.3Å; V196-A198 PolarHBondContact O-N 3.3Å; A198-A201 PolarHBondContact O-N 3.48Å; A198-I202 WeakPolarHBondContact O-CB 3.4Å; A198-I202 WeakPolarHBondContact O-CD1 3.37Å; A198-I202 VanDerWaalsContact O-CG1 3.23Å; A198-I202 WeakPolarHBondContact O-CG1 3.45Å; A198-I202 PolarHBondContact O-N 2.84Å; A198-F246 HydrophobicContact CB-CD1 4.46Å; A198-F246 HydrophobicContact CB-CE1 4.22Å
199F92.1Very high87.9Confident5 Ų565.5 Ų65.52%0.02235%0.348CS..Hα-helixtrans-57.9-52174.6172.5-104.6000110.9K195 V196 A201 I202 M203 V238 A242 F246 V248 L252 F256K195-F199 WeakPolarHBondContact O-CB 3.33Å; K195-F199 PolarHBondContact O-N 3.37Å; V196-F199 PolarHBondContact O-N 3.01Å; F199-A201 PolarHBondContact O-N 2.96Å; F199-I202 PolarHBondContact O-N 3.29Å; F199-M203 HydrophobicContact CD2-CG 4.16Å; F199-M203 HydrophobicContact CE1-CG 3.98Å; F199-M203 HydrophobicContact CE2-CG 3.59Å; F199-M203 HydrophobicContact CE2-SD 4.11Å; F199-M203 HydrophobicContact CZ-CG 3.46Å; F199-M203 VanDerWaalsContact CZ-CG 3.46Å; F199-M203 HydrophobicContact CZ-SD 4.2Å; F199-M203 WeakPolarHBondContact O-CB 3.4Å; F199-M203 WeakPolarHBondContact O-CG 3.34Å; F199-M203 PolarHBondContact O-N 3.13Å; F199-V238 HydrophobicContact CE2-CG1 4.34Å; F199-V238 HydrophobicContact CZ-CG1 4.23Å; F199-A242 HydrophobicContact CD2-CB 4.15Å; F199-A242 HydrophobicContact CE2-CB 3.66Å; F199-A242 HydrophobicContact CZ-CB 3.91Å; F199-F246 HydrophobicContact CB-CB 4.08Å; F199-F246 HydrophobicContact CB-CD1 3.79Å; F199-F246 HydrophobicContact CB-CD2 4.15Å; F199-F246 HydrophobicContact CB-CE1 4.27Å; F199-F246 HydrophobicContact CB-CG 3.74Å; F199-F246 AromaticContact CD2-CD2 3.68Å; F199-F246 HydrophobicContact CD2-CD2 3.68Å; F199-F246 AromaticContact CD2-CE2 3.95Å; F199-F246 HydrophobicContact CD2-CE2 3.95Å; F199-F246 HydrophobicContact CD2-CG 4.13Å; F199-F246 HydrophobicContact CG-CD2 4.35Å; F199-F246 HydrophobicContact CG-CG 4.35Å; F199-V248 HydrophobicContact CB-CG2 4.36Å; F199-V248 HydrophobicContact CD1-CG1 4.32Å; F199-L252 HydrophobicContact CD1-CD2 4.37Å; F199-L252 HydrophobicContact CD1-CG 4.38Å; F199-L252 HydrophobicContact CE1-CG 4.17Å; F199-F256 HydrophobicContact CE1-CB 4.02Å; F199-F256 HydrophobicContact CE1-CD2 4.25Å; F199-F256 HydrophobicContact CE1-CG 4.2Å; F199-F256 HydrophobicContact CZ-CB 4.25Å
200I89.6Confident88.8Confident47 Ų4766.4 Ų66.424%0.24135%0.353CS..Hα-helixtrans-58.7-48.5178.1-67.7171.1000110V196 I197 I202 M203 M204 F256V196-I200 HydrophobicContact CG1-CD1 3.94Å; V196-I200 VanDerWaalsContact O-CG1 3.29Å; V196-I200 WeakPolarHBondContact O-CG1 3.36Å; V196-I200 PolarHBondContact O-N 2.92Å; I197-I200 PolarHBondContact O-N 3.07Å; I200-I202 VanDerWaalsContact C-N 3.35Å; I200-I202 PolarHBondContact O-N 2.9Å; I200-M203 PolarHBondContact O-N 3.24Å; I200-M204 HydrophobicContact CG2-CG 4.13Å; I200-M204 WeakPolarHBondContact O-CB 3.15Å; I200-M204 WeakPolarHBondContact O-CG 3.36Å; I200-M204 PolarHBondContact O-N 2.88Å; I200-F256 HydrophobicContact CB-CE1 4.39Å; I200-F256 HydrophobicContact CB-CZ 4.5Å; I200-F256 HydrophobicContact CD1-CE2 4.38Å; I200-F256 HydrophobicContact CD1-CZ 4Å; I200-F256 HydrophobicContact CG1-CE1 4.05Å; I200-F256 HydrophobicContact CG1-CE2 4.1Å; I200-F256 HydrophobicContact CG1-CZ 3.73Å; I200-F256 HydrophobicContact CG2-CE1 3.83Å; I200-F256 HydrophobicContact CG2-CZ 4.12Å
201A91.8Very high89.2Confident41 Ų4164.6 Ų64.634%0.33933%0.334SS..Hα-helixtrans-59.5-44.3178.800000111.9I197 A198 F199 M204 L205I197-A201 VanDerWaalsContact O-CB 3.22Å; I197-A201 WeakPolarHBondContact O-CB 3.17Å; I197-A201 PolarHBondContact O-N 3.26Å; A198-A201 PolarHBondContact O-N 3.48Å; F199-A201 PolarHBondContact O-N 2.96Å; A201-M204 PolarHBondContact O-N 3.45Å; A201-L205 WeakPolarHBondContact O-CB 3.18Å; A201-L205 WeakPolarHBondContact O-CD1 3.21Å; A201-L205 PolarHBondContact O-N 3.25Å
202I94.1Very high89.3Confident75 Ų7562.4 Ų62.439%0.38532%0.324SS..Hα-helixtrans-64.5-42.6177.7-71.7166000110.8A198 F199 I200 M204 L205 V206 G207 F246A198-I202 WeakPolarHBondContact O-CB 3.4Å; A198-I202 WeakPolarHBondContact O-CD1 3.37Å; A198-I202 VanDerWaalsContact O-CG1 3.23Å; A198-I202 WeakPolarHBondContact O-CG1 3.45Å; A198-I202 PolarHBondContact O-N 2.84Å; F199-I202 PolarHBondContact O-N 3.29Å; I200-I202 VanDerWaalsContact C-N 3.35Å; I200-I202 PolarHBondContact O-N 2.9Å; I202-M204 VanDerWaalsContact C-N 3.34Å; I202-M204 PolarHBondContact O-N 3.47Å; I202-L205 PolarHBondContact O-N 3.47Å; I202-V206 HydrophobicContact CG2-CB 4.26Å; I202-V206 HydrophobicContact CG2-CG2 4.21Å; I202-V206 WeakPolarHBondContact O-CA 3.29Å; I202-V206 VanDerWaalsContact O-CB 3.24Å; I202-V206 WeakPolarHBondContact O-CB 3.49Å; I202-V206 PolarHBondContact O-N 3.46Å; I202-G207 PolarHBondContact O-N 3.48Å; I202-G207 VanDerWaalsContact O-N 3.14Å; I202-F246 HydrophobicContact CD1-CE1 3.74Å; I202-F246 HydrophobicContact CD1-CZ 3.53Å
203M92.3Very high89.8Confident15 Ų1566.8 Ų66.87%0.07434%0.337CS..Iπ-helixtrans-63.5-40.5175.6-73.4-56.8-62.900112F199 I200 G207 R208 V238 F256 V260F199-M203 HydrophobicContact CD2-CG 4.16Å; F199-M203 HydrophobicContact CE1-CG 3.98Å; F199-M203 HydrophobicContact CE2-CG 3.59Å; F199-M203 HydrophobicContact CE2-SD 4.11Å; F199-M203 HydrophobicContact CZ-CG 3.46Å; F199-M203 VanDerWaalsContact CZ-CG 3.46Å; F199-M203 HydrophobicContact CZ-SD 4.2Å; F199-M203 WeakPolarHBondContact O-CB 3.4Å; F199-M203 WeakPolarHBondContact O-CG 3.34Å; F199-M203 PolarHBondContact O-N 3.13Å; I200-M203 PolarHBondContact O-N 3.24Å; M203-G207 CarbonylContact O-C 3.43Å; M203-G207 WeakPolarHBondContact O-CA 3.33Å; M203-G207 PolarHBondContact O-N 3.26Å; M203-R208 PolarHBondContact O-N 2.95Å; M203-V238 HydrophobicContact CE-CG1 3.67Å; M203-V238 HydrophobicContact CE-CG2 4.38Å; M203-V238 HydrophobicContact SD-CG1 3.69Å; M203-F256 HydrophobicContact CB-CB 4.39Å; M203-F256 HydrophobicContact CB-CD1 4.39Å; M203-F256 HydrophobicContact CE-CB 4.42Å; M203-F256 HydrophobicContact CG-CB 4.27Å; M203-V260 HydrophobicContact CE-CG2 4.16Å
204M89Confident90.2Very high66 Ų6665.8 Ų65.833%0.32533%0.332SS..Iπ-helixtrans-72.5-32.4179.4-65.6-59-72.700113.3I200 A201 I202 R208 F256I200-M204 HydrophobicContact CG2-CG 4.13Å; I200-M204 WeakPolarHBondContact O-CB 3.15Å; I200-M204 WeakPolarHBondContact O-CG 3.36Å; I200-M204 PolarHBondContact O-N 2.88Å; A201-M204 PolarHBondContact O-N 3.45Å; I202-M204 VanDerWaalsContact C-N 3.34Å; I202-M204 PolarHBondContact O-N 3.47Å; M204-R208 WeakPolarHBondContact O-CB 3.39Å; M204-F256 HydrophobicContact SD-CE1 4.5Å
205L92.3Very high90.1Very high134 Ų13464.2 Ų64.270%0.70232%0.316SS*.Iπ-helixtrans-90.8-54.4179.6-84.877.2000112.2A201 I202A201-L205 WeakPolarHBondContact O-CB 3.18Å; A201-L205 WeakPolarHBondContact O-CD1 3.21Å; A201-L205 PolarHBondContact O-N 3.25Å; I202-L205 PolarHBondContact O-N 3.47Å
206V92.3Very high89.9Confident77 Ų7763.6 Ų63.647%0.46732%0.323SS..Iπ-helixtrans-85.8-49.8-175.7-175.30000110.3I202 R208 R209 L210I202-V206 HydrophobicContact CG2-CB 4.26Å; I202-V206 HydrophobicContact CG2-CG2 4.21Å; I202-V206 WeakPolarHBondContact O-CA 3.29Å; I202-V206 VanDerWaalsContact O-CB 3.24Å; I202-V206 WeakPolarHBondContact O-CB 3.49Å; I202-V206 PolarHBondContact O-N 3.46Å; V206-R208 VanDerWaalsContact C-N 3.35Å; V206-R208 PolarHBondContact O-N 3.09Å; V206-R209 PolarHBondContact O-N 2.74Å; V206-R209 VanDerWaalsContact O-N 3.09Å; V206-L210 HydrophobicContact CG1-CB 4.36Å; V206-L210 HydrophobicContact CG1-CD2 4.38Å; V206-L210 VanDerWaalsContact O-CB 3.25Å; V206-L210 WeakPolarHBondContact O-CB 2.92Å; V206-L210 PolarHBondContact O-N 2.88Å
207G90.7Very high90Very high6 Ų670 Ų706%0.06235%0.346CS..Iπ-helixtrans-56.3-48.3-178.900000111.8I202 M203 R209 L210 V211 V260I202-G207 PolarHBondContact O-N 3.48Å; I202-G207 VanDerWaalsContact O-N 3.14Å; M203-G207 CarbonylContact O-C 3.43Å; M203-G207 WeakPolarHBondContact O-CA 3.33Å; M203-G207 PolarHBondContact O-N 3.26Å; G207-R209 PolarHBondContact O-N 2.85Å; G207-L210 PolarHBondContact O-N 3.44Å; G207-V211 VanDerWaalsContact O-CB 3.3Å; G207-V211 WeakPolarHBondContact O-CB 3.17Å; G207-V211 PolarHBondContact O-N 3.03Å; G207-V260 VanDerWaalsContact O-CG1 3.31Å; G207-V260 WeakPolarHBondContact O-CG1 2.97Å
208R88.6Confident89.9Confident145 Ų14565.5 Ų65.555%0.54732%0.324SS..Hα-helixtrans-52-27.9176.8-169.4176.9-175.3-163.8-3.3114.8M203 M204 V206 P212 E263M203-R208 PolarHBondContact O-N 2.95Å; M204-R208 WeakPolarHBondContact O-CB 3.39Å; V206-R208 VanDerWaalsContact C-N 3.35Å; V206-R208 PolarHBondContact O-N 3.09Å; R208-P212 VanDerWaalsContact O-CD 3.25Å; R208-P212 WeakPolarHBondContact O-CD 3.41Å; R208-P212 VanDerWaalsContact O-CG 3.28Å; R208-P212 WeakPolarHBondContact O-CG 3.47Å; R208-E263 WeakPolarHBondContact CD-OE2 3.48Å; R208-E263 IonicContact CZ-OE2 2.54Å; R208-E263 IonicContact NE-OE2 3.53Å; R208-E263 PolarHBondContact NE-OE2 2.78Å; R208-E263 IonicContact NH2-OE2 3.44Å
209R90.3Very high89.2Confident209 Ų20964.9 Ų64.979%0.78932%0.319SS*.Hα-helixtrans-99-41.9176.6-169.6173.8-178.2156.10.9112.6V206 G207 W213V206-R209 PolarHBondContact O-N 2.74Å; V206-R209 VanDerWaalsContact O-N 3.09Å; G207-R209 PolarHBondContact O-N 2.85Å; R209-W213 WeakPolarHBondContact O-CB 3.36Å; R209-W213 PolarHBondContact O-N 3.45Å
210L93Very high88.7Confident83 Ų8368.9 Ų68.944%0.43535%0.353SS..Hα-helixtrans-71.6-44.9-174.3-176.962.8000111.7V206 G207 W213 I214V206-L210 HydrophobicContact CG1-CB 4.36Å; V206-L210 HydrophobicContact CG1-CD2 4.38Å; V206-L210 VanDerWaalsContact O-CB 3.25Å; V206-L210 WeakPolarHBondContact O-CB 2.92Å; V206-L210 PolarHBondContact O-N 2.88Å; G207-L210 PolarHBondContact O-N 3.44Å; L210-W213 HydrophobicContact CD1-CE3 4.24Å; L210-W213 WeakPolarHBondContact O-CB 3.27Å; L210-W213 PolarHBondContact O-N 3.39Å; L210-I214 HydrophobicContact CD1-CD1 4.07Å; L210-I214 HydrophobicContact CD1-CG1 4.25Å; L210-I214 HydrophobicContact CG-CD1 3.88Å; L210-I214 HydrophobicContact CG-CG1 4.42Å; L210-I214 VanDerWaalsContact O-CG1 3.32Å; L210-I214 WeakPolarHBondContact O-CG1 3.49Å; L210-I214 PolarHBondContact O-N 2.8Å
211V91.3Very high88.4Confident5 Ų570.3 Ų70.33%0.0336%0.364CS..Hα-helixtrans-62.4-55.3-178164.90000110.9G207 W213 I214 M215 L234 V260 L261G207-V211 VanDerWaalsContact O-CB 3.3Å; G207-V211 WeakPolarHBondContact O-CB 3.17Å; G207-V211 PolarHBondContact O-N 3.03Å; V211-W213 PolarHBondContact O-N 2.87Å; V211-I214 PolarHBondContact O-N 3.25Å; V211-I214 VanDerWaalsContact O-N 3.16Å; V211-M215 HydrophobicContact CG1-CG 4.49Å; V211-M215 VanDerWaalsContact O-CG 3.29Å; V211-M215 WeakPolarHBondContact O-CG 3.46Å; V211-M215 PolarHBondContact O-N 3.07Å; V211-L234 HydrophobicContact CB-CD1 4.33Å; V211-L234 HydrophobicContact CG1-CD1 3.82Å; V211-L234 HydrophobicContact CG2-CD1 4.2Å; V211-L234 HydrophobicContact CG2-CD2 4.07Å; V211-V260 HydrophobicContact CB-CG1 3.7Å; V211-V260 HydrophobicContact CG1-CG1 4.08Å; V211-V260 HydrophobicContact CG2-CG1 3.85Å; V211-L261 HydrophobicContact CG1-CB 3.98Å; V211-L261 HydrophobicContact CG1-CD1 3.74Å; V211-L261 HydrophobicContact CG1-CG 4.42Å
212P84.8Confident87.8Confident35 Ų3571.5 Ų71.523%0.22738%0.381CS..Hα-helixtrans-59.9-32.7175.9-2636.7000113.3R208 M215 A216R208-P212 VanDerWaalsContact O-CD 3.25Å; R208-P212 WeakPolarHBondContact O-CD 3.41Å; R208-P212 VanDerWaalsContact O-CG 3.28Å; R208-P212 WeakPolarHBondContact O-CG 3.47Å; P212-M215 PolarHBondContact O-N 3.32Å; P212-A216 VanDerWaalsContact O-CB 3.29Å; P212-A216 WeakPolarHBondContact O-CB 3.33Å; P212-A216 PolarHBondContact O-N 3.04Å
213W89Confident87.2Confident129 Ų12969.9 Ų69.949%0.48938%0.376SS..Hα-helixtrans-66.6-43.2176.2178.293.3000112.7R209 L210 V211 M215 R217R209-W213 WeakPolarHBondContact O-CB 3.36Å; R209-W213 PolarHBondContact O-N 3.45Å; L210-W213 HydrophobicContact CD1-CE3 4.24Å; L210-W213 WeakPolarHBondContact O-CB 3.27Å; L210-W213 PolarHBondContact O-N 3.39Å; V211-W213 PolarHBondContact O-N 2.87Å; W213-M215 VanDerWaalsContact C-N 3.34Å; W213-R217 VanDerWaalsContact CE2-CZ 3.42Å; W213-R217 VanDerWaalsContact CZ2-CZ 3.42Å; W213-R217 VanDerWaalsContact NE1-NH1 3.12Å; W213-R217 WeakPolarHBondContact O-CB 3.28Å; W213-R217 PolarHBondContact O-N 2.88Å
214I91.2Very high86.8Confident50 Ų5079.4 Ų79.426%0.25641%0.411SS..Hα-helixtrans-62.1-45.6174.6-68.3171.6000109.3L210 V211 R217 S218 L234L210-I214 HydrophobicContact CD1-CD1 4.07Å; L210-I214 HydrophobicContact CD1-CG1 4.25Å; L210-I214 HydrophobicContact CG-CD1 3.88Å; L210-I214 HydrophobicContact CG-CG1 4.42Å; L210-I214 VanDerWaalsContact O-CG1 3.32Å; L210-I214 WeakPolarHBondContact O-CG1 3.49Å; L210-I214 PolarHBondContact O-N 2.8Å; V211-I214 PolarHBondContact O-N 3.25Å; V211-I214 VanDerWaalsContact O-N 3.16Å; I214-R217 PolarHBondContact O-N 3.05Å; I214-S218 PolarHBondContact O-N 3.34Å; I214-S218 PolarHBondContact O-OG 2.96Å; I214-L234 HydrophobicContact CD1-CD2 3.92Å; I214-L234 HydrophobicContact CG2-CD1 4.48Å
215M86.4Confident86.6Confident0 Ų084 Ų840%043%0.432CS..Hα-helixtrans-62.7-44.9178.6-64-64.388.900113.1V211 P212 W213 R217 S218 A219 F227 S230 V231 L234 L261 L266V211-M215 HydrophobicContact CG1-CG 4.49Å; V211-M215 VanDerWaalsContact O-CG 3.29Å; V211-M215 WeakPolarHBondContact O-CG 3.46Å; V211-M215 PolarHBondContact O-N 3.07Å; P212-M215 PolarHBondContact O-N 3.32Å; W213-M215 VanDerWaalsContact C-N 3.34Å; M215-R217 VanDerWaalsContact C-N 3.29Å; M215-R217 PolarHBondContact O-N 3.2Å; M215-S218 PolarHBondContact O-N 3.44Å; M215-S218 PolarHBondContact O-OG 2.99Å; M215-S218 VanDerWaalsContact O-OG 3.07Å; M215-A219 WeakPolarHBondContact O-CB 3.36Å; M215-A219 PolarHBondContact O-N 3.18Å; M215-F227 HydrophobicContact CB-CE2 4.47Å; M215-F227 HydrophobicContact SD-CE2 4.11Å; M215-F227 HydrophobicContact SD-CZ 4.34Å; M215-S230 WeakPolarHBondContact CE-OG 3.28Å; M215-V231 HydrophobicContact CE-CG2 4.42Å; M215-V231 HydrophobicContact SD-CG2 3.77Å; M215-L234 HydrophobicContact CE-CD1 3.38Å; M215-L234 HydrophobicContact CE-CG 4.34Å; M215-L234 HydrophobicContact CG-CD1 4.42Å; M215-L234 HydrophobicContact SD-CD1 4.14Å; M215-L261 HydrophobicContact CG-CD1 3.43Å; M215-L261 VanDerWaalsContact CG-CD1 3.43Å; M215-L261 HydrophobicContact SD-CD1 3.87Å; M215-L261 HydrophobicContact SD-CD2 4.37Å; M215-L266 HydrophobicContact CB-CD1 3.81Å
216A82.8Confident86.5Confident56 Ų5681.7 Ų81.746%0.46342%0.42SS..Hα-helixtrans-63.3-38.4177.900000111.2P212 A220P212-A216 VanDerWaalsContact O-CB 3.29Å; P212-A216 WeakPolarHBondContact O-CB 3.33Å; P212-A216 PolarHBondContact O-N 3.04Å; A216-A220 VanDerWaalsContact O-CB 3.26Å; A216-A220 WeakPolarHBondContact O-CB 3.49Å; A216-A220 PolarHBondContact O-N 3.23Å
217R87.8Confident86.2Confident147 Ų14778.2 Ų78.256%0.55540%0.398SS*.Hα-helixtrans-70.7-42.9176-96.8147159.183.4-4.5113.2W213 I214 M215 A219 A220 T221W213-R217 VanDerWaalsContact CE2-CZ 3.42Å; W213-R217 VanDerWaalsContact CZ2-CZ 3.42Å; W213-R217 VanDerWaalsContact NE1-NH1 3.12Å; W213-R217 WeakPolarHBondContact O-CB 3.28Å; W213-R217 PolarHBondContact O-N 2.88Å; I214-R217 PolarHBondContact O-N 3.05Å; M215-R217 VanDerWaalsContact C-N 3.29Å; M215-R217 PolarHBondContact O-N 3.2Å; R217-A219 VanDerWaalsContact C-N 3.35Å; R217-A220 PolarHBondContact O-N 2.98Å; R217-T221 WeakPolarHBondContact O-CG2 3.44Å; R217-T221 PolarHBondContact O-N 3.28Å
218S86.1Confident86.2Confident11 Ų1179.5 Ų79.58%0.07741%0.405CS..Hα-helixtrans-65.5-41.7175.964.30000110.6I214 M215 A220 T221 F227 S230I214-S218 PolarHBondContact O-N 3.34Å; I214-S218 PolarHBondContact O-OG 2.96Å; M215-S218 PolarHBondContact O-N 3.44Å; M215-S218 PolarHBondContact O-OG 2.99Å; M215-S218 VanDerWaalsContact O-OG 3.07Å; S218-A220 VanDerWaalsContact C-N 3.34Å; S218-A220 PolarHBondContact O-N 3.22Å; S218-T221 WeakPolarHBondContact O-CB 3.25Å; S218-T221 PolarHBondContact O-N 2.87Å; S218-T221 VanDerWaalsContact O-N 3.16Å; S218-T221 PolarHBondContact O-OG1 2.75Å; S218-F227 WeakPolarHBondContact OG-CD2 3.15Å; S218-S230 WeakPolarHBondContact CB-OG 3.47Å; S218-S230 PolarHBondContact OG-OG 3.41Å
219A78.3Confident86.4Confident27 Ų2777.7 Ų77.722%0.22341%0.406CS..Hα-helixtrans-61.9-38.6173.800000112.7M215 R217 T221 G222 F227 L266M215-A219 WeakPolarHBondContact O-CB 3.36Å; M215-A219 PolarHBondContact O-N 3.18Å; R217-A219 VanDerWaalsContact C-N 3.35Å; A219-T221 PolarHBondContact O-N 3.19Å; A219-G222 PolarHBondContact O-N 3.13Å; A219-F227 HydrophobicContact CB-CD2 4.09Å; A219-F227 HydrophobicContact CB-CE2 4.31Å; A219-L266 HydrophobicContact CB-CD1 3.86Å; A219-L266 HydrophobicContact CB-CD2 4.43Å
220A81.5Confident86.5Confident88 Ų8868.4 Ų68.473%0.72737%0.373SS*.Hα-helixtrans-65.3-18.7177.300000113.7A216 R217 S218 G222A216-A220 VanDerWaalsContact O-CB 3.26Å; A216-A220 WeakPolarHBondContact O-CB 3.49Å; A216-A220 PolarHBondContact O-N 3.23Å; R217-A220 PolarHBondContact O-N 2.98Å; S218-A220 VanDerWaalsContact C-N 3.34Å; S218-A220 PolarHBondContact O-N 3.22Å; A220-G222 PolarHBondContact O-N 2.92Å
221T83.2Confident86.5Confident77 Ų7764.5 Ų64.547%0.47235%0.352SS..THydrogen-bonded Turntrans-70.8-18.5172.371.60000113R217 S218 A219 S223 L226R217-T221 WeakPolarHBondContact O-CG2 3.44Å; R217-T221 PolarHBondContact O-N 3.28Å; S218-T221 WeakPolarHBondContact O-CB 3.25Å; S218-T221 PolarHBondContact O-N 2.87Å; S218-T221 VanDerWaalsContact O-N 3.16Å; S218-T221 PolarHBondContact O-OG1 2.75Å; A219-T221 PolarHBondContact O-N 3.19Å; T221-S223 PolarHBondContact O-N 3.44Å; T221-S223 VanDerWaalsContact O-N 3.16Å; T221-S223 PolarHBondContact OG1-N 3.24Å; T221-L226 HydrophobicContact CG2-CD1 4.17Å
222G78.3Confident86.6Confident67 Ų6765.7 Ų65.769%0.69136%0.358SS*.  trans71.4-5.6-172.800000114.9A219 A220 R224A219-G222 PolarHBondContact O-N 3.13Å; A220-G222 PolarHBondContact O-N 2.92Å; G222-R224 PolarHBondContact O-N 3.49Å
223S82.6Confident87.1Confident41 Ų4166.8 Ų66.829%0.28737%0.371SS..  trans-82.3115.9179174.90000110.9T221 E225 L226 F227T221-S223 PolarHBondContact O-N 3.44Å; T221-S223 VanDerWaalsContact O-N 3.16Å; T221-S223 PolarHBondContact OG1-N 3.24Å; S223-E225 VanDerWaalsContact C-N 3.27Å; S223-E225 PolarHBondContact O-N 3.5Å; S223-E225 PolarHBondContact OG-N 2.88Å; S223-L226 PolarHBondContact O-N 3.35Å; S223-L226 PolarHBondContact OG-N 2.83Å; S223-F227 PolarHBondContact O-N 2.74Å; S223-F227 VanDerWaalsContact O-N 3.08Å
224R83.1Confident87.3Confident214 Ų21461.6 Ų61.681%0.80835%0.352SS*.Hα-helixtrans-59.4-40.8173-66.8-175.1-179.1-169.5-0.2111.1G222 F227 T228G222-R224 PolarHBondContact O-N 3.49Å; R224-F227 WeakPolarHBondContact O-CB 3.22Å; R224-F227 PolarHBondContact O-N 3.22Å; R224-T228 PolarHBondContact O-N 2.82Å; R224-T228 PolarHBondContact O-OG1 3.44Å
225E85.8Confident87.5Confident162 Ų16259.2 Ų59.276%0.75734%0.34SS*.Hα-helixtrans-62.5-45.5179.7-63.5176.7-168.500112.3S223 F227 T228 L229S223-E225 VanDerWaalsContact C-N 3.27Å; S223-E225 PolarHBondContact O-N 3.5Å; S223-E225 PolarHBondContact OG-N 2.88Å; E225-F227 VanDerWaalsContact C-N 3.3Å; E225-F227 PolarHBondContact O-N 3.39Å; E225-T228 PolarHBondContact O-N 3.04Å; E225-L229 VanDerWaalsContact O-CB 3.23Å; E225-L229 WeakPolarHBondContact O-CB 3.35Å; E225-L229 PolarHBondContact O-N 2.83Å
226L88.6Confident87.9Confident87 Ų8762.1 Ų62.146%0.45536%0.355SS..Hα-helixtrans-66.3-35.4177-69.2-179.9000111.6T221 S223 S230T221-L226 HydrophobicContact CG2-CD1 4.17Å; S223-L226 PolarHBondContact O-N 3.35Å; S223-L226 PolarHBondContact OG-N 2.83Å; L226-S230 VanDerWaalsContact O-CB 3.25Å; L226-S230 WeakPolarHBondContact O-CB 3.26Å; L226-S230 PolarHBondContact O-N 3.48Å; L226-S230 PolarHBondContact O-OG 3.18Å
227F87.7Confident88.5Confident3 Ų361.3 Ų61.31%0.01335%0.353CS..Hα-helixtrans-63.6-54.7174.1-174.9-93.7000110.7M215 S218 A219 S223 R224 E225 L229 S230 V231 L266 R269 A270 D273M215-F227 HydrophobicContact CB-CE2 4.47Å; M215-F227 HydrophobicContact SD-CE2 4.11Å; M215-F227 HydrophobicContact SD-CZ 4.34Å; S218-F227 WeakPolarHBondContact OG-CD2 3.15Å; A219-F227 HydrophobicContact CB-CD2 4.09Å; A219-F227 HydrophobicContact CB-CE2 4.31Å; S223-F227 PolarHBondContact O-N 2.74Å; S223-F227 VanDerWaalsContact O-N 3.08Å; R224-F227 WeakPolarHBondContact O-CB 3.22Å; R224-F227 PolarHBondContact O-N 3.22Å; E225-F227 VanDerWaalsContact C-N 3.3Å; E225-F227 PolarHBondContact O-N 3.39Å; F227-L229 VanDerWaalsContact C-N 3.32Å; F227-L229 PolarHBondContact O-N 3.43Å; F227-S230 WeakPolarHBondContact CA-OG 3.42Å; F227-S230 PolarHBondContact O-N 2.92Å; F227-S230 PolarHBondContact O-OG 3.44Å; F227-V231 HydrophobicContact CD1-CG2 4.26Å; F227-V231 HydrophobicContact CE1-CG2 3.87Å; F227-V231 HydrophobicContact CZ-CG2 4.15Å; F227-V231 WeakPolarHBondContact O-CG2 3.39Å; F227-V231 PolarHBondContact O-N 2.97Å; F227-L266 HydrophobicContact CE2-CB 4.31Å; F227-L266 HydrophobicContact CE2-CD1 4.17Å; F227-L266 HydrophobicContact CZ-CB 4.22Å; F227-R269 HydrophobicContact CD1-CG 4.1Å; F227-R269 HydrophobicContact CE1-CB 3.98Å; F227-R269 HydrophobicContact CE1-CG 3.54Å; F227-R269 HydrophobicContact CZ-CB 4.12Å; F227-R269 HydrophobicContact CZ-CG 4.08Å; F227-A270 HydrophobicContact CE1-CB 4.3Å; F227-A270 HydrophobicContact CZ-CB 4.2Å; F227-D273 WeakPolarHBondContact CD1-OD2 3.23Å
228T89.8Confident88.8Confident34 Ų3455.6 Ų55.621%0.20933%0.334CS..Hα-helixtrans-56.7-45.4177.4-50.40000111.8R224 E225 S230 V231 L232 D273R224-T228 PolarHBondContact O-N 2.82Å; R224-T228 PolarHBondContact O-OG1 3.44Å; E225-T228 PolarHBondContact O-N 3.04Å; T228-S230 VanDerWaalsContact C-N 3.31Å; T228-S230 PolarHBondContact O-N 2.87Å; T228-V231 PolarHBondContact O-N 3.39Å; T228-L232 HydrophobicContact CG2-CD1 4.35Å; T228-L232 WeakPolarHBondContact O-CG 3.26Å; T228-L232 PolarHBondContact O-N 2.91Å; T228-D273 HydrophobicContact CG2-CB 4.29Å
229L92.4Very high89.2Confident106 Ų10655 Ų5556%0.55533%0.33SS*.Hα-helixtrans-60.6-40.7176.5-178.163.7000111.6E225 F227 V231 L232 A233E225-L229 VanDerWaalsContact O-CB 3.23Å; E225-L229 WeakPolarHBondContact O-CB 3.35Å; E225-L229 PolarHBondContact O-N 2.83Å; F227-L229 VanDerWaalsContact C-N 3.32Å; F227-L229 PolarHBondContact O-N 3.43Å; L229-V231 VanDerWaalsContact C-N 3.33Å; L229-V231 PolarHBondContact O-N 3.44Å; L229-L232 PolarHBondContact O-N 2.92Å; L229-A233 WeakPolarHBondContact O-CB 3.32Å; L229-A233 PolarHBondContact O-N 3.36Å
230S92.9Very high89.9Confident15 Ų1559.5 Ų59.511%0.10535%0.345CS..Hα-helixtrans-64.7-37.2177.669.30000112.3M215 S218 L226 F227 T228 L234M215-S230 WeakPolarHBondContact CE-OG 3.28Å; S218-S230 WeakPolarHBondContact CB-OG 3.47Å; S218-S230 PolarHBondContact OG-OG 3.41Å; L226-S230 VanDerWaalsContact O-CB 3.25Å; L226-S230 WeakPolarHBondContact O-CB 3.26Å; L226-S230 PolarHBondContact O-N 3.48Å; L226-S230 PolarHBondContact O-OG 3.18Å; F227-S230 WeakPolarHBondContact CA-OG 3.42Å; F227-S230 PolarHBondContact O-N 2.92Å; F227-S230 PolarHBondContact O-OG 3.44Å; T228-S230 VanDerWaalsContact C-N 3.31Å; T228-S230 PolarHBondContact O-N 2.87Å; S230-L234 WeakPolarHBondContact O-CB 3.33Å; S230-L234 VanDerWaalsContact O-CG 3.27Å; S230-L234 WeakPolarHBondContact O-CG 3.43Å; S230-L234 PolarHBondContact O-N 3.26Å
231V92.9Very high90.5Very high0 Ų056.2 Ų56.20%032%0.32CS..Hα-helixtrans-66.4-46.4176.1-175.10000110.5F70 M215 F227 T228 L229 L234 A235 L261 A270 T274F70-V231 HydrophobicContact CE1-CG1 3.67Å; F70-V231 HydrophobicContact CZ-CG1 3.56Å; M215-V231 HydrophobicContact CE-CG2 4.42Å; M215-V231 HydrophobicContact SD-CG2 3.77Å; F227-V231 HydrophobicContact CD1-CG2 4.26Å; F227-V231 HydrophobicContact CE1-CG2 3.87Å; F227-V231 HydrophobicContact CZ-CG2 4.15Å; F227-V231 WeakPolarHBondContact O-CG2 3.39Å; F227-V231 PolarHBondContact O-N 2.97Å; T228-V231 PolarHBondContact O-N 3.39Å; L229-V231 VanDerWaalsContact C-N 3.33Å; L229-V231 PolarHBondContact O-N 3.44Å; V231-L234 PolarHBondContact O-N 3.15Å; V231-A235 PolarHBondContact O-N 3.17Å; V231-L261 HydrophobicContact CG1-CD2 4.01Å; V231-A270 HydrophobicContact CG1-CB 3.94Å; V231-A270 HydrophobicContact CG2-CB 3.66Å; V231-T274 HydrophobicContact CB-CG2 3.97Å; V231-T274 HydrophobicContact CG1-CG2 3.31Å
232L93.5Very high90.9Very high30 Ų3052.6 Ų52.616%0.15730%0.297CS..Hα-helixtrans-64.3-43.1177.2-66.9170.4000112.4L67 T228 L229 L234 A235 L236 T274 L277L67-L232 HydrophobicContact CD2-CD2 3.85Å; T228-L232 HydrophobicContact CG2-CD1 4.35Å; T228-L232 WeakPolarHBondContact O-CG 3.26Å; T228-L232 PolarHBondContact O-N 2.91Å; L229-L232 PolarHBondContact O-N 2.92Å; L232-L234 VanDerWaalsContact C-N 3.26Å; L232-L234 PolarHBondContact O-N 3.34Å; L232-A235 PolarHBondContact O-N 2.92Å; L232-L236 WeakPolarHBondContact O-CB 3.48Å; L232-L236 WeakPolarHBondContact O-CG 3.37Å; L232-L236 PolarHBondContact O-N 3.22Å; L232-T274 HydrophobicContact CD2-CG2 4.26Å; L232-L277 HydrophobicContact CD1-CD1 3.37Å; L232-L277 HydrophobicContact CD2-CD1 3.66Å; L232-L277 HydrophobicContact CG-CD1 4.02Å
233A94.5Very high91.5Very high59 Ų5951.1 Ų51.149%0.48828%0.275SS..Hα-helixtrans-62.5-35.8177.200000111.3L229 G237L229-A233 WeakPolarHBondContact O-CB 3.32Å; L229-A233 PolarHBondContact O-N 3.36Å; A233-G237 WeakPolarHBondContact O-CA 3.38Å; A233-G237 PolarHBondContact O-N 3.37Å
234L94.4Very high91.9Very high19 Ų1955.1 Ų55.110%0.09929%0.289CS..Hα-helixtrans-68.5-49.1172.1-76.9178.8000112V211 I214 M215 S230 V231 L232 V238V211-L234 HydrophobicContact CB-CD1 4.33Å; V211-L234 HydrophobicContact CG1-CD1 3.82Å; V211-L234 HydrophobicContact CG2-CD1 4.2Å; V211-L234 HydrophobicContact CG2-CD2 4.07Å; I214-L234 HydrophobicContact CD1-CD2 3.92Å; I214-L234 HydrophobicContact CG2-CD1 4.48Å; M215-L234 HydrophobicContact CE-CD1 3.38Å; M215-L234 HydrophobicContact CE-CG 4.34Å; M215-L234 HydrophobicContact CG-CD1 4.42Å; M215-L234 HydrophobicContact SD-CD1 4.14Å; S230-L234 WeakPolarHBondContact O-CB 3.33Å; S230-L234 VanDerWaalsContact O-CG 3.27Å; S230-L234 WeakPolarHBondContact O-CG 3.43Å; S230-L234 PolarHBondContact O-N 3.26Å; V231-L234 PolarHBondContact O-N 3.15Å; L232-L234 VanDerWaalsContact C-N 3.26Å; L232-L234 PolarHBondContact O-N 3.34Å; L234-V238 VanDerWaalsContact O-CB 3.22Å; L234-V238 WeakPolarHBondContact O-CB 3.39Å; L234-V238 WeakPolarHBondContact O-CG2 3.35Å; L234-V238 PolarHBondContact O-N 3.01Å
235A93.9Very high92.3Very high0 Ų051.1 Ų51.10%028%0.283CS..Hα-helixtrans-59-53.3-179.300000111.7F70 V231 L232 A239F70-A235 HydrophobicContact CB-CB 4.08Å; F70-A235 HydrophobicContact CD1-CB 3.91Å; F70-A235 HydrophobicContact CD2-CB 3.52Å; F70-A235 HydrophobicContact CE1-CB 4.18Å; F70-A235 HydrophobicContact CE2-CB 3.83Å; F70-A235 HydrophobicContact CG-CB 3.55Å; F70-A235 HydrophobicContact CZ-CB 4.13Å; V231-A235 PolarHBondContact O-N 3.17Å; L232-A235 PolarHBondContact O-N 2.92Å; A235-A239 VanDerWaalsContact O-CB 3.24Å; A235-A239 WeakPolarHBondContact O-CB 3.24Å; A235-A239 PolarHBondContact O-N 3.31Å
236L94.8Very high92.4Very high61 Ų6145.2 Ų45.232%0.31926%0.255SS..Hα-helixtrans-72.8-41.6-179.1-62.6170.7000111.8L63 I66 L232 A239 F240L63-L236 HydrophobicContact CD2-CD2 3.73Å; I66-L236 HydrophobicContact CB-CD2 4.34Å; I66-L236 HydrophobicContact CD1-CD2 4.34Å; I66-L236 HydrophobicContact CG2-CD2 3.74Å; L232-L236 WeakPolarHBondContact O-CB 3.48Å; L232-L236 WeakPolarHBondContact O-CG 3.37Å; L232-L236 PolarHBondContact O-N 3.22Å; L236-A239 PolarHBondContact O-N 2.92Å; L236-F240 VanDerWaalsContact O-CB 3.31Å; L236-F240 WeakPolarHBondContact O-CB 3.48Å; L236-F240 PolarHBondContact O-N 2.84Å
237G95.5Very high92.1Very high40 Ų4046.4 Ų46.441%0.41226%0.261SS..Hα-helixtrans-69.1-40.2-177.200000113.2A233 G241A233-G237 WeakPolarHBondContact O-CA 3.38Å; A233-G237 PolarHBondContact O-N 3.37Å; G237-G241 PolarHBondContact O-N 3.07Å
238V95.1Very high91.9Very high26 Ų2646.3 Ų46.316%0.15826%0.261CS..Hα-helixtrans-70-40.3173.7176.10000110.6F199 M203 L234 G241 A242 G253 A257F199-V238 HydrophobicContact CE2-CG1 4.34Å; F199-V238 HydrophobicContact CZ-CG1 4.23Å; M203-V238 HydrophobicContact CE-CG1 3.67Å; M203-V238 HydrophobicContact CE-CG2 4.38Å; M203-V238 HydrophobicContact SD-CG1 3.69Å; L234-V238 VanDerWaalsContact O-CB 3.22Å; L234-V238 WeakPolarHBondContact O-CB 3.39Å; L234-V238 WeakPolarHBondContact O-CG2 3.35Å; L234-V238 PolarHBondContact O-N 3.01Å; V238-G241 PolarHBondContact O-N 3.42Å; V238-A242 WeakPolarHBondContact O-CB 3.47Å; V238-A242 PolarHBondContact O-N 3.41Å; V238-G253 WeakPolarHBondContact CG1-O 2.98Å; V238-A257 HydrophobicContact CB-CB 3.8Å; V238-A257 HydrophobicContact CG1-CB 3.86Å; V238-A257 HydrophobicContact CG2-CB 4.15Å
239A93.6Very high91.6Very high0 Ų046.2 Ų46.20%026%0.262CS..Hα-helixtrans-59.6-47.4175.400000112I66 A235 L236 A242 V243 F250 A254I66-A239 HydrophobicContact CD1-CB 4.17Å; I66-A239 HydrophobicContact CG1-CB 3.99Å; I66-A239 HydrophobicContact CG2-CB 3.76Å; A235-A239 VanDerWaalsContact O-CB 3.24Å; A235-A239 WeakPolarHBondContact O-CB 3.24Å; A235-A239 PolarHBondContact O-N 3.31Å; L236-A239 PolarHBondContact O-N 2.92Å; A239-A242 WeakPolarHBondContact O-CB 3.43Å; A239-A242 PolarHBondContact O-N 3.26Å; A239-V243 PolarHBondContact O-N 3.03Å; A239-F250 HydrophobicContact CB-CD1 4.26Å; A239-A254 HydrophobicContact CB-CB 4.1Å
240F94.6Very high91.4Very high121 Ų12143.9 Ų43.953%0.53125%0.248SC..Hα-helixtrans-64.7-44.1176.5-176.3-101.1000112.3L236 A242 V243 E244 F250L236-F240 VanDerWaalsContact O-CB 3.31Å; L236-F240 WeakPolarHBondContact O-CB 3.48Å; L236-F240 PolarHBondContact O-N 2.84Å; F240-A242 VanDerWaalsContact C-N 3.26Å; F240-A242 PolarHBondContact O-N 2.84Å; F240-V243 PolarHBondContact O-N 3.47Å; F240-E244 HydrophobicContact CD1-CG 4.17Å; F240-E244 HydrophobicContact CD2-CG 4.37Å; F240-E244 HydrophobicContact CE1-CG 3.67Å; F240-E244 HydrophobicContact CE2-CG 3.88Å; F240-E244 HydrophobicContact CZ-CG 3.5Å; F240-E244 VanDerWaalsContact CZ-CG 3.5Å; F240-E244 PolarHBondContact O-N 3.2Å; F240-F250 HydrophobicContact CD2-CE1 4.2Å
241G94.1Very high90.9Very high19 Ų1943.4 Ų43.420%0.19625%0.245CC..Hα-helixtrans-62.5-31175.500000113.5G237 V238 L245G237-G241 PolarHBondContact O-N 3.07Å; V238-G241 PolarHBondContact O-N 3.42Å; G241-L245 WeakPolarHBondContact O-CB 3.43Å; G241-L245 WeakPolarHBondContact O-CG 3.35Å; G241-L245 PolarHBondContact O-N 3.04Å
242A91.7Very high90.5Very high0 Ų043.5 Ų43.50%025%0.245CC..Hα-helixtrans-65.3-44175.700000111.7F199 V238 A239 F240 F246 D247 V248F199-A242 HydrophobicContact CD2-CB 4.15Å; F199-A242 HydrophobicContact CE2-CB 3.66Å; F199-A242 HydrophobicContact CZ-CB 3.91Å; V238-A242 WeakPolarHBondContact O-CB 3.47Å; V238-A242 PolarHBondContact O-N 3.41Å; A239-A242 WeakPolarHBondContact O-CB 3.43Å; A239-A242 PolarHBondContact O-N 3.26Å; F240-A242 VanDerWaalsContact C-N 3.26Å; F240-A242 PolarHBondContact O-N 2.84Å; A242-F246 CarbonylContact O-C 3.58Å; A242-F246 WeakPolarHBondContact O-CA 3.45Å; A242-F246 WeakPolarHBondContact O-CB 3.29Å; A242-F246 PolarHBondContact O-N 2.81Å; A242-F246 VanDerWaalsContact O-N 3.14Å; A242-D247 PolarHBondContact O-N 3.47Å; A242-V248 CarbonylContact C-O 3.54Å; A242-V248 HydrophobicContact CB-CB 4.12Å; A242-V248 HydrophobicContact CB-CG1 3.96Å; A242-V248 WeakPolarHBondContact O-CB 3.49Å; A242-V248 PolarHBondContact O-N 2.98Å
243V89.9Confident90.3Very high37 Ų3742 Ų4222%0.22424%0.237CC..Hα-helixtrans-66.3-56.2176.6176.80000110.7A239 F240 L245 D247 V248 F250A239-V243 PolarHBondContact O-N 3.03Å; F240-V243 PolarHBondContact O-N 3.47Å; V243-L245 PolarHBondContact O-N 3.39Å; V243-D247 VanDerWaalsContact O-CA 3.27Å; V243-D247 WeakPolarHBondContact O-CA 3.41Å; V243-D247 PolarHBondContact O-N 3.28Å; V243-V248 WeakPolarHBondContact CA-O 3.2Å; V243-V248 WeakPolarHBondContact CG2-O 3.24Å; V243-V248 PolarHBondContact N-O 3.42Å; V243-F250 HydrophobicContact CB-CD1 4.41Å; V243-F250 HydrophobicContact CB-CE1 4.11Å; V243-F250 HydrophobicContact CB-CZ 4.38Å; V243-F250 HydrophobicContact CG1-CZ 4.47Å; V243-F250 HydrophobicContact CG2-CB 4.38Å; V243-F250 HydrophobicContact CG2-CD1 3.44Å; V243-F250 VanDerWaalsContact CG2-CD1 3.44Å; V243-F250 HydrophobicContact CG2-CD2 3.98Å; V243-F250 HydrophobicContact CG2-CE1 3.56Å; V243-F250 HydrophobicContact CG2-CE2 4.09Å; V243-F250 HydrophobicContact CG2-CG 3.65Å; V243-F250 HydrophobicContact CG2-CZ 3.88Å
244E91.8Very high90.1Very high125 Ų12539.2 Ų39.258%0.58421%0.214SC*.Hα-helixtrans-69.3-32.8-171.2-70.5-68.3149.300114.2F240F240-E244 HydrophobicContact CD1-CG 4.17Å; F240-E244 HydrophobicContact CD2-CG 4.37Å; F240-E244 HydrophobicContact CE1-CG 3.67Å; F240-E244 HydrophobicContact CE2-CG 3.88Å; F240-E244 HydrophobicContact CZ-CG 3.5Å; F240-E244 VanDerWaalsContact CZ-CG 3.5Å; F240-E244 PolarHBondContact O-N 3.2Å
245L90.6Very high89.8Confident129 Ų12938.4 Ų38.468%0.67521%0.21SC*.Hα-helixtrans-100.3-28.3-174.3-57174.8000113.4G241 V243G241-L245 WeakPolarHBondContact O-CB 3.43Å; G241-L245 WeakPolarHBondContact O-CG 3.35Å; G241-L245 PolarHBondContact O-N 3.04Å; V243-L245 PolarHBondContact O-N 3.39Å
246F88Confident89.6Confident38 Ų3839 Ų3917%0.16721%0.213CC..Hα-helixtrans-122.5-1.3-172.3-58.7-88.4000113.6K195 A198 F199 I202 A242 V248K195-F246 HydrophobicContact CB-CB 4.47Å; K195-F246 WeakPolarHBondContact CB-O 3.14Å; K195-F246 WeakPolarHBondContact CD-O 3.43Å; K195-F246 WeakPolarHBondContact O-CD1 3.09Å; A198-F246 HydrophobicContact CB-CD1 4.46Å; A198-F246 HydrophobicContact CB-CE1 4.22Å; F199-F246 HydrophobicContact CB-CB 4.08Å; F199-F246 HydrophobicContact CB-CD1 3.79Å; F199-F246 HydrophobicContact CB-CD2 4.15Å; F199-F246 HydrophobicContact CB-CE1 4.27Å; F199-F246 HydrophobicContact CB-CG 3.74Å; F199-F246 AromaticContact CD2-CD2 3.68Å; F199-F246 HydrophobicContact CD2-CD2 3.68Å; F199-F246 AromaticContact CD2-CE2 3.95Å; F199-F246 HydrophobicContact CD2-CE2 3.95Å; F199-F246 HydrophobicContact CD2-CG 4.13Å; F199-F246 HydrophobicContact CG-CD2 4.35Å; F199-F246 HydrophobicContact CG-CG 4.35Å; I202-F246 HydrophobicContact CD1-CE1 3.74Å; I202-F246 HydrophobicContact CD1-CZ 3.53Å; A242-F246 CarbonylContact O-C 3.58Å; A242-F246 WeakPolarHBondContact O-CA 3.45Å; A242-F246 WeakPolarHBondContact O-CB 3.29Å; A242-F246 PolarHBondContact O-N 2.81Å; A242-F246 VanDerWaalsContact O-N 3.14Å; F246-V248 HydrophobicContact CB-CB 4.19Å; F246-V248 HydrophobicContact CB-CG2 3.74Å; F246-V248 PolarHBondContact O-N 2.91Å
247D82.9Confident89.5Confident112 Ų11236.3 Ų36.360%0.59920%0.199SC*.  trans53.133.6-171.7-57.7-57.1000112.3K195 A242 V243K195-D247 IonicContact NZ-OD2 2.72Å; K195-D247 PolarHBondContact NZ-OD2 3.37Å; A242-D247 PolarHBondContact O-N 3.47Å; V243-D247 VanDerWaalsContact O-CA 3.27Å; V243-D247 WeakPolarHBondContact O-CA 3.41Å; V243-D247 PolarHBondContact O-N 3.28Å
248V83Confident89.3Confident2 Ų234.4 Ų34.41%0.01218%0.179CC..  trans-99143.4-179.11630000109.4V196 F199 A242 V243 F246 L252V196-V248 HydrophobicContact CG2-CG2 3.95Å; F199-V248 HydrophobicContact CB-CG2 4.36Å; F199-V248 HydrophobicContact CD1-CG1 4.32Å; A242-V248 CarbonylContact C-O 3.54Å; A242-V248 HydrophobicContact CB-CB 4.12Å; A242-V248 HydrophobicContact CB-CG1 3.96Å; A242-V248 WeakPolarHBondContact O-CB 3.49Å; A242-V248 PolarHBondContact O-N 2.98Å; V243-V248 WeakPolarHBondContact CA-O 3.2Å; V243-V248 WeakPolarHBondContact CG2-O 3.24Å; V243-V248 PolarHBondContact N-O 3.42Å; F246-V248 HydrophobicContact CB-CB 4.19Å; F246-V248 HydrophobicContact CB-CG2 3.74Å; F246-V248 PolarHBondContact O-N 2.91Å; V248-L252 HydrophobicContact CB-CD2 4.37Å; V248-L252 HydrophobicContact CG1-CB 3.53Å; V248-L252 HydrophobicContact CG1-CD2 3.23Å; V248-L252 HydrophobicContact CG1-CG 3.5Å; V248-L252 HydrophobicContact CG2-CD2 4.24Å
249S83.6Confident88.9Confident32 Ų3233.9 Ų33.922%0.22418%0.175CC..  trans-58.5148.4-179.971.40000113.6A251 L252 G253S249-A251 PolarHBondContact O-N 3.16Å; S249-L252 PolarHBondContact O-N 3.43Å; S249-L252 VanDerWaalsContact O-N 3.13Å; S249-L252 PolarHBondContact OG-N 2.89Å; S249-G253 PolarHBondContact O-N 3.42Å; S249-G253 VanDerWaalsContact O-N 3.09Å
250F87.6Confident88.8Confident57 Ų5734 Ų3425%0.2518%0.176CC..Hα-helixtrans-51.3-39.7171.8-73.1-60.1000112.4I66 A239 F240 V243 G253 A254I66-F250 HydrophobicContact CD1-CB 4.07Å; I66-F250 HydrophobicContact CD1-CD1 3.89Å; I66-F250 HydrophobicContact CD1-CG 4.04Å; I66-F250 HydrophobicContact CG1-CB 3.74Å; I66-F250 HydrophobicContact CG1-CD1 4.44Å; I66-F250 HydrophobicContact CG1-CG 4.27Å; A239-F250 HydrophobicContact CB-CD1 4.26Å; F240-F250 HydrophobicContact CD2-CE1 4.2Å; V243-F250 HydrophobicContact CB-CD1 4.41Å; V243-F250 HydrophobicContact CB-CE1 4.11Å; V243-F250 HydrophobicContact CB-CZ 4.38Å; V243-F250 HydrophobicContact CG1-CZ 4.47Å; V243-F250 HydrophobicContact CG2-CB 4.38Å; V243-F250 HydrophobicContact CG2-CD1 3.44Å; V243-F250 VanDerWaalsContact CG2-CD1 3.44Å; V243-F250 HydrophobicContact CG2-CD2 3.98Å; V243-F250 HydrophobicContact CG2-CE1 3.56Å; V243-F250 HydrophobicContact CG2-CE2 4.09Å; V243-F250 HydrophobicContact CG2-CG 3.65Å; V243-F250 HydrophobicContact CG2-CZ 3.88Å; F250-G253 PolarHBondContact O-N 2.87Å; F250-A254 WeakPolarHBondContact O-CB 3.37Å; F250-A254 PolarHBondContact O-N 2.83Å
251A83.1Confident88.5Confident5 Ų528.2 Ų28.24%0.04115%0.15CC..Hα-helixtrans-60.4-48.5178.200000112.4V65 M69 S249 G253 A254 F255V65-A251 HydrophobicContact CG1-CB 4.14Å; M69-A251 HydrophobicContact CB-CB 4.48Å; M69-A251 HydrophobicContact CG-CB 3.73Å; M69-A251 HydrophobicContact SD-CB 4.35Å; S249-A251 PolarHBondContact O-N 3.16Å; A251-G253 VanDerWaalsContact C-N 3.34Å; A251-G253 PolarHBondContact O-N 3.47Å; A251-A254 PolarHBondContact O-N 3.47Å; A251-F255 VanDerWaalsContact O-CB 3.26Å; A251-F255 WeakPolarHBondContact O-CB 3.03Å; A251-F255 PolarHBondContact O-N 3.29Å
252L83.8Confident88.1Confident1 Ų129.5 Ų29.51%0.00515%0.153CC..Hα-helixtrans-63.2-42.8177.9176.559.4000110.7V162 V166 V196 F199 V248 S249 F255 F256V162-L252 HydrophobicContact CG1-CB 3.48Å; V162-L252 VanDerWaalsContact CG1-CB 3.48Å; V162-L252 HydrophobicContact CG1-CD1 3.31Å; V162-L252 HydrophobicContact CG1-CG 3.9Å; V166-L252 HydrophobicContact CG2-CB 4.11Å; V166-L252 HydrophobicContact CG2-CD2 3.64Å; V166-L252 HydrophobicContact CG2-CG 4.43Å; V196-L252 HydrophobicContact CG1-CD2 4.1Å; F199-L252 HydrophobicContact CD1-CD2 4.37Å; F199-L252 HydrophobicContact CD1-CG 4.38Å; F199-L252 HydrophobicContact CE1-CG 4.17Å; V248-L252 HydrophobicContact CB-CD2 4.37Å; V248-L252 HydrophobicContact CG1-CB 3.53Å; V248-L252 HydrophobicContact CG1-CD2 3.23Å; V248-L252 HydrophobicContact CG1-CG 3.5Å; V248-L252 HydrophobicContact CG2-CD2 4.24Å; S249-L252 PolarHBondContact O-N 3.43Å; S249-L252 VanDerWaalsContact O-N 3.13Å; S249-L252 PolarHBondContact OG-N 2.89Å; L252-F255 PolarHBondContact O-N 2.83Å; L252-F256 HydrophobicContact CD1-CD2 3.31Å; L252-F256 HydrophobicContact CD1-CE2 3.22Å; L252-F256 HydrophobicContact CD1-CZ 4.47Å; L252-F256 HydrophobicContact CG-CD2 4.23Å; L252-F256 HydrophobicContact CG-CE2 4.45Å; L252-F256 WeakPolarHBondContact O-CD2 3.43Å; L252-F256 PolarHBondContact O-N 3.18Å; L252-F256 VanDerWaalsContact O-N 3.09Å
253G90.3Very high87.5Confident0 Ų033.8 Ų33.80%017%0.173CC..Hα-helixtrans-59.8-49177.600000113V238 S249 F250 A251 A257V238-G253 WeakPolarHBondContact CG1-O 2.98Å; S249-G253 PolarHBondContact O-N 3.42Å; S249-G253 VanDerWaalsContact O-N 3.09Å; F250-G253 PolarHBondContact O-N 2.87Å; A251-G253 VanDerWaalsContact C-N 3.34Å; A251-G253 PolarHBondContact O-N 3.47Å; G253-A257 WeakPolarHBondContact O-CB 3.41Å; G253-A257 PolarHBondContact O-N 3.17Å
254A90.5Very high87Confident0 Ų032.7 Ų32.70%017%0.167CC..Hα-helixtrans-64.2-43.3178.400000112.9I66 M69 F70 A239 F250 A251 A257 G258I66-A254 HydrophobicContact CB-CB 4.4Å; I66-A254 HydrophobicContact CG2-CB 3.85Å; I66-A254 VanDerWaalsContact O-CB 3.23Å; I66-A254 WeakPolarHBondContact O-CB 3.44Å; M69-A254 HydrophobicContact CB-CB 3.96Å; F70-A254 WeakPolarHBondContact CA-O 3.33Å; F70-A254 HydrophobicContact CB-CB 4.23Å; A239-A254 HydrophobicContact CB-CB 4.1Å; F250-A254 WeakPolarHBondContact O-CB 3.37Å; F250-A254 PolarHBondContact O-N 2.83Å; A251-A254 PolarHBondContact O-N 3.47Å; A254-A257 WeakPolarHBondContact O-CB 3.43Å; A254-A257 PolarHBondContact O-N 3.32Å; A254-G258 PolarHBondContact O-N 3.16Å
255F87.6Confident86.2Confident1 Ų136.2 Ų36.20%0.00418%0.183CC..Hα-helixtrans-59.3-47.6178174.9-97.6000112M69 V72 G73 F76 L159 A251 L252 A257 G258 M259M69-F255 WeakPolarHBondContact O-CA 3.26Å; V72-F255 HydrophobicContact CB-CD2 4.47Å; V72-F255 HydrophobicContact CG1-CD2 4.1Å; V72-F255 HydrophobicContact CG1-CE2 3.98Å; G73-F255 WeakPolarHBondContact CA-O 3.16Å; F76-F255 HydrophobicContact CB-CE2 4.38Å; F76-F255 HydrophobicContact CB-CZ 4.44Å; F76-F255 HydrophobicContact CD2-CE2 4.1Å; F76-F255 AromaticContact CD2-CZ 3.62Å; F76-F255 HydrophobicContact CD2-CZ 3.62Å; F76-F255 AromaticContact CE2-CZ 3.93Å; F76-F255 HydrophobicContact CE2-CZ 3.93Å; F76-F255 HydrophobicContact CG-CE2 4.45Å; F76-F255 HydrophobicContact CG-CZ 4.07Å; L159-F255 HydrophobicContact CD1-CE1 4.48Å; A251-F255 VanDerWaalsContact O-CB 3.26Å; A251-F255 WeakPolarHBondContact O-CB 3.03Å; A251-F255 PolarHBondContact O-N 3.29Å; L252-F255 PolarHBondContact O-N 2.83Å; F255-A257 VanDerWaalsContact C-N 3.35Å; F255-A257 PolarHBondContact O-N 2.91Å; F255-G258 PolarHBondContact O-N 3.42Å; F255-M259 HydrophobicContact CD1-CE 4Å; F255-M259 HydrophobicContact CE1-CE 3.18Å; F255-M259 HydrophobicContact CZ-CE 3.61Å; F255-M259 PolarHBondContact O-N 3.22Å
256F89.2Confident85.6Confident14 Ų1432 Ų326%0.06116%0.161CC..Hα-helixtrans-68.3-32.8176.8-88-91.8000112.7F199 I200 M203 M204 L252 G258 M259 V260F199-F256 HydrophobicContact CE1-CB 4.02Å; F199-F256 HydrophobicContact CE1-CD2 4.25Å; F199-F256 HydrophobicContact CE1-CG 4.2Å; F199-F256 HydrophobicContact CZ-CB 4.25Å; I200-F256 HydrophobicContact CB-CE1 4.39Å; I200-F256 HydrophobicContact CB-CZ 4.5Å; I200-F256 HydrophobicContact CD1-CE2 4.38Å; I200-F256 HydrophobicContact CD1-CZ 4Å; I200-F256 HydrophobicContact CG1-CE1 4.05Å; I200-F256 HydrophobicContact CG1-CE2 4.1Å; I200-F256 HydrophobicContact CG1-CZ 3.73Å; I200-F256 HydrophobicContact CG2-CE1 3.83Å; I200-F256 HydrophobicContact CG2-CZ 4.12Å; M203-F256 HydrophobicContact CB-CB 4.39Å; M203-F256 HydrophobicContact CB-CD1 4.39Å; M203-F256 HydrophobicContact CE-CB 4.42Å; M203-F256 HydrophobicContact CG-CB 4.27Å; M204-F256 HydrophobicContact SD-CE1 4.5Å; L252-F256 HydrophobicContact CD1-CD2 3.31Å; L252-F256 HydrophobicContact CD1-CE2 3.22Å; L252-F256 HydrophobicContact CD1-CZ 4.47Å; L252-F256 HydrophobicContact CG-CD2 4.23Å; L252-F256 HydrophobicContact CG-CE2 4.45Å; L252-F256 WeakPolarHBondContact O-CD2 3.43Å; L252-F256 PolarHBondContact O-N 3.18Å; L252-F256 VanDerWaalsContact O-N 3.09Å; F256-G258 VanDerWaalsContact C-N 3.33Å; F256-M259 HydrophobicContact CD1-SD 4.44Å; F256-M259 HydrophobicContact CE1-CE 4.27Å; F256-M259 HydrophobicContact CE1-SD 4.28Å; F256-M259 HydrophobicContact CZ-CE 4.4Å; F256-M259 PolarHBondContact O-N 3.37Å; F256-V260 WeakPolarHBondContact O-CB 3.27Å; F256-V260 VanDerWaalsContact O-CG2 3.29Å; F256-V260 WeakPolarHBondContact O-CG2 3.18Å; F256-V260 PolarHBondContact O-N 3.05Å
257A92.3Very high85.3Confident3 Ų330.8 Ų30.83%0.02516%0.157CC..Hα-helixtrans-61.3-43.217200000111.7F70 V238 G253 A254 F255 L261F70-A257 HydrophobicContact CD2-CB 4.06Å; F70-A257 HydrophobicContact CE2-CB 4.21Å; V238-A257 HydrophobicContact CB-CB 3.8Å; V238-A257 HydrophobicContact CG1-CB 3.86Å; V238-A257 HydrophobicContact CG2-CB 4.15Å; G253-A257 WeakPolarHBondContact O-CB 3.41Å; G253-A257 PolarHBondContact O-N 3.17Å; A254-A257 WeakPolarHBondContact O-CB 3.43Å; A254-A257 PolarHBondContact O-N 3.32Å; F255-A257 VanDerWaalsContact C-N 3.35Å; F255-A257 PolarHBondContact O-N 2.91Å; A257-L261 WeakPolarHBondContact O-CB 3.38Å; A257-L261 PolarHBondContact O-N 2.64Å; A257-L261 VanDerWaalsContact O-N 3.11Å
258G91.3Very high85.1Confident0 Ų033.1 Ų33.10%016%0.164CC..Hα-helixtrans-64.7-47175.500000112.4G73 L74 A254 F255 F256 V260 L261 N262G73-G258 CarbonylContact O-C 3.49Å; L74-G258 WeakPolarHBondContact CD2-O 3.31Å; A254-G258 PolarHBondContact O-N 3.16Å; F255-G258 PolarHBondContact O-N 3.42Å; F256-G258 VanDerWaalsContact C-N 3.33Å; G258-V260 PolarHBondContact O-N 2.89Å; G258-L261 PolarHBondContact O-N 3.4Å; G258-L261 VanDerWaalsContact O-N 3.13Å; G258-N262 PolarHBondContact O-N 3.23Å
259M88.3Confident85Confident15 Ų1539.6 Ų39.67%0.07419%0.189CC..Hα-helixtrans-59.1-46.9179.1-178.2-171.3-53.200112G73 F76 F255 F256 L261 N262G73-M259 VanDerWaalsContact O-CA 3.24Å; G73-M259 WeakPolarHBondContact O-CA 3.47Å; G73-M259 PolarHBondContact O-N 2.62Å; F76-M259 HydrophobicContact CD1-CE 3.6Å; F76-M259 HydrophobicContact CD1-CG 3.82Å; F76-M259 HydrophobicContact CD1-SD 4Å; F76-M259 HydrophobicContact CE1-CE 3.46Å; F76-M259 VanDerWaalsContact CE1-CE 3.46Å; F76-M259 HydrophobicContact CE1-CG 4.24Å; F76-M259 HydrophobicContact CE1-SD 3.82Å; F76-M259 HydrophobicContact CE2-CE 4.39Å; F76-M259 HydrophobicContact CG-CE 4.13Å; F76-M259 HydrophobicContact CZ-CE 3.92Å; F255-M259 HydrophobicContact CD1-CE 4Å; F255-M259 HydrophobicContact CE1-CE 3.18Å; F255-M259 HydrophobicContact CZ-CE 3.61Å; F255-M259 PolarHBondContact O-N 3.22Å; F256-M259 HydrophobicContact CD1-SD 4.44Å; F256-M259 HydrophobicContact CE1-CE 4.27Å; F256-M259 HydrophobicContact CE1-SD 4.28Å; F256-M259 HydrophobicContact CZ-CE 4.4Å; F256-M259 PolarHBondContact O-N 3.37Å; M259-L261 VanDerWaalsContact C-N 3.28Å; M259-L261 PolarHBondContact O-N 3.34Å; M259-N262 WeakPolarHBondContact O-CB 3.25Å; M259-N262 PolarHBondContact O-N 3.47Å
260V90.2Very high85Confident3 Ų338.1 Ų38.12%0.01818%0.178CC..Hα-helixtrans-63.3-36.7177.6163.80000111.4M203 G207 V211 F256 G258M203-V260 HydrophobicContact CE-CG2 4.16Å; G207-V260 VanDerWaalsContact O-CG1 3.31Å; G207-V260 WeakPolarHBondContact O-CG1 2.97Å; V211-V260 HydrophobicContact CB-CG1 3.7Å; V211-V260 HydrophobicContact CG1-CG1 4.08Å; V211-V260 HydrophobicContact CG2-CG1 3.85Å; F256-V260 WeakPolarHBondContact O-CB 3.27Å; F256-V260 VanDerWaalsContact O-CG2 3.29Å; F256-V260 WeakPolarHBondContact O-CG2 3.18Å; F256-V260 PolarHBondContact O-N 3.05Å; G258-V260 PolarHBondContact O-N 2.89Å
261L89.2Confident84.9Confident0 Ų036.2 Ų36.20%017%0.173CC..Hα-helixtrans-72.2-31176.7-175.557000112.6F70 L74 V211 M215 V231 A257 G258 M259 E263 S264 S267 A270F70-L261 HydrophobicContact CE2-CD2 4.26Å; F70-L261 HydrophobicContact CZ-CD2 3.63Å; L74-L261 HydrophobicContact CD2-CB 3.87Å; L74-L261 HydrophobicContact CD2-CD2 3.97Å; L74-L261 HydrophobicContact CD2-CG 3.86Å; V211-L261 HydrophobicContact CG1-CB 3.98Å; V211-L261 HydrophobicContact CG1-CD1 3.74Å; V211-L261 HydrophobicContact CG1-CG 4.42Å; M215-L261 HydrophobicContact CG-CD1 3.43Å; M215-L261 VanDerWaalsContact CG-CD1 3.43Å; M215-L261 HydrophobicContact SD-CD1 3.87Å; M215-L261 HydrophobicContact SD-CD2 4.37Å; V231-L261 HydrophobicContact CG1-CD2 4.01Å; A257-L261 WeakPolarHBondContact O-CB 3.38Å; A257-L261 PolarHBondContact O-N 2.64Å; A257-L261 VanDerWaalsContact O-N 3.11Å; G258-L261 PolarHBondContact O-N 3.4Å; G258-L261 VanDerWaalsContact O-N 3.13Å; M259-L261 VanDerWaalsContact C-N 3.28Å; M259-L261 PolarHBondContact O-N 3.34Å; L261-E263 PolarHBondContact O-N 2.89Å; L261-S264 WeakPolarHBondContact CD1-OG 3.36Å; L261-S264 WeakPolarHBondContact O-CB 3.35Å; L261-S264 PolarHBondContact O-N 2.9Å; L261-S264 PolarHBondContact O-OG 2.85Å; L261-S267 WeakPolarHBondContact O-CB 3.34Å; L261-A270 HydrophobicContact CD2-CB 3.45Å; L261-A270 VanDerWaalsContact CD2-CB 3.45Å; L261-A270 HydrophobicContact CG-CB 4.16Å
262N86Confident85Confident46 Ų4642.1 Ų42.125%0.24620%0.199CC..Hα-helixtrans-59.6-31.2176.4-167.922.3000112.5L74 F76 G258 M259 S264L74-N262 PolarHBondContact O-ND2 3.08Å; L74-N262 PolarHBondContact O-OD1 3.48Å; F76-N262 PolarHBondContact O-ND2 3.15Å; G258-N262 PolarHBondContact O-N 3.23Å; M259-N262 WeakPolarHBondContact O-CB 3.25Å; M259-N262 PolarHBondContact O-N 3.47Å; N262-S264 PolarHBondContact O-N 3.22Å
263E77.8Confident85Confident90 Ų9043.9 Ų43.942%0.42121%0.209SC..THydrogen-bonded Turntrans-69.1-9.5175.1-65-166.3-178.100114R208 L261R208-E263 WeakPolarHBondContact CD-OE2 3.48Å; R208-E263 IonicContact CZ-OE2 2.54Å; R208-E263 IonicContact NE-OE2 3.53Å; R208-E263 PolarHBondContact NE-OE2 2.78Å; R208-E263 IonicContact NH2-OE2 3.44Å; L261-E263 PolarHBondContact O-N 2.89Å
264S79.2Confident84.8Confident14 Ų1444 Ų4410%0.09821%0.21CC..SBendtrans-90.5148.8179.580.60000112.7L261 N262 L266 S267L261-S264 WeakPolarHBondContact CD1-OG 3.36Å; L261-S264 WeakPolarHBondContact O-CB 3.35Å; L261-S264 PolarHBondContact O-N 2.9Å; L261-S264 PolarHBondContact O-OG 2.85Å; N262-S264 PolarHBondContact O-N 3.22Å; S264-L266 PolarHBondContact O-N 3.22Å; S264-L266 VanDerWaalsContact O-N 3.08Å; S264-L266 PolarHBondContact OG-N 2.84Å; S264-S267 VanDerWaalsContact O-CB 3.27Å; S264-S267 WeakPolarHBondContact O-CB 3.44Å; S264-S267 PolarHBondContact O-N 3.42Å; S264-S267 VanDerWaalsContact O-N 3.07Å; S264-S267 PolarHBondContact O-OG 2.83Å; S264-S267 VanDerWaalsContact O-OG 3.14Å; S264-S267 PolarHBondContact OG-N 3.45Å
265E75.1Confident84.4Confident198 Ų19846.8 Ų46.893%0.92522%0.224SC*.THydrogen-bonded Turntrans-63.3-15.4174.2-62-176.3172.600113.5
266L78.8Confident84.4Confident41 Ų4150.8 Ų50.822%0.21525%0.251CS..THydrogen-bonded Turntrans-92.91.4179.5-66.1171.7000112.6M215 A219 F227 S264 H268 R269 A270M215-L266 HydrophobicContact CB-CD1 3.81Å; A219-L266 HydrophobicContact CB-CD1 3.86Å; A219-L266 HydrophobicContact CB-CD2 4.43Å; F227-L266 HydrophobicContact CE2-CB 4.31Å; F227-L266 HydrophobicContact CE2-CD1 4.17Å; F227-L266 HydrophobicContact CZ-CB 4.22Å; S264-L266 PolarHBondContact O-N 3.22Å; S264-L266 VanDerWaalsContact O-N 3.08Å; S264-L266 PolarHBondContact OG-N 2.84Å; L266-H268 VanDerWaalsContact C-N 3.35Å; L266-H268 PolarHBondContact O-N 3.02Å; L266-R269 PolarHBondContact O-N 2.9Å; L266-R269 VanDerWaalsContact O-N 3.13Å; L266-A270 PolarHBondContact O-N 2.87Å
267S81.3Confident84.4Confident12 Ų1253 Ų538%0.08426%0.263CS..Hα-helixtrans-56.5-44.5-177.663.50000112.6L261 S264 R269 A270 A271L261-S267 WeakPolarHBondContact O-CB 3.34Å; S264-S267 VanDerWaalsContact O-CB 3.27Å; S264-S267 WeakPolarHBondContact O-CB 3.44Å; S264-S267 PolarHBondContact O-N 3.42Å; S264-S267 VanDerWaalsContact O-N 3.07Å; S264-S267 PolarHBondContact O-OG 2.83Å; S264-S267 VanDerWaalsContact O-OG 3.14Å; S264-S267 PolarHBondContact OG-N 3.45Å; S267-R269 VanDerWaalsContact C-N 3.33Å; S267-R269 PolarHBondContact O-N 3.45Å; S267-A270 PolarHBondContact O-N 2.93Å; S267-A271 WeakPolarHBondContact O-CB 3.5Å; S267-A271 PolarHBondContact O-N 3.34Å
268H79Confident84.1Confident161 Ų16155.2 Ų55.275%0.74527%0.27SS*.Hα-helixtrans-60.3-40.5177.7-73.4-67.5000112.7L266 H272L266-H268 VanDerWaalsContact C-N 3.35Å; L266-H268 PolarHBondContact O-N 3.02Å; H268-H272 WeakPolarHBondContact O-CB 3.25Å; H268-H272 PolarHBondContact O-N 3.26Å
269R80.2Confident83.9Confident139 Ų13958.6 Ų58.653%0.52529%0.289SS..Hα-helixtrans-69.7-42.7176.5-172.3-178.2-76.1178.6-3.3110.7F227 L266 S267 A271 H272 D273F227-R269 HydrophobicContact CD1-CG 4.1Å; F227-R269 HydrophobicContact CE1-CB 3.98Å; F227-R269 HydrophobicContact CE1-CG 3.54Å; F227-R269 HydrophobicContact CZ-CB 4.12Å; F227-R269 HydrophobicContact CZ-CG 4.08Å; L266-R269 PolarHBondContact O-N 2.9Å; L266-R269 VanDerWaalsContact O-N 3.13Å; S267-R269 VanDerWaalsContact C-N 3.33Å; S267-R269 PolarHBondContact O-N 3.45Å; R269-A271 VanDerWaalsContact C-N 3.34Å; R269-A271 PolarHBondContact O-N 3.43Å; R269-H272 PolarHBondContact O-N 2.96Å; R269-D273 WeakPolarHBondContact O-CB 3.23Å; R269-D273 PolarHBondContact O-N 3.12Å
270A85Confident84Confident0 Ų060 Ų600%030%0.302CS..Hα-helixtrans-62.7-41.6177.500000112.4F227 V231 L261 L266 S267 T274F227-A270 HydrophobicContact CE1-CB 4.3Å; F227-A270 HydrophobicContact CZ-CB 4.2Å; V231-A270 HydrophobicContact CG1-CB 3.94Å; V231-A270 HydrophobicContact CG2-CB 3.66Å; L261-A270 HydrophobicContact CD2-CB 3.45Å; L261-A270 VanDerWaalsContact CD2-CB 3.45Å; L261-A270 HydrophobicContact CG-CB 4.16Å; L266-A270 PolarHBondContact O-N 2.87Å; S267-A270 PolarHBondContact O-N 2.93Å; A270-T274 WeakPolarHBondContact O-CB 3.34Å; A270-T274 WeakPolarHBondContact O-CG2 3.49Å; A270-T274 PolarHBondContact O-N 3.33Å; A270-T274 VanDerWaalsContact O-N 3.1Å; A270-T274 PolarHBondContact O-OG1 2.93Å
271A84.1Confident83.9Confident18 Ų1862.5 Ų62.515%0.14931%0.313CS..Hα-helixtrans-58.2-59.4172.200000109.4L74 S267 R269 D273 T274 L275L74-A271 HydrophobicContact CD1-CB 4.1Å; S267-A271 WeakPolarHBondContact O-CB 3.5Å; S267-A271 PolarHBondContact O-N 3.34Å; R269-A271 VanDerWaalsContact C-N 3.34Å; R269-A271 PolarHBondContact O-N 3.43Å; A271-D273 VanDerWaalsContact C-N 3.31Å; A271-D273 PolarHBondContact O-N 3.38Å; A271-T274 PolarHBondContact O-N 3.43Å; A271-T274 PolarHBondContact O-OG1 3.45Å; A271-L275 VanDerWaalsContact O-CG 3.3Å; A271-L275 WeakPolarHBondContact O-CG 3.46Å; A271-L275 PolarHBondContact O-N 3.49Å
272H84.7Confident83.7Confident128 Ų12862.9 Ų62.959%0.59332%0.316SS*.Hα-helixtrans-51.5-46.2-179.2179.6-85.9000113.3H268 R269 T274 L275H268-H272 WeakPolarHBondContact O-CB 3.25Å; H268-H272 PolarHBondContact O-N 3.26Å; R269-H272 PolarHBondContact O-N 2.96Å; H272-T274 VanDerWaalsContact C-N 3.33Å; H272-T274 PolarHBondContact O-N 3.4Å; H272-L275 PolarHBondContact O-N 3Å
273D84.7Confident83.9Confident38 Ų3861.5 Ų61.520%0.20331%0.31CS..Hα-helixtrans-74.3-22.4-177.3-68.8-4000113.2F227 T228 R269 A271F227-D273 WeakPolarHBondContact CD1-OD2 3.23Å; T228-D273 HydrophobicContact CG2-CB 4.29Å; R269-D273 WeakPolarHBondContact O-CB 3.23Å; R269-D273 PolarHBondContact O-N 3.12Å; A271-D273 VanDerWaalsContact C-N 3.31Å; A271-D273 PolarHBondContact O-N 3.38Å
274T85.3Confident84.5Confident4 Ų457.9 Ų57.93%0.02529%0.293CS..Hα-helixtrans-91.7-18.4175.353.40000113.9F70 V231 L232 A270 A271 H272 P276 L277 R278F70-T274 HydrophobicContact CE1-CG2 4.1Å; V231-T274 HydrophobicContact CB-CG2 3.97Å; V231-T274 HydrophobicContact CG1-CG2 3.31Å; L232-T274 HydrophobicContact CD2-CG2 4.26Å; A270-T274 WeakPolarHBondContact O-CB 3.34Å; A270-T274 WeakPolarHBondContact O-CG2 3.49Å; A270-T274 PolarHBondContact O-N 3.33Å; A270-T274 VanDerWaalsContact O-N 3.1Å; A270-T274 PolarHBondContact O-OG1 2.93Å; A271-T274 PolarHBondContact O-N 3.43Å; A271-T274 PolarHBondContact O-OG1 3.45Å; H272-T274 VanDerWaalsContact C-N 3.33Å; H272-T274 PolarHBondContact O-N 3.4Å; T274-P276 VanDerWaalsContact C-CD 3.5Å; T274-L277 PolarHBondContact O-N 3.27Å; T274-R278 WeakPolarHBondContact O-CB 3.25Å; T274-R278 PolarHBondContact O-N 2.9Å
275L83.2Confident84.9Confident57 Ų5757.6 Ų57.630%0.29829%0.29SS..Hα-helixtrans-48.3-50.4179.2-69176.9000112.7A271 H272 L277 R278 D279A271-L275 VanDerWaalsContact O-CG 3.3Å; A271-L275 WeakPolarHBondContact O-CG 3.46Å; A271-L275 PolarHBondContact O-N 3.49Å; H272-L275 PolarHBondContact O-N 3Å; L275-L277 VanDerWaalsContact C-N 3.34Å; L275-L277 PolarHBondContact O-N 3.47Å; L275-R278 PolarHBondContact O-N 2.87Å; L275-D279 WeakPolarHBondContact O-CB 3.33Å; L275-D279 PolarHBondContact O-N 3.5Å
276P88.2Confident85.6Confident86 Ų8648.4 Ų48.456%0.55825%0.247SC*.Hα-helixtrans-65.2-38-174.7-21.634.7000113T274 A280T274-P276 VanDerWaalsContact C-CD 3.5Å; P276-A280 WeakPolarHBondContact O-CB 3.25Å; P276-A280 PolarHBondContact O-N 2.91Å
277L87.7Confident86.2Confident61 Ų6146.7 Ų46.732%0.31924%0.238SC..Hα-helixtrans-73.8-45.2179.4-70.8170.6000110.9L67 L232 T274 L275 D279 A280 F281L67-L277 HydrophobicContact CD1-CB 4.4Å; L232-L277 HydrophobicContact CD1-CD1 3.37Å; L232-L277 HydrophobicContact CD2-CD1 3.66Å; L232-L277 HydrophobicContact CG-CD1 4.02Å; T274-L277 PolarHBondContact O-N 3.27Å; L275-L277 VanDerWaalsContact C-N 3.34Å; L275-L277 PolarHBondContact O-N 3.47Å; L277-D279 VanDerWaalsContact C-N 3.28Å; L277-D279 PolarHBondContact O-N 3.06Å; L277-A280 PolarHBondContact O-N 2.91Å; L277-F281 HydrophobicContact CD2-CE2 4.37Å; L277-F281 VanDerWaalsContact O-CD2 3.31Å; L277-F281 WeakPolarHBondContact O-CD2 3.25Å; L277-F281 PolarHBondContact O-N 3.17Å
278R87.4Confident86.5Confident48 Ų4846.5 Ų46.518%0.18124%0.237CC..Hα-helixtrans-53.1-49.4173.1-178.8-164.171.4-179.12.7110.5L67 L68 T274 L275 F281 A282L67-R278 HydrophobicContact CB-CB 4.22Å; L67-R278 HydrophobicContact CB-CG 4.3Å; L67-R278 WeakPolarHBondContact O-CG 3.34Å; L68-R278 HydrophobicContact CD2-CG 4.11Å; T274-R278 WeakPolarHBondContact O-CB 3.25Å; T274-R278 PolarHBondContact O-N 2.9Å; L275-R278 PolarHBondContact O-N 2.87Å; R278-F281 PolarHBondContact O-N 3.48Å; R278-A282 WeakPolarHBondContact O-CB 3.32Å; R278-A282 PolarHBondContact O-N 3.44Å
279D87Confident86.9Confident72 Ų7239.3 Ų39.339%0.38520%0.204SC..Hα-helixtrans-66.7-40.1-177.3-69-0.5000111.7L275 L277 V283L275-D279 WeakPolarHBondContact O-CB 3.33Å; L275-D279 PolarHBondContact O-N 3.5Å; L277-D279 VanDerWaalsContact C-N 3.28Å; L277-D279 PolarHBondContact O-N 3.06Å; D279-V283 WeakPolarHBondContact O-CG2 3.36Å; D279-V283 PolarHBondContact O-N 3.4Å
280A89.2Confident87.4Confident44 Ų4432.7 Ų32.736%0.36418%0.18SC..Hα-helixtrans-65.2-45.6176.500000113P276 L277 V283 L284P276-A280 WeakPolarHBondContact O-CB 3.25Å; P276-A280 PolarHBondContact O-N 2.91Å; L277-A280 PolarHBondContact O-N 2.91Å; A280-V283 WeakPolarHBondContact O-CB 3.29Å; A280-V283 PolarHBondContact O-N 3.15Å; A280-L284 PolarHBondContact O-N 3.4Å
281F89Confident87.6Confident56 Ų5633 Ų3325%0.24618%0.181CC..Hα-helixtrans-75.6-28.6179.2-80.9-88.7000112.5L63 G64 L67 L277 R278 V283 L284 F285L63-F281 HydrophobicContact CB-CD1 3.76Å; L63-F281 HydrophobicContact CB-CE1 3.98Å; L63-F281 HydrophobicContact CD1-CD1 4.41Å; L63-F281 HydrophobicContact CD1-CE1 3.78Å; G64-F281 WeakPolarHBondContact CA-O 3.19Å; L67-F281 HydrophobicContact CD1-CB 3.88Å; L67-F281 HydrophobicContact CD1-CD2 3.66Å; L67-F281 HydrophobicContact CD1-CE2 4.4Å; L67-F281 HydrophobicContact CD1-CG 3.88Å; L277-F281 HydrophobicContact CD2-CE2 4.37Å; L277-F281 VanDerWaalsContact O-CD2 3.31Å; L277-F281 WeakPolarHBondContact O-CD2 3.25Å; L277-F281 PolarHBondContact O-N 3.17Å; R278-F281 PolarHBondContact O-N 3.48Å; F281-V283 VanDerWaalsContact C-N 3.27Å; F281-V283 PolarHBondContact O-N 2.81Å; F281-L284 HydrophobicContact CD1-CD1 4.11Å; F281-L284 HydrophobicContact CE1-CD1 4.41Å; F281-L284 WeakPolarHBondContact O-CB 3.04Å; F281-L284 PolarHBondContact O-N 3.1Å; F281-L284 VanDerWaalsContact O-N 3.16Å; F281-F285 PolarHBondContact O-N 2.87Å
282A84.7Confident87.7Confident7 Ų735.6 Ų35.66%0.05819%0.192CC..Hα-helixtrans-59.4-40.5170.300000111.4L68 R278 L284 F285 F286L68-A282 HydrophobicContact CD1-CB 3.83Å; L68-A282 HydrophobicContact CD2-CB 3.62Å; L68-A282 HydrophobicContact CG-CB 3.81Å; R278-A282 WeakPolarHBondContact O-CB 3.32Å; R278-A282 PolarHBondContact O-N 3.44Å; A282-L284 VanDerWaalsContact C-N 3.32Å; A282-L284 PolarHBondContact O-N 3.02Å; A282-F285 WeakPolarHBondContact O-CB 3.39Å; A282-F285 PolarHBondContact O-N 3.01Å; A282-F286 HydrophobicContact CB-CE2 4.27Å; A282-F286 WeakPolarHBondContact O-CD2 3.44Å; A282-F286 PolarHBondContact O-N 3.03Å
283V90.3Very high87.9Confident18 Ų1830 Ų3011%0.10917%0.166CC..Hα-helixtrans-58.8-45.1174.1173.90000111L15 A18 Y36 D279 A280 F281 F285 F286 V287L15-V283 HydrophobicContact CD2-CB 4.11Å; L15-V283 HydrophobicContact CD2-CG1 3.83Å; A18-V283 HydrophobicContact CB-CG1 3.28Å; Y36-V283 HydrophobicContact CD1-CG1 4.32Å; Y36-V283 HydrophobicContact CD1-CG2 4.46Å; Y36-V283 HydrophobicContact CD2-CG2 3.98Å; Y36-V283 HydrophobicContact CE1-CG2 4.24Å; Y36-V283 HydrophobicContact CE2-CG2 3.77Å; Y36-V283 HydrophobicContact CG-CG1 4.32Å; Y36-V283 HydrophobicContact CG-CG2 4.34Å; D279-V283 WeakPolarHBondContact O-CG2 3.36Å; D279-V283 PolarHBondContact O-N 3.4Å; A280-V283 WeakPolarHBondContact O-CB 3.29Å; A280-V283 PolarHBondContact O-N 3.15Å; F281-V283 VanDerWaalsContact C-N 3.27Å; F281-V283 PolarHBondContact O-N 2.81Å; V283-F285 VanDerWaalsContact C-N 3.31Å; V283-F285 PolarHBondContact O-N 3.29Å; V283-F286 PolarHBondContact O-N 3.42Å; V283-V287 HydrophobicContact CG1-CG2 4.31Å; V283-V287 VanDerWaalsContact O-CG2 3.27Å; V283-V287 WeakPolarHBondContact O-CG2 3.31Å; V283-V287 PolarHBondContact O-N 3.17Å
284L89.8Confident88.1Confident14 Ų1429.8 Ų29.87%0.07317%0.165CC..Hα-helixtrans-61.8-38.6176.6-64.8178.3000112.2I11 L15 L60 A280 F281 A282 V287 S288I11-L284 HydrophobicContact CG1-CD1 4.47Å; L15-L284 HydrophobicContact CD2-CD2 3.86Å; L15-L284 HydrophobicContact CD2-CG 4.11Å; L15-L284 HydrophobicContact CG-CD2 3.84Å; L60-L284 HydrophobicContact CB-CD1 4.4Å; A280-L284 PolarHBondContact O-N 3.4Å; F281-L284 HydrophobicContact CD1-CD1 4.11Å; F281-L284 HydrophobicContact CE1-CD1 4.41Å; F281-L284 WeakPolarHBondContact O-CB 3.04Å; F281-L284 PolarHBondContact O-N 3.1Å; F281-L284 VanDerWaalsContact O-N 3.16Å; A282-L284 VanDerWaalsContact C-N 3.32Å; A282-L284 PolarHBondContact O-N 3.02Å; L284-V287 PolarHBondContact O-N 3.28Å; L284-S288 WeakPolarHBondContact O-CB 3.02Å; L284-S288 PolarHBondContact O-N 2.93Å
285F88.5Confident88.3Confident7 Ų731.4 Ų31.43%0.03118%0.175CC..Hα-helixtrans-58.4-52.5172.2164-99.9000111.9A61 V65 L68 F281 A282 V283 V287 S288 V289 E346 F349 I350A61-F285 HydrophobicContact CB-CB 4.26Å; A61-F285 HydrophobicContact CB-CD2 4.08Å; V65-F285 HydrophobicContact CG2-CD2 3.37Å; V65-F285 HydrophobicContact CG2-CE2 3.42Å; V65-F285 VanDerWaalsContact CG2-CE2 3.42Å; V65-F285 HydrophobicContact CG2-CG 4.23Å; V65-F285 HydrophobicContact CG2-CZ 4.31Å; L68-F285 HydrophobicContact CD1-CD1 4.04Å; L68-F285 HydrophobicContact CD1-CG 4.48Å; F281-F285 PolarHBondContact O-N 2.87Å; A282-F285 WeakPolarHBondContact O-CB 3.39Å; A282-F285 PolarHBondContact O-N 3.01Å; V283-F285 VanDerWaalsContact C-N 3.31Å; V283-F285 PolarHBondContact O-N 3.29Å; F285-V287 VanDerWaalsContact C-N 3.31Å; F285-V287 PolarHBondContact O-N 2.7Å; F285-S288 PolarHBondContact O-N 3.38Å; F285-S288 VanDerWaalsContact O-N 3.15Å; F285-V289 HydrophobicContact CD2-CG2 4.08Å; F285-V289 HydrophobicContact CE1-CG2 4.21Å; F285-V289 HydrophobicContact CE2-CG2 3.63Å; F285-V289 HydrophobicContact CZ-CG2 3.72Å; F285-V289 WeakPolarHBondContact O-CG2 3.43Å; F285-V289 PolarHBondContact O-N 3.05Å; F285-E346 HydrophobicContact CE1-CB 3.94Å; F285-E346 HydrophobicContact CZ-CB 4.2Å; F285-F349 HydrophobicContact CE1-CD2 4.31Å; F285-F349 HydrophobicContact CZ-CB 4.27Å; F285-F349 HydrophobicContact CZ-CD2 4.22Å; F285-I350 HydrophobicContact CE2-CD1 4.41Å; F285-I350 HydrophobicContact CE2-CG1 3.9Å; F285-I350 HydrophobicContact CZ-CD1 4.38Å; F285-I350 HydrophobicContact CZ-CG1 4.02Å
286F88.6Confident88.6Confident5 Ų532.5 Ų32.52%0.02218%0.181CC..Hα-helixtrans-64.4-35.8-179.9-68.5-64.2000112.6L33 Y36 L37 A282 V283 V289 G290 F349L33-F286 HydrophobicContact CD1-CZ 4.37Å; L33-F286 HydrophobicContact CD2-CD2 3.72Å; L33-F286 HydrophobicContact CD2-CE1 4.34Å; L33-F286 HydrophobicContact CD2-CE2 3.36Å; L33-F286 HydrophobicContact CD2-CG 4.39Å; L33-F286 HydrophobicContact CD2-CZ 3.71Å; Y36-F286 HydrophobicContact CD2-CD2 4.2Å; L37-F286 HydrophobicContact CD2-CB 4.42Å; L37-F286 HydrophobicContact CD2-CD1 4.28Å; L37-F286 HydrophobicContact CG-CB 4.46Å; L37-F286 HydrophobicContact CG-CD1 4.42Å; A282-F286 HydrophobicContact CB-CE2 4.27Å; A282-F286 WeakPolarHBondContact O-CD2 3.44Å; A282-F286 PolarHBondContact O-N 3.03Å; V283-F286 PolarHBondContact O-N 3.42Å; F286-V289 PolarHBondContact O-N 2.7Å; F286-G290 PolarHBondContact O-N 2.86Å; F286-F349 HydrophobicContact CD1-CE2 4.49Å; F286-F349 HydrophobicContact CE1-CE2 4.29Å
287V91.7Very high88.7Confident6 Ų628.6 Ų28.64%0.03616%0.156CC..Hα-helixtrans-62.3-48.6172171.70000110.2A18 A39 G40 V283 L284 F285 V289 G290 M291A18-V287 HydrophobicContact CB-CG2 3.8Å; A39-V287 HydrophobicContact CB-CG2 4.14Å; G40-V287 WeakPolarHBondContact CA-O 3.36Å; V283-V287 HydrophobicContact CG1-CG2 4.31Å; V283-V287 VanDerWaalsContact O-CG2 3.27Å; V283-V287 WeakPolarHBondContact O-CG2 3.31Å; V283-V287 PolarHBondContact O-N 3.17Å; L284-V287 PolarHBondContact O-N 3.28Å; F285-V287 VanDerWaalsContact C-N 3.31Å; F285-V287 PolarHBondContact O-N 2.7Å; V287-V289 VanDerWaalsContact C-N 3.34Å; V287-V289 PolarHBondContact O-N 3.45Å; V287-G290 PolarHBondContact O-N 3.43Å; V287-M291 WeakPolarHBondContact O-CG 3.41Å; V287-M291 PolarHBondContact O-N 3.28Å
288S89.3Confident88.8Confident7 Ų729.1 Ų29.15%0.04916%0.158CC..Hα-helixtrans-63-39179-172.60000112.8A57 L284 F285 M291A57-S288 PolarHBondContact O-OG 3.49Å; L284-S288 WeakPolarHBondContact O-CB 3.02Å; L284-S288 PolarHBondContact O-N 2.93Å; F285-S288 PolarHBondContact O-N 3.38Å; F285-S288 VanDerWaalsContact O-N 3.15Å; S288-M291 WeakPolarHBondContact O-CB 3.13Å; S288-M291 PolarHBondContact O-N 3.32Å
289V86.5Confident89.1Confident10 Ų1033.2 Ų33.26%0.06118%0.182CC..Hα-helixtrans-63.3-44.5174.3169.30000110.3L37 F285 F286 V287 M291 L292 F349 L370L37-V289 HydrophobicContact CD2-CB 4.22Å; L37-V289 HydrophobicContact CD2-CG1 3.88Å; F285-V289 HydrophobicContact CD2-CG2 4.08Å; F285-V289 HydrophobicContact CE1-CG2 4.21Å; F285-V289 HydrophobicContact CE2-CG2 3.63Å; F285-V289 HydrophobicContact CZ-CG2 3.72Å; F285-V289 WeakPolarHBondContact O-CG2 3.43Å; F285-V289 PolarHBondContact O-N 3.05Å; F286-V289 PolarHBondContact O-N 2.7Å; V287-V289 VanDerWaalsContact C-N 3.34Å; V287-V289 PolarHBondContact O-N 3.45Å; V289-M291 PolarHBondContact O-N 2.86Å; V289-L292 WeakPolarHBondContact O-CB 3.43Å; V289-L292 PolarHBondContact O-N 3.19Å; V289-F349 HydrophobicContact CG1-CB 3.78Å; V289-F349 HydrophobicContact CG1-CD1 3.57Å; V289-F349 HydrophobicContact CG1-CD2 3.93Å; V289-F349 HydrophobicContact CG1-CE1 4.06Å; V289-F349 HydrophobicContact CG1-CE2 4.43Å; V289-F349 HydrophobicContact CG1-CG 3.5Å; V289-F349 VanDerWaalsContact CG1-CG 3.5Å; V289-F349 HydrophobicContact CG1-CZ 4.48Å; V289-F349 HydrophobicContact CG2-CB 3.88Å; V289-F349 HydrophobicContact CG2-CD2 4.44Å; V289-F349 HydrophobicContact CG2-CG 4.28Å; V289-L370 HydrophobicContact CG1-CD2 3.96Å; V289-L370 HydrophobicContact CG1-CG 4.16Å; V289-L370 VanDerWaalsContact O-CD2 3.25Å; V289-L370 WeakPolarHBondContact O-CD2 3.42Å
290G90.1Very high89.3Confident1 Ų135.7 Ų35.71%0.0119%0.192CC..Hα-helixtrans-60.6-31.8177.200000113.1L37 G40 V41 F286 V287 L292 F293L37-G290 WeakPolarHBondContact O-CA 3.39Å; G40-G290 CarbonylContact C-O 3.59Å; G40-G290 CarbonylContact O-C 3.03Å; V41-G290 WeakPolarHBondContact CA-O 3.27Å; V41-G290 PolarHBondContact N-O 2.88Å; F286-G290 PolarHBondContact O-N 2.86Å; V287-G290 PolarHBondContact O-N 3.43Å; G290-L292 PolarHBondContact O-N 3.17Å; G290-F293 WeakPolarHBondContact O-CB 3.4Å; G290-F293 PolarHBondContact O-N 3.45Å
291M90.1Very high89.4Confident7 Ų736.9 Ų36.93%0.03419%0.189CC..Hα-helixtrans-63.5-26.4175-66.9168.962.400112.9G40 A43 P45 A52 T54 A57 V287 S288 V289 F293G40-M291 VanDerWaalsContact O-CA 3.27Å; G40-M291 WeakPolarHBondContact O-CA 3.24Å; G40-M291 VanDerWaalsContact O-CG 3.26Å; G40-M291 WeakPolarHBondContact O-CG 3.15Å; G40-M291 PolarHBondContact O-N 2.82Å; A43-M291 HydrophobicContact CB-CG 4.49Å; P45-M291 WeakPolarHBondContact CD-O 3.09Å; A52-M291 HydrophobicContact CB-CE 3.55Å; A52-M291 HydrophobicContact CB-SD 3.7Å; A52-M291 WeakPolarHBondContact O-CE 3.37Å; T54-M291 HydrophobicContact CG2-CE 4.1Å; A57-M291 HydrophobicContact CB-CE 3.93Å; A57-M291 HydrophobicContact CB-SD 3.61Å; V287-M291 WeakPolarHBondContact O-CG 3.41Å; V287-M291 PolarHBondContact O-N 3.28Å; S288-M291 WeakPolarHBondContact O-CB 3.13Å; S288-M291 PolarHBondContact O-N 3.32Å; V289-M291 PolarHBondContact O-N 2.86Å; M291-F293 VanDerWaalsContact C-N 3.29Å
292L85.3Confident89.7Confident71 Ų7137.1 Ų37.137%0.37220%0.197SC..THydrogen-bonded Turntrans-79.5-13.2179.2-58.3175.8000112.8V289 G290 D294 N367 L370V289-L292 WeakPolarHBondContact O-CB 3.43Å; V289-L292 PolarHBondContact O-N 3.19Å; G290-L292 PolarHBondContact O-N 3.17Å; L292-D294 PolarHBondContact O-N 3.23Å; L292-N367 PolarHBondContact O-OD1 3.48Å; L292-L370 HydrophobicContact CB-CD2 4.19Å
293F89.1Confident90.1Very high12 Ų1243.5 Ų43.55%0.05323%0.229CC..  trans-80.2118.4-176.7-177.9-120.6000111.8V41 F46 G290 M291 P295 I297 L298 L370 A371 I374V41-F293 HydrophobicContact CG1-CD1 4.41Å; V41-F293 HydrophobicContact CG2-CB 4.17Å; V41-F293 HydrophobicContact CG2-CD1 3.71Å; V41-F293 HydrophobicContact CG2-CG 4.41Å; F46-F293 WeakPolarHBondContact CD2-O 3.25Å; G290-F293 WeakPolarHBondContact O-CB 3.4Å; G290-F293 PolarHBondContact O-N 3.45Å; M291-F293 VanDerWaalsContact C-N 3.29Å; F293-P295 HydrophobicContact CD1-CB 4.34Å; F293-P295 HydrophobicContact CE1-CB 3.92Å; F293-P295 VanDerWaalsContact O-CD 3.22Å; F293-P295 WeakPolarHBondContact O-CD 3.43Å; F293-I297 HydrophobicContact CE2-CG2 3.76Å; F293-I297 HydrophobicContact CZ-CG2 4.04Å; F293-L298 HydrophobicContact CZ-CD1 4.37Å; F293-L298 HydrophobicContact CZ-CD2 4.4Å; F293-L298 HydrophobicContact CZ-CG 4.22Å; F293-L370 HydrophobicContact CB-CB 4.37Å; F293-L370 HydrophobicContact CB-CD2 3.79Å; F293-L370 HydrophobicContact CD2-CB 3.65Å; F293-L370 HydrophobicContact CE2-CB 4.37Å; F293-L370 HydrophobicContact CG-CB 4.32Å; F293-A371 HydrophobicContact CE2-CB 3.7Å; F293-A371 HydrophobicContact CZ-CB 3.97Å; F293-I374 HydrophobicContact CD1-CD1 4.2Å; F293-I374 HydrophobicContact CE1-CD1 4.38Å; F293-I374 HydrophobicContact CG-CD1 4.41Å
294D90Very high90.4Very high32 Ų3243 Ų4317%0.17123%0.227CC..  trans-87.2105166.7-176.7-0.7000110.3F46 L292 L296 I297 N367F46-D294 HydrophobicContact CD1-CB 3.87Å; F46-D294 HydrophobicContact CD2-CB 4.15Å; F46-D294 HydrophobicContact CE1-CB 4.05Å; F46-D294 HydrophobicContact CE2-CB 4.31Å; F46-D294 HydrophobicContact CG-CB 3.94Å; F46-D294 HydrophobicContact CZ-CB 4.26Å; L292-D294 PolarHBondContact O-N 3.23Å; D294-L296 PolarHBondContact O-N 3.25Å; D294-L296 VanDerWaalsContact O-N 3.07Å; D294-L296 WeakPolarHBondContact OD1-CB 3.29Å; D294-L296 PolarHBondContact OD1-N 3.04Å; D294-I297 VanDerWaalsContact O-CG2 3.27Å; D294-I297 WeakPolarHBondContact O-CG2 3.47Å; D294-I297 PolarHBondContact O-N 2.83Å; D294-N367 PolarHBondContact N-OD1 3.41Å
295P88.4Confident90.6Very high39 Ų3942.7 Ų42.725%0.25323%0.226SC..THydrogen-bonded Turntrans-64.8-14.4-178.228.7-35.6000113.1V41 T47 F293 I297 L298V41-P295 HydrophobicContact CG1-CG 4.37Å; T47-P295 HydrophobicContact CG2-CG 4.42Å; F293-P295 HydrophobicContact CD1-CB 4.34Å; F293-P295 HydrophobicContact CE1-CB 3.92Å; F293-P295 VanDerWaalsContact O-CD 3.22Å; F293-P295 WeakPolarHBondContact O-CD 3.43Å; P295-I297 PolarHBondContact O-N 2.9Å; P295-L298 WeakPolarHBondContact O-CB 3.26Å; P295-L298 PolarHBondContact O-N 2.74Å
296L90.3Very high91Very high79 Ų7947.5 Ų47.541%0.41425%0.251SS..THydrogen-bonded Turntrans-63.6-21.9178.2-164.258.8000112.2D294 L298 I299 Q300D294-L296 PolarHBondContact O-N 3.25Å; D294-L296 VanDerWaalsContact O-N 3.07Å; D294-L296 WeakPolarHBondContact OD1-CB 3.29Å; D294-L296 PolarHBondContact OD1-N 3.04Å; L296-L298 PolarHBondContact O-N 3.22Å; L296-I299 PolarHBondContact O-N 3.06Å; L296-Q300 HydrophobicContact CG-CG 4Å; L296-Q300 PolarHBondContact O-N 2.91Å
297I89.5Confident91.4Very high5 Ų548.9 Ų48.93%0.02626%0.263CS..Hα-helixtrans-58-32.3175.1-163.862.9000112.7F293 D294 P295 I299 Q301 V305 N367 L368 A371F293-I297 HydrophobicContact CE2-CG2 3.76Å; F293-I297 HydrophobicContact CZ-CG2 4.04Å; D294-I297 VanDerWaalsContact O-CG2 3.27Å; D294-I297 WeakPolarHBondContact O-CG2 3.47Å; D294-I297 PolarHBondContact O-N 2.83Å; P295-I297 PolarHBondContact O-N 2.9Å; I297-I299 PolarHBondContact O-N 3.48Å; I297-Q301 HydrophobicContact CD1-CB 3.89Å; I297-Q301 HydrophobicContact CD1-CG 3.9Å; I297-Q301 CarbonylContact O-C 3.38Å; I297-Q301 PolarHBondContact O-N 3.07Å; I297-V305 HydrophobicContact CG1-CG2 4.22Å; I297-V305 HydrophobicContact CG2-CG2 4.38Å; I297-N367 HydrophobicContact CB-CB 4.09Å; I297-N367 HydrophobicContact CG1-CB 4.05Å; I297-N367 HydrophobicContact CG2-CB 4.13Å; I297-L368 HydrophobicContact CG1-CD2 4.03Å; I297-A371 HydrophobicContact CG2-CB 4.45Å
298L90.8Very high91.6Very high71 Ų7148.6 Ų48.637%0.37226%0.262SS..Hα-helixtrans-64.3-29.3179.2-60.8178.6000111.9F293 P295 L296 V305 A371 L375F293-L298 HydrophobicContact CZ-CD1 4.37Å; F293-L298 HydrophobicContact CZ-CD2 4.4Å; F293-L298 HydrophobicContact CZ-CG 4.22Å; P295-L298 WeakPolarHBondContact O-CB 3.26Å; P295-L298 PolarHBondContact O-N 2.74Å; L296-L298 PolarHBondContact O-N 3.22Å; L298-V305 HydrophobicContact CD2-CG1 3.78Å; L298-V305 HydrophobicContact CD2-CG2 4.15Å; L298-A371 HydrophobicContact CD2-CB 4.02Å; L298-L375 HydrophobicContact CD2-CD1 4.43Å
299I93Very high91.9Very high135 Ų13549.1 Ų49.169%0.69226%0.264SS*.Hα-helixtrans-95.3-40.1-178.9-57176000110.5L296 I297 P302L296-I299 PolarHBondContact O-N 3.06Å; I297-I299 PolarHBondContact O-N 3.48Å; I299-P302 WeakPolarHBondContact O-CD 3.35Å
300Q91.6Very high92.3Very high124 Ų12450.7 Ų50.758%0.57928%0.278SS*.Hα-helixtrans-75.3-38.9-177.1-72-177.33.200113.2L296 P302L296-Q300 HydrophobicContact CG-CG 4Å; L296-Q300 PolarHBondContact O-N 2.91Å; Q300-P302 VanDerWaalsContact C-CD 3.44Å
301Q91.6Very high92.6Very high68 Ų6851.7 Ų51.732%0.31828%0.283SS..  trans-131.955-176-57.2-172.311.600112.2I297 L303 A304 V305I297-Q301 HydrophobicContact CD1-CB 3.89Å; I297-Q301 HydrophobicContact CD1-CG 3.9Å; I297-Q301 CarbonylContact O-C 3.38Å; I297-Q301 PolarHBondContact O-N 3.07Å; Q301-L303 PolarHBondContact O-N 3.42Å; Q301-A304 HydrophobicContact CB-CB 4.01Å; Q301-A304 PolarHBondContact O-N 3.22Å; Q301-V305 PolarHBondContact O-N 3.45Å; Q301-V305 VanDerWaalsContact O-N 3.08Å
302P94Very high92.9Very high61 Ų6151.3 Ų51.340%0.39628%0.281SS..Hα-helixtrans-59.1-35.7-175.923.9-34.2000112.2I299 Q300 V305 L306I299-P302 WeakPolarHBondContact O-CD 3.35Å; Q300-P302 VanDerWaalsContact C-CD 3.44Å; P302-V305 PolarHBondContact O-N 2.9Å; P302-L306 WeakPolarHBondContact O-CB 3.11Å; P302-L306 VanDerWaalsContact O-CG 3.26Å; P302-L306 WeakPolarHBondContact O-CG 3.36Å; P302-L306 PolarHBondContact O-N 3.32Å
303L94.6Very high93.3Very high141 Ų14149 Ų4974%0.73827%0.269SS*.Hα-helixtrans-65.6-40.3177.8-66.9176.2000112.4Q301 L306 A307Q301-L303 PolarHBondContact O-N 3.42Å; L303-L306 PolarHBondContact O-N 2.71Å; L303-A307 VanDerWaalsContact O-CB 3.28Å; L303-A307 WeakPolarHBondContact O-CB 3.38Å; L303-A307 PolarHBondContact O-N 3.41Å
304A95.1Very high93.5Very high9 Ų954.4 Ų54.47%0.07429%0.293CS..Hα-helixtrans-69.5-38.5178.300000111.3L110 Q301 A307 T308 L368L110-A304 HydrophobicContact CD1-CB 4.5Å; L110-A304 HydrophobicContact CD2-CB 4.08Å; Q301-A304 HydrophobicContact CB-CB 4.01Å; Q301-A304 PolarHBondContact O-N 3.22Å; A304-A307 PolarHBondContact O-N 3.39Å; A304-T308 WeakPolarHBondContact O-CB 3.36Å; A304-T308 PolarHBondContact O-N 3.07Å; A304-T308 PolarHBondContact O-OG1 3.15Å; A304-L368 HydrophobicContact CB-CD1 3.92Å; A304-L368 HydrophobicContact CB-CD2 3.83Å
305V95.5Very high93.5Very high7 Ų753.7 Ų53.74%0.04229%0.293CS..Hα-helixtrans-63.1-48.4173.3174.90000110.7I297 L298 Q301 P302 A307 T308 L309 L368 A371 L375I297-V305 HydrophobicContact CG1-CG2 4.22Å; I297-V305 HydrophobicContact CG2-CG2 4.38Å; L298-V305 HydrophobicContact CD2-CG1 3.78Å; L298-V305 HydrophobicContact CD2-CG2 4.15Å; Q301-V305 PolarHBondContact O-N 3.45Å; Q301-V305 VanDerWaalsContact O-N 3.08Å; P302-V305 PolarHBondContact O-N 2.9Å; V305-A307 VanDerWaalsContact C-N 3.35Å; V305-A307 PolarHBondContact O-N 2.98Å; V305-T308 PolarHBondContact O-N 3.08Å; V305-L309 WeakPolarHBondContact O-CB 3.4Å; V305-L309 PolarHBondContact O-N 3.04Å; V305-L368 HydrophobicContact CB-CD2 4.38Å; V305-L368 HydrophobicContact CG2-CD2 3.6Å; V305-A371 HydrophobicContact CG1-CB 4.03Å; V305-A371 HydrophobicContact CG2-CB 4.33Å; V305-L375 HydrophobicContact CG1-CD1 3.78Å
306L95.7Very high93.7Very high107 Ų10751.9 Ų51.956%0.5628%0.281SS*.Hα-helixtrans-62.7-40.3178-74.7173.2000112.1P302 L303 L309 A310P302-L306 WeakPolarHBondContact O-CB 3.11Å; P302-L306 VanDerWaalsContact O-CG 3.26Å; P302-L306 WeakPolarHBondContact O-CG 3.36Å; P302-L306 PolarHBondContact O-N 3.32Å; L303-L306 PolarHBondContact O-N 2.71Å; L306-L309 PolarHBondContact O-N 2.98Å; L306-A310 VanDerWaalsContact O-CB 3.27Å; L306-A310 WeakPolarHBondContact O-CB 3.27Å; L306-A310 PolarHBondContact O-N 3.23Å
307A96.3Very high93.7Very high34 Ų3448.5 Ų48.528%0.28126%0.264SS..Hα-helixtrans-64.4-44.7175.400000111.6L106 L303 A304 V305 A310 I311L106-A307 HydrophobicContact CD1-CB 3.81Å; L106-A307 HydrophobicContact CD2-CB 3.87Å; L303-A307 VanDerWaalsContact O-CB 3.28Å; L303-A307 WeakPolarHBondContact O-CB 3.38Å; L303-A307 PolarHBondContact O-N 3.41Å; A304-A307 PolarHBondContact O-N 3.39Å; V305-A307 VanDerWaalsContact C-N 3.35Å; V305-A307 PolarHBondContact O-N 2.98Å; A307-A310 PolarHBondContact O-N 3.2Å; A307-I311 WeakPolarHBondContact O-CG1 3.14Å; A307-I311 PolarHBondContact O-N 2.94Å
308T96.4Very high93.9Very high0 Ų052.4 Ų52.40%029%0.285CS..Hα-helixtrans-60-47.5175.8-56.10000110.9F120 L124 A304 V305 A310 I311 I312 L368F120-T308 HydrophobicContact CZ-CG2 3.94Å; L124-T308 HydrophobicContact CD1-CG2 4.14Å; L124-T308 HydrophobicContact CD2-CG2 3.65Å; A304-T308 WeakPolarHBondContact O-CB 3.36Å; A304-T308 PolarHBondContact O-N 3.07Å; A304-T308 PolarHBondContact O-OG1 3.15Å; V305-T308 PolarHBondContact O-N 3.08Å; T308-A310 VanDerWaalsContact C-N 3.34Å; T308-A310 PolarHBondContact O-N 3.14Å; T308-I311 PolarHBondContact O-N 3.37Å; T308-I312 HydrophobicContact CG2-CD1 4.12Å; T308-I312 WeakPolarHBondContact O-CG1 3.47Å; T308-I312 PolarHBondContact O-N 2.78Å; T308-L368 HydrophobicContact CG2-CB 4.44Å
309L96.1Very high94Very high18 Ų1849.7 Ų49.79%0.09427%0.272CS..Hα-helixtrans-61.7-41.2176.4-177.462.7000111.8V305 L306 I311 I312 L313 L375 L379V305-L309 WeakPolarHBondContact O-CB 3.4Å; V305-L309 PolarHBondContact O-N 3.04Å; L306-L309 PolarHBondContact O-N 2.98Å; L309-I311 VanDerWaalsContact C-N 3.34Å; L309-I311 PolarHBondContact O-N 3.37Å; L309-I312 PolarHBondContact O-N 3.13Å; L309-L313 HydrophobicContact CD1-CD1 3.82Å; L309-L313 HydrophobicContact CD1-CD2 4.34Å; L309-L313 HydrophobicContact CD1-CG 3.78Å; L309-L313 HydrophobicContact CD2-CD1 4.26Å; L309-L313 HydrophobicContact CG-CD1 3.75Å; L309-L313 HydrophobicContact CG-CG 4.07Å; L309-L313 WeakPolarHBondContact O-CB 3.37Å; L309-L313 WeakPolarHBondContact O-CG 3.31Å; L309-L313 PolarHBondContact O-N 3.03Å; L309-L375 HydrophobicContact CD1-CB 3.76Å; L309-L375 HydrophobicContact CD2-CB 4.03Å; L309-L375 HydrophobicContact CD2-CD1 4.17Å; L309-L375 HydrophobicContact CG-CB 4.49Å; L309-L379 HydrophobicContact CD1-CD1 4.46Å; L309-L379 HydrophobicContact CD2-CD1 4.01Å
310A95.9Very high94Very high44 Ų4443.2 Ų43.236%0.36424%0.239SC..Hα-helixtrans-64.9-37.3177.500000112.3L306 A307 T308 I312 F314 G315L306-A310 VanDerWaalsContact O-CB 3.27Å; L306-A310 WeakPolarHBondContact O-CB 3.27Å; L306-A310 PolarHBondContact O-N 3.23Å; A307-A310 PolarHBondContact O-N 3.2Å; T308-A310 VanDerWaalsContact C-N 3.34Å; T308-A310 PolarHBondContact O-N 3.14Å; A310-I312 VanDerWaalsContact C-N 3.35Å; A310-F314 HydrophobicContact CB-CD2 4.42Å; A310-F314 WeakPolarHBondContact O-CA 3.47Å; A310-F314 WeakPolarHBondContact O-CB 3.2Å; A310-F314 PolarHBondContact O-N 2.74Å; A310-G315 PolarHBondContact O-N 3.03Å
311I95.7Very high94.1Very high21 Ų2139.2 Ų39.211%0.10822%0.22CC..Iπ-helixtrans-63-43.1173.3-68.2167000110.6L102 L106 L124 A307 T308 L309 G315 K316L102-I311 HydrophobicContact CB-CD1 4.29Å; L102-I311 HydrophobicContact CB-CG1 4.23Å; L102-I311 HydrophobicContact CB-CG2 3.81Å; L102-I311 HydrophobicContact CD1-CG2 4.23Å; L106-I311 HydrophobicContact CB-CD1 3.88Å; L106-I311 HydrophobicContact CD2-CD1 3.72Å; L106-I311 HydrophobicContact CG-CD1 4.43Å; L124-I311 HydrophobicContact CD1-CB 4.32Å; L124-I311 HydrophobicContact CD1-CD1 4.4Å; L124-I311 HydrophobicContact CD1-CG2 3.87Å; A307-I311 WeakPolarHBondContact O-CG1 3.14Å; A307-I311 PolarHBondContact O-N 2.94Å; T308-I311 PolarHBondContact O-N 3.37Å; L309-I311 VanDerWaalsContact C-N 3.34Å; L309-I311 PolarHBondContact O-N 3.37Å; I311-G315 CarbonylContact O-C 3.55Å; I311-G315 WeakPolarHBondContact O-CA 3.41Å; I311-G315 PolarHBondContact O-N 3.23Å; I311-K316 PolarHBondContact O-N 3.5Å
312I95.3Very high94.2Very high0 Ų042.2 Ų42.20%023%0.232CC..Iπ-helixtrans-67.5-50.2178.9-64.6162.7000111.5L124 T308 L309 A310 K316 S317 I344L124-I312 HydrophobicContact CD2-CD1 4.01Å; L124-I312 HydrophobicContact CD2-CG1 4.09Å; T308-I312 HydrophobicContact CG2-CD1 4.12Å; T308-I312 WeakPolarHBondContact O-CG1 3.47Å; T308-I312 PolarHBondContact O-N 2.78Å; L309-I312 PolarHBondContact O-N 3.13Å; A310-I312 VanDerWaalsContact C-N 3.35Å; I312-K316 WeakPolarHBondContact O-CG 3.22Å; I312-S317 PolarHBondContact O-OG 3.46Å; I312-I344 HydrophobicContact CD1-CD1 3.65Å; I312-I344 HydrophobicContact CD1-CG1 4.03Å; I312-I344 HydrophobicContact CD1-CG2 4.29Å; I312-I344 HydrophobicContact CG1-CD1 4.38Å; I312-I344 HydrophobicContact CG1-CG2 3.97Å; I312-I344 HydrophobicContact CG2-CG2 3.87Å
313L93.7Very high94.1Very high22 Ų2240.7 Ų40.712%0.11522%0.221CC..Iπ-helixtrans-75.4-40.5-173.8-68.5-176.9000113L309 S317 A342 L379L309-L313 HydrophobicContact CD1-CD1 3.82Å; L309-L313 HydrophobicContact CD1-CD2 4.34Å; L309-L313 HydrophobicContact CD1-CG 3.78Å; L309-L313 HydrophobicContact CD2-CD1 4.26Å; L309-L313 HydrophobicContact CG-CD1 3.75Å; L309-L313 HydrophobicContact CG-CG 4.07Å; L309-L313 WeakPolarHBondContact O-CB 3.37Å; L309-L313 WeakPolarHBondContact O-CG 3.31Å; L309-L313 PolarHBondContact O-N 3.03Å; L313-S317 WeakPolarHBondContact O-CB 3.35Å; L313-S317 PolarHBondContact O-OG 3.48Å; L313-A342 VanDerWaalsContact CD2-O 3.27Å; L313-A342 WeakPolarHBondContact CD2-O 3.47Å; L313-L379 HydrophobicContact CD1-CD1 3.78Å
314F93.5Very high93.9Very high126 Ų12634 Ų3455%0.55319%0.185SC*.Iπ-helixtrans-114-46.5-173.4-57.8-70.7000111.9A310 S317 L318A310-F314 HydrophobicContact CB-CD2 4.42Å; A310-F314 WeakPolarHBondContact O-CA 3.47Å; A310-F314 WeakPolarHBondContact O-CB 3.2Å; A310-F314 PolarHBondContact O-N 2.74Å; F314-S317 PolarHBondContact O-N 3.1Å; F314-L318 HydrophobicContact CB-CD1 4.29Å; F314-L318 WeakPolarHBondContact O-CB 3.1Å; F314-L318 WeakPolarHBondContact O-CD1 3.26Å; F314-L318 WeakPolarHBondContact O-CG 3.36Å; F314-L318 PolarHBondContact O-N 2.9Å
315G91.6Very high93.7Very high17 Ų1738.7 Ų38.718%0.17520%0.201CC..Iπ-helixtrans-54.8-60.1-174.500000112.9A310 I311 A319A310-G315 PolarHBondContact O-N 3.03Å; I311-G315 CarbonylContact O-C 3.55Å; I311-G315 WeakPolarHBondContact O-CA 3.41Å; I311-G315 PolarHBondContact O-N 3.23Å; G315-A319 PolarHBondContact O-N 2.95Å
316K90.8Very high93.5Very high1 Ų145.3 Ų45.30%0.00424%0.236CC..Hα-helixtrans-73.1-35.5178.562161.7177.6155.30114Q95 A99 I311 I312 L318 A319 A320 L341 Q343Q95-K316 HydrophobicContact CG-CB 4.2Å; A99-K316 HydrophobicContact CB-CB 4.14Å; I311-K316 PolarHBondContact O-N 3.5Å; I312-K316 WeakPolarHBondContact O-CG 3.22Å; K316-L318 VanDerWaalsContact C-N 3.35Å; K316-L318 PolarHBondContact O-N 2.95Å; K316-A319 WeakPolarHBondContact O-CB 3.42Å; K316-A319 PolarHBondContact O-N 3.39Å; K316-A320 PolarHBondContact O-N 2.94Å; K316-L341 WeakPolarHBondContact CE-O 3.4Å; K316-L341 PolarHBondContact NZ-O 3.13Å; K316-Q343 WeakPolarHBondContact CE-O 3.27Å; K316-Q343 PolarHBondContact NZ-O 3.22Å
317S91.5Very high93.1Very high8 Ų844.1 Ų44.16%0.05623%0.226CC..Hα-helixtrans-65.6-38.7-180-47.30000111.8I312 L313 F314 A320 F321 A338 A342I312-S317 PolarHBondContact O-OG 3.46Å; L313-S317 WeakPolarHBondContact O-CB 3.35Å; L313-S317 PolarHBondContact O-OG 3.48Å; F314-S317 PolarHBondContact O-N 3.1Å; S317-A320 PolarHBondContact O-N 3.49Å; S317-F321 WeakPolarHBondContact O-CB 3.38Å; S317-F321 PolarHBondContact O-N 2.92Å; S317-A338 WeakPolarHBondContact CB-O 3.3Å; S317-A338 VanDerWaalsContact O-CB 3.24Å; S317-A338 WeakPolarHBondContact O-CB 3.35Å; S317-A338 PolarHBondContact OG-O 3.5Å; S317-A342 WeakPolarHBondContact OG-CA 3.2Å; S317-A342 VanDerWaalsContact OG-CB 3.26Å; S317-A342 WeakPolarHBondContact OG-CB 3.47Å
318L93.7Very high92.5Very high87 Ų8745.6 Ų45.646%0.45525%0.245SC..Hα-helixtrans-64.5-42.5172.4-73.5169.6000110.8F314 K316 A320 F321 F322F314-L318 HydrophobicContact CB-CD1 4.29Å; F314-L318 WeakPolarHBondContact O-CB 3.1Å; F314-L318 WeakPolarHBondContact O-CD1 3.26Å; F314-L318 WeakPolarHBondContact O-CG 3.36Å; F314-L318 PolarHBondContact O-N 2.9Å; K316-L318 VanDerWaalsContact C-N 3.35Å; K316-L318 PolarHBondContact O-N 2.95Å; L318-A320 VanDerWaalsContact C-N 3.35Å; L318-A320 PolarHBondContact O-N 3.28Å; L318-F321 PolarHBondContact O-N 3.09Å; L318-F322 HydrophobicContact CB-CD2 4.4Å; L318-F322 HydrophobicContact CB-CE2 4.24Å; L318-F322 HydrophobicContact CD2-CE2 4.31Å; L318-F322 WeakPolarHBondContact O-CD2 3.4Å; L318-F322 PolarHBondContact O-N 3.45Å
319A92.9Very high91.8Very high13 Ų1347 Ų4711%0.10725%0.251CS..Hα-helixtrans-58.1-48175.100000111.2Q95 V98 G315 K316 F321 F322 L323Q95-A319 HydrophobicContact CG-CB 4.47Å; V98-A319 HydrophobicContact CB-CB 4.02Å; V98-A319 HydrophobicContact CG1-CB 3.75Å; V98-A319 HydrophobicContact CG2-CB 4.33Å; G315-A319 PolarHBondContact O-N 2.95Å; K316-A319 WeakPolarHBondContact O-CB 3.42Å; K316-A319 PolarHBondContact O-N 3.39Å; A319-F321 PolarHBondContact O-N 2.92Å; A319-F322 PolarHBondContact O-N 3.39Å; A319-L323 WeakPolarHBondContact O-CB 3.45Å; A319-L323 WeakPolarHBondContact O-CD1 3.42Å; A319-L323 WeakPolarHBondContact O-CG 3.44Å; A319-L323 PolarHBondContact O-N 3.22Å
320A92.8Very high91.3Very high0 Ų047.6 Ų47.60%026%0.257CS..Hα-helixtrans-59.3-47175.200000112W153 K316 S317 L318 F322 L323 V324 L341W153-A320 HydrophobicContact CH2-CB 4.33Å; W153-A320 HydrophobicContact CZ2-CB 4.14Å; K316-A320 PolarHBondContact O-N 2.94Å; S317-A320 PolarHBondContact O-N 3.49Å; L318-A320 VanDerWaalsContact C-N 3.35Å; L318-A320 PolarHBondContact O-N 3.28Å; A320-F322 PolarHBondContact O-N 2.88Å; A320-L323 PolarHBondContact O-N 2.89Å; A320-V324 WeakPolarHBondContact O-CB 3.34Å; A320-V324 VanDerWaalsContact O-CG2 3.27Å; A320-V324 WeakPolarHBondContact O-CG2 3.44Å; A320-V324 PolarHBondContact O-N 3.23Å; A320-L341 HydrophobicContact CB-CD1 3.93Å
321F93.6Very high90.8Very high39 Ų3949.5 Ų49.517%0.17126%0.258CS..Hα-helixtrans-55.4-51.8176.8174.4-97.5000112S317 L318 A319 L323 V324 R325 Q331 A334 L335 A338S317-F321 WeakPolarHBondContact O-CB 3.38Å; S317-F321 PolarHBondContact O-N 2.92Å; L318-F321 PolarHBondContact O-N 3.09Å; A319-F321 PolarHBondContact O-N 2.92Å; F321-L323 PolarHBondContact O-N 3.45Å; F321-V324 PolarHBondContact O-N 3.4Å; F321-R325 HydrophobicContact CD1-CG 4.45Å; F321-R325 HydrophobicContact CD2-CG 4.47Å; F321-R325 HydrophobicContact CE1-CG 4.05Å; F321-R325 HydrophobicContact CE2-CG 4.06Å; F321-R325 HydrophobicContact CZ-CG 3.84Å; F321-R325 VanDerWaalsContact O-CG 3.31Å; F321-R325 WeakPolarHBondContact O-CG 3.31Å; F321-R325 PolarHBondContact O-N 3.1Å; F321-Q331 HydrophobicContact CE2-CG 4.41Å; F321-A334 HydrophobicContact CD2-CB 3.51Å; F321-A334 HydrophobicContact CE2-CB 3.72Å; F321-A334 HydrophobicContact CG-CB 4.36Å; F321-L335 HydrophobicContact CD2-CD2 3.79Å; F321-L335 HydrophobicContact CD2-CG 4.05Å; F321-L335 HydrophobicContact CE2-CD2 3.73Å; F321-L335 HydrophobicContact CE2-CG 3.77Å; F321-A338 HydrophobicContact CB-CB 3.91Å
322F93.4Very high90.3Very high131 Ų13151.1 Ų51.158%0.57526%0.263SS*.Hα-helixtrans-65.8-39.6-178.7-73.8-62.2000112.2L318 A319 A320 R325 L326L318-F322 HydrophobicContact CB-CD2 4.4Å; L318-F322 HydrophobicContact CB-CE2 4.24Å; L318-F322 HydrophobicContact CD2-CE2 4.31Å; L318-F322 WeakPolarHBondContact O-CD2 3.4Å; L318-F322 PolarHBondContact O-N 3.45Å; A319-F322 PolarHBondContact O-N 3.39Å; A320-F322 PolarHBondContact O-N 2.88Å; F322-R325 PolarHBondContact O-N 3.35Å; F322-L326 VanDerWaalsContact O-CB 3.29Å; F322-L326 WeakPolarHBondContact O-CB 3.38Å; F322-L326 PolarHBondContact O-N 2.9Å
323L92.2Very high89.8Confident30 Ų3051.4 Ų51.416%0.15726%0.264CS..Hα-helixtrans-62-49.7176.6-72.8164.8000110.7G91 A94 Q95 W153 A319 A320 F321 R325 L326 F327G91-L323 WeakPolarHBondContact O-CD1 3.48Å; A94-L323 HydrophobicContact CB-CD1 3.74Å; A94-L323 HydrophobicContact CB-CD2 3.84Å; A94-L323 HydrophobicContact CB-CG 4.47Å; Q95-L323 HydrophobicContact CB-CD1 4.08Å; W153-L323 HydrophobicContact CH2-CB 4.13Å; W153-L323 HydrophobicContact CH2-CD1 4.13Å; W153-L323 HydrophobicContact CZ2-CD1 4.42Å; A319-L323 WeakPolarHBondContact O-CB 3.45Å; A319-L323 WeakPolarHBondContact O-CD1 3.42Å; A319-L323 WeakPolarHBondContact O-CG 3.44Å; A319-L323 PolarHBondContact O-N 3.22Å; A320-L323 PolarHBondContact O-N 2.89Å; F321-L323 PolarHBondContact O-N 3.45Å; L323-R325 VanDerWaalsContact C-N 3.32Å; L323-R325 PolarHBondContact O-N 3.04Å; L323-L326 WeakPolarHBondContact O-CB 3.37Å; L323-L326 PolarHBondContact O-N 3.23Å; L323-L326 VanDerWaalsContact O-N 3.12Å; L323-F327 WeakPolarHBondContact O-CD2 3.35Å; L323-F327 PolarHBondContact O-N 3.03Å
324V89.9Confident89.6Confident0 Ų050.3 Ų50.30%026%0.259CS..Hα-helixtrans-61-41.2179174.80000111.5W153 A320 F321 F327 H329 T333 A334 I337W153-V324 HydrophobicContact CH2-CG2 4.44Å; W153-V324 HydrophobicContact CZ3-CG2 3.91Å; A320-V324 WeakPolarHBondContact O-CB 3.34Å; A320-V324 VanDerWaalsContact O-CG2 3.27Å; A320-V324 WeakPolarHBondContact O-CG2 3.44Å; A320-V324 PolarHBondContact O-N 3.23Å; F321-V324 PolarHBondContact O-N 3.4Å; V324-F327 PolarHBondContact O-N 3.03Å; V324-H329 HydrophobicContact CG1-CB 3.54Å; V324-H329 PolarHBondContact O-N 2.9Å; V324-T333 HydrophobicContact CG1-CG2 4.11Å; V324-A334 HydrophobicContact CB-CB 3.92Å; V324-A334 HydrophobicContact CG1-CB 3.71Å; V324-I337 HydrophobicContact CG1-CD1 4.04Å; V324-I337 HydrophobicContact CG2-CB 4.32Å; V324-I337 HydrophobicContact CG2-CD1 3.8Å; V324-I337 HydrophobicContact CG2-CG2 4.07Å
325R91Very high89.5Confident107 Ų10746.1 Ų46.140%0.40424%0.242SC..Hα-helixtrans-64.7-38.7174.4-70.4-66.2-70.2127.1-2.4112.7F321 F322 L323 F327 G328 H329 A334F321-R325 HydrophobicContact CD1-CG 4.45Å; F321-R325 HydrophobicContact CD2-CG 4.47Å; F321-R325 HydrophobicContact CE1-CG 4.05Å; F321-R325 HydrophobicContact CE2-CG 4.06Å; F321-R325 HydrophobicContact CZ-CG 3.84Å; F321-R325 VanDerWaalsContact O-CG 3.31Å; F321-R325 WeakPolarHBondContact O-CG 3.31Å; F321-R325 PolarHBondContact O-N 3.1Å; F322-R325 PolarHBondContact O-N 3.35Å; L323-R325 VanDerWaalsContact C-N 3.32Å; L323-R325 PolarHBondContact O-N 3.04Å; R325-F327 VanDerWaalsContact C-N 3.28Å; R325-F327 PolarHBondContact O-N 2.89Å; R325-G328 PolarHBondContact O-N 3.43Å; R325-H329 PolarHBondContact NH1-O 3.46Å; R325-A334 HydrophobicContact CG-CB 3.7Å
326L91Very high89.3Confident147 Ų14745.8 Ų45.877%0.7724%0.237SC*.Hα-helixtrans-65.2-33.3177.7-170.571.7000111.7F322 L323 G328F322-L326 VanDerWaalsContact O-CB 3.29Å; F322-L326 WeakPolarHBondContact O-CB 3.38Å; F322-L326 PolarHBondContact O-N 2.9Å; L323-L326 WeakPolarHBondContact O-CB 3.37Å; L323-L326 PolarHBondContact O-N 3.23Å; L323-L326 VanDerWaalsContact O-N 3.12Å; L326-G328 PolarHBondContact O-N 3.41Å
327F88.7Confident89.2Confident82 Ų8245.8 Ų45.836%0.3624%0.237SC..THydrogen-bonded Turntrans-76.67.3172.8-72.4-68.5000114I87 P90 L323 V324 R325I87-F327 HydrophobicContact CG1-CB 4.02Å; I87-F327 HydrophobicContact CG1-CG 4.21Å; I87-F327 HydrophobicContact CG2-CB 4.48Å; I87-F327 HydrophobicContact CG2-CD2 4.21Å; I87-F327 HydrophobicContact CG2-CG 4.47Å; P90-F327 HydrophobicContact CB-CZ 3.97Å; P90-F327 HydrophobicContact CG-CE1 4.2Å; P90-F327 HydrophobicContact CG-CE2 4.3Å; P90-F327 HydrophobicContact CG-CZ 3.64Å; L323-F327 WeakPolarHBondContact O-CD2 3.35Å; L323-F327 PolarHBondContact O-N 3.03Å; V324-F327 PolarHBondContact O-N 3.03Å; R325-F327 VanDerWaalsContact C-N 3.28Å; R325-F327 PolarHBondContact O-N 2.89Å
328G82.2Confident89.3Confident65 Ų6545.9 Ų45.967%0.6724%0.237SC*.THydrogen-bonded Turntrans84.67.2172.400000114.9R325 L326R325-G328 PolarHBondContact O-N 3.43Å; L326-G328 PolarHBondContact O-N 3.41Å
329H83.4Confident89.2Confident29 Ų2942 Ų4213%0.13422%0.219CC..  trans-77.4159.2176.2-71.3-83.1000112.3I87 V324 R325 T333I87-H329 WeakPolarHBondContact CD1-NE2 3.47Å; I87-H329 WeakPolarHBondContact CG1-NE2 3.44Å; V324-H329 HydrophobicContact CG1-CB 3.54Å; V324-H329 PolarHBondContact O-N 2.9Å; R325-H329 PolarHBondContact NH1-O 3.46Å; H329-T333 HydrophobicContact CB-CG2 4Å
330S84.3Confident88.9Confident30 Ų3041.5 Ų41.521%0.2121%0.214CC..  trans-66.7160.3-175.390.50000112.8R332 T333 A334 E403S330-R332 VanDerWaalsContact C-N 3.29Å; S330-R332 PolarHBondContact O-N 2.78Å; S330-T333 PolarHBondContact O-N 3.5Å; S330-T333 PolarHBondContact OG-N 3.16Å; S330-T333 PolarHBondContact OG-OG1 3.45Å; S330-A334 PolarHBondContact O-N 3.01Å; S330-E403 WeakPolarHBondContact CB-OE1 3.14Å; S330-E403 PolarHBondContact OG-OE1 3.47Å
331Q85.8Confident88.8Confident84 Ų8441.5 Ų41.539%0.39321%0.214SC..Hα-helixtrans-64.3-37.5-179.5-180168.9-34.300111.4F321 A334 L335F321-Q331 HydrophobicContact CE2-CG 4.41Å; Q331-A334 PolarHBondContact O-N 3.44Å; Q331-L335 HydrophobicContact CG-CD1 3.86Å; Q331-L335 HydrophobicContact CG-CG 4.32Å; Q331-L335 WeakPolarHBondContact O-CB 3.49Å; Q331-L335 WeakPolarHBondContact O-CG 3.28Å; Q331-L335 PolarHBondContact O-N 3.06Å
332R85.6Confident88.7Confident56 Ų5639.7 Ų39.721%0.21121%0.206CC..Hα-helixtrans-60.2-50.5174.7-158.1168173.3167-20.4111.5R146 S330 A334 L335 T336 L391 E395 E403R146-R332 VanDerWaalsContact NH1-CG 3.33Å; S330-R332 VanDerWaalsContact C-N 3.29Å; S330-R332 PolarHBondContact O-N 2.78Å; R332-A334 VanDerWaalsContact C-N 3.33Å; R332-A334 PolarHBondContact O-N 3.38Å; R332-L335 PolarHBondContact O-N 2.93Å; R332-T336 WeakPolarHBondContact O-CB 3.3Å; R332-T336 PolarHBondContact O-N 3.28Å; R332-T336 PolarHBondContact O-OG1 3.38Å; R332-L391 HydrophobicContact CB-CD2 4.43Å; R332-L391 HydrophobicContact CG-CD1 3.8Å; R332-L391 HydrophobicContact CG-CD2 4.08Å; R332-E395 VanDerWaalsContact CB-OE1 3.23Å; R332-E395 WeakPolarHBondContact CB-OE1 3.43Å; R332-E395 WeakPolarHBondContact CD-OE1 3.48Å; R332-E395 WeakPolarHBondContact CD-OE2 3.35Å; R332-E395 VanDerWaalsContact CG-OE1 3.31Å; R332-E395 WeakPolarHBondContact CG-OE1 3.42Å; R332-E395 IonicContact CZ-OE2 2.97Å; R332-E395 IonicContact NE-OE2 3.5Å; R332-E395 IonicContact NH1-OE2 3.86Å; R332-E395 PolarHBondContact NH1-OE2 2.93Å; R332-E403 WeakPolarHBondContact CB-OE1 3.49Å; R332-E403 WeakPolarHBondContact CB-OE2 3.37Å; R332-E403 WeakPolarHBondContact CD-OE2 3.5Å
333T84.7Confident88.7Confident5 Ų533.4 Ų33.43%0.03118%0.179CC..Hα-helixtrans-56.3-48.1177.9-58.20000111.2R146 I149 V324 H329 S330 L335 T336 I337R146-T333 HydrophobicContact CG-CG2 4.11Å; I149-T333 HydrophobicContact CD1-CG2 4.31Å; V324-T333 HydrophobicContact CG1-CG2 4.11Å; H329-T333 HydrophobicContact CB-CG2 4Å; S330-T333 PolarHBondContact O-N 3.5Å; S330-T333 PolarHBondContact OG-N 3.16Å; S330-T333 PolarHBondContact OG-OG1 3.45Å; T333-L335 PolarHBondContact O-N 2.99Å; T333-T336 PolarHBondContact O-N 3.44Å; T333-I337 HydrophobicContact CG2-CD1 3.72Å; T333-I337 WeakPolarHBondContact O-CB 3.49Å; T333-I337 VanDerWaalsContact O-CG1 3.31Å; T333-I337 WeakPolarHBondContact O-CG1 3.34Å; T333-I337 PolarHBondContact O-N 3.5Å
334A89.8Confident88.7Confident0 Ų032 Ų320%017%0.171CC..Hα-helixtrans-62.8-43.1179.300000112.9F321 V324 R325 S330 Q331 R332 A338F321-A334 HydrophobicContact CD2-CB 3.51Å; F321-A334 HydrophobicContact CE2-CB 3.72Å; F321-A334 HydrophobicContact CG-CB 4.36Å; V324-A334 HydrophobicContact CB-CB 3.92Å; V324-A334 HydrophobicContact CG1-CB 3.71Å; R325-A334 HydrophobicContact CG-CB 3.7Å; S330-A334 PolarHBondContact O-N 3.01Å; Q331-A334 PolarHBondContact O-N 3.44Å; R332-A334 VanDerWaalsContact C-N 3.33Å; R332-A334 PolarHBondContact O-N 3.38Å; A334-A338 WeakPolarHBondContact O-CB 3.42Å; A334-A338 PolarHBondContact O-N 3.23Å
335L91.5Very high88.4Confident38 Ų3832 Ų3220%0.19917%0.172CC..Hα-helixtrans-70.3-39.5178.8-72.8170.7000112.3F321 Q331 R332 T333 A338 A339 L387 Y390 L391F321-L335 HydrophobicContact CD2-CD2 3.79Å; F321-L335 HydrophobicContact CD2-CG 4.05Å; F321-L335 HydrophobicContact CE2-CD2 3.73Å; F321-L335 HydrophobicContact CE2-CG 3.77Å; Q331-L335 HydrophobicContact CG-CD1 3.86Å; Q331-L335 HydrophobicContact CG-CG 4.32Å; Q331-L335 WeakPolarHBondContact O-CB 3.49Å; Q331-L335 WeakPolarHBondContact O-CG 3.28Å; Q331-L335 PolarHBondContact O-N 3.06Å; R332-L335 PolarHBondContact O-N 2.93Å; T333-L335 PolarHBondContact O-N 2.99Å; L335-A338 PolarHBondContact O-N 2.98Å; L335-A339 WeakPolarHBondContact O-CB 3.19Å; L335-A339 PolarHBondContact O-N 2.87Å; L335-L387 HydrophobicContact CB-CD1 3.46Å; L335-L387 VanDerWaalsContact CB-CD1 3.46Å; L335-L387 HydrophobicContact CB-CD2 4.24Å; L335-L387 HydrophobicContact CB-CG 4.5Å; L335-L387 HydrophobicContact CD1-CD1 3.87Å; L335-L387 HydrophobicContact CD2-CD1 4.47Å; L335-L387 HydrophobicContact CG-CD1 4.13Å; L335-L387 WeakPolarHBondContact O-CD2 3.28Å; L335-Y390 HydrophobicContact CD1-CD1 4.22Å; L335-Y390 HydrophobicContact CD1-CE1 4.08Å; L335-L391 HydrophobicContact CD1-CD2 3.75Å
336T87.5Confident87.9Confident10 Ų1027.1 Ų27.16%0.06115%0.153CC..Hα-helixtrans-61.9-46.4175.8-59.80000110.9L141 R332 T333 A339 S340L141-T336 HydrophobicContact CD1-CG2 4.29Å; R332-T336 WeakPolarHBondContact O-CB 3.3Å; R332-T336 PolarHBondContact O-N 3.28Å; R332-T336 PolarHBondContact O-OG1 3.38Å; T333-T336 PolarHBondContact O-N 3.44Å; T336-A339 PolarHBondContact O-N 3.22Å; T336-S340 WeakPolarHBondContact O-CB 2.97Å; T336-S340 PolarHBondContact O-N 3.4Å; T336-S340 PolarHBondContact O-OG 2.91Å
337I88.8Confident87.6Confident1 Ų120.2 Ų20.21%0.00512%0.117CC..Hα-helixtrans-64.8-43176.6-67.1164.5000110.9I149 A150 V324 T333 A339 S340 L341I149-I337 HydrophobicContact CB-CD1 3.98Å; I149-I337 HydrophobicContact CG2-CD1 3.44Å; I149-I337 VanDerWaalsContact CG2-CD1 3.44Å; I149-I337 HydrophobicContact CG2-CG1 4.45Å; A150-I337 HydrophobicContact CB-CG1 4.48Å; V324-I337 HydrophobicContact CG1-CD1 4.04Å; V324-I337 HydrophobicContact CG2-CB 4.32Å; V324-I337 HydrophobicContact CG2-CD1 3.8Å; V324-I337 HydrophobicContact CG2-CG2 4.07Å; T333-I337 HydrophobicContact CG2-CD1 3.72Å; T333-I337 WeakPolarHBondContact O-CB 3.49Å; T333-I337 VanDerWaalsContact O-CG1 3.31Å; T333-I337 WeakPolarHBondContact O-CG1 3.34Å; T333-I337 PolarHBondContact O-N 3.5Å; I337-A339 PolarHBondContact O-N 3.48Å; I337-S340 WeakPolarHBondContact CA-OG 3.26Å; I337-S340 PolarHBondContact O-N 3.47Å; I337-S340 PolarHBondContact O-OG 2.82Å; I337-L341 HydrophobicContact CG2-CD1 3.76Å; I337-L341 HydrophobicContact CG2-CG 4.36Å; I337-L341 WeakPolarHBondContact O-CB 3.49Å; I337-L341 VanDerWaalsContact O-CG 3.29Å; I337-L341 WeakPolarHBondContact O-CG 3.31Å; I337-L341 PolarHBondContact O-N 3.29Å
338A92.7Very high87.7Confident9 Ų916.3 Ų16.37%0.07410%0.1CC..Hα-helixtrans-61.5-44.4177.800000112.2S317 F321 A334 L335 L341 A342S317-A338 WeakPolarHBondContact CB-O 3.3Å; S317-A338 VanDerWaalsContact O-CB 3.24Å; S317-A338 WeakPolarHBondContact O-CB 3.35Å; S317-A338 PolarHBondContact OG-O 3.5Å; F321-A338 HydrophobicContact CB-CB 3.91Å; A334-A338 WeakPolarHBondContact O-CB 3.42Å; A334-A338 PolarHBondContact O-N 3.23Å; L335-A338 PolarHBondContact O-N 2.98Å; A338-L341 PolarHBondContact O-N 3.3Å; A338-A342 PolarHBondContact O-N 3.45Å
339A90.7Very high88Confident7 Ų713.6 Ų13.66%0.0587%0.069CC..Hα-helixtrans-66.7-40.2175.900000111.8L335 T336 I337 L341 A342 N380 L383 F384 L387L335-A339 WeakPolarHBondContact O-CB 3.19Å; L335-A339 PolarHBondContact O-N 2.87Å; T336-A339 PolarHBondContact O-N 3.22Å; I337-A339 PolarHBondContact O-N 3.48Å; A339-L341 PolarHBondContact O-N 2.89Å; A339-A342 WeakPolarHBondContact O-CB 3.35Å; A339-A342 PolarHBondContact O-N 2.91Å; A339-N380 PolarHBondContact O-OD1 2.98Å; A339-N380 VanDerWaalsContact O-OD1 3.13Å; A339-L383 HydrophobicContact CB-CD2 4.15Å; A339-L383 HydrophobicContact CB-CG 4.23Å; A339-F384 HydrophobicContact CB-CD1 4.32Å; A339-F384 HydrophobicContact CB-CE1 4.2Å; A339-F384 HydrophobicContact CB-CZ 4.34Å; A339-L387 HydrophobicContact CB-CD2 3.74Å
340S86.7Confident88Confident1 Ų113.8 Ų13.81%0.0077%0.071CC..Hα-helixtrans-63.9-32.3179.668.60000113.1T336 I337 F384T336-S340 WeakPolarHBondContact O-CB 2.97Å; T336-S340 PolarHBondContact O-N 3.4Å; T336-S340 PolarHBondContact O-OG 2.91Å; I337-S340 WeakPolarHBondContact CA-OG 3.26Å; I337-S340 PolarHBondContact O-N 3.47Å; I337-S340 PolarHBondContact O-OG 2.82Å; S340-F384 VanDerWaalsContact CA-CZ 3.46Å
341L90.9Very high88.3Confident1 Ų112.5 Ų12.51%0.0056%0.062CC..THydrogen-bonded Turntrans-90.4-0.1179.2-61.6175.7000113.3A127 L132 W153 L154 K316 A320 I337 A338 A339 Q343A127-L341 HydrophobicContact CB-CD2 3.8Å; L132-L341 HydrophobicContact CD1-CD2 4Å; W153-L341 HydrophobicContact CD2-CD1 4.04Å; W153-L341 HydrophobicContact CG-CD1 4.04Å; W153-L341 HydrophobicContact CZ2-CD1 4.28Å; L154-L341 HydrophobicContact CD2-CD2 3.97Å; L154-L341 HydrophobicContact CG-CD2 4.45Å; K316-L341 WeakPolarHBondContact CE-O 3.4Å; K316-L341 PolarHBondContact NZ-O 3.13Å; A320-L341 HydrophobicContact CB-CD1 3.93Å; I337-L341 HydrophobicContact CG2-CD1 3.76Å; I337-L341 HydrophobicContact CG2-CG 4.36Å; I337-L341 WeakPolarHBondContact O-CB 3.49Å; I337-L341 VanDerWaalsContact O-CG 3.29Å; I337-L341 WeakPolarHBondContact O-CG 3.31Å; I337-L341 PolarHBondContact O-N 3.29Å; A338-L341 PolarHBondContact O-N 3.3Å; A339-L341 PolarHBondContact O-N 2.89Å; L341-Q343 PolarHBondContact O-N 3.47Å
342A92.8Very high88.6Confident0 Ų08.5 Ų8.50%04%0.043CC..SBendtrans-77.327.2-17400000114.7L313 S317 A338 A339 L383L313-A342 VanDerWaalsContact CD2-O 3.27Å; L313-A342 WeakPolarHBondContact CD2-O 3.47Å; S317-A342 WeakPolarHBondContact OG-CA 3.2Å; S317-A342 VanDerWaalsContact OG-CB 3.26Å; S317-A342 WeakPolarHBondContact OG-CB 3.47Å; A338-A342 PolarHBondContact O-N 3.45Å; A339-A342 WeakPolarHBondContact O-CB 3.35Å; A339-A342 PolarHBondContact O-N 2.91Å; A342-L383 HydrophobicContact CB-CD2 3.27Å
343Q92.5Very high88.7Confident0 Ų07 Ų70%05%0.045CC..SBendtrans-145.2160.1178.955.176.324.700109.7A127 S128 V131 K316 L341 I377 N380A127-Q343 VanDerWaalsContact CA-O 3.25Å; A127-Q343 WeakPolarHBondContact CA-O 3.34Å; S128-Q343 VanDerWaalsContact N-CD 3.34Å; S128-Q343 PolarHBondContact O-NE2 3.25Å; V131-Q343 HydrophobicContact CB-CG 4.45Å; V131-Q343 HydrophobicContact CG1-CG 4.1Å; K316-Q343 WeakPolarHBondContact CE-O 3.27Å; K316-Q343 PolarHBondContact NZ-O 3.22Å; L341-Q343 PolarHBondContact O-N 3.47Å; Q343-I377 HydrophobicContact CB-CG1 4.36Å; Q343-N380 HydrophobicContact CB-CB 4.42Å; Q343-N380 HydrophobicContact CG-CB 4.42Å
344I92Very high88.8Confident0 Ų09 Ų90%06%0.055CC..  trans-117.5154.1174.464.8171.7000111.4L124 T126 I312 A348 V369 A373 S376L124-I344 HydrophobicContact CD2-CD1 4.28Å; L124-I344 WeakPolarHBondContact O-CG2 3.33Å; T126-I344 WeakPolarHBondContact O-CA 3.46Å; T126-I344 VanDerWaalsContact O-CB 3.23Å; T126-I344 WeakPolarHBondContact O-CB 3.18Å; T126-I344 WeakPolarHBondContact O-CG2 3.41Å; I312-I344 HydrophobicContact CD1-CD1 3.65Å; I312-I344 HydrophobicContact CD1-CG1 4.03Å; I312-I344 HydrophobicContact CD1-CG2 4.29Å; I312-I344 HydrophobicContact CG1-CD1 4.38Å; I312-I344 HydrophobicContact CG1-CG2 3.97Å; I312-I344 HydrophobicContact CG2-CG2 3.87Å; I344-A348 HydrophobicContact CB-CB 4.19Å; I344-A348 HydrophobicContact CD1-CB 3.92Å; I344-A348 HydrophobicContact CG1-CB 4.32Å; I344-V369 HydrophobicContact CD1-CG1 4.06Å; I344-A373 HydrophobicContact CD1-CB 3.8Å; I344-A373 VanDerWaalsContact CG1-CA 3.48Å; I344-A373 HydrophobicContact CG1-CB 3.51Å; I344-S376 PolarHBondContact N-OG 2.92Å
345G83.7Confident88.9Confident1 Ų19 Ų91%0.016%0.055CC..  trans-129-156.3-168.100000116.9S128 F347 A348 F349S128-G345 VanDerWaalsContact CB-CA 3.45Å; G345-F347 VanDerWaalsContact C-N 3.29Å; G345-F347 PolarHBondContact O-N 3.45Å; G345-A348 VanDerWaalsContact O-CB 3.28Å; G345-A348 WeakPolarHBondContact O-CB 3.22Å; G345-A348 PolarHBondContact O-N 3.4Å; G345-F349 WeakPolarHBondContact O-CD2 3.24Å
346E81.3Confident88.9Confident4 Ų49.5 Ų9.52%0.0196%0.058CC..Hα-helixtrans-46.1-45-177.349.4-90.4-146.200114.1M69 S128 F285 A348 F349 I350M69-E346 HydrophobicContact CE-CG 4.36Å; S128-E346 WeakPolarHBondContact CB-OE2 3.32Å; S128-E346 PolarHBondContact OG-OE2 3.44Å; F285-E346 HydrophobicContact CE1-CB 3.94Å; F285-E346 HydrophobicContact CZ-CB 4.2Å; E346-A348 VanDerWaalsContact C-N 3.33Å; E346-A348 PolarHBondContact O-N 3.2Å; E346-F349 PolarHBondContact O-N 2.81Å; E346-I350 WeakPolarHBondContact O-CG1 3.47Å; E346-I350 PolarHBondContact O-N 3.19Å; E346-I350 VanDerWaalsContact O-N 3.15Å
347F85.2Confident88.9Confident1 Ų112.7 Ų12.70%0.0049%0.085CC..Hα-helixtrans-64.4-35.5179.4-75.7-73.8000113.3M69 T126 D158 M161 V162 L165 G345 F349 I350 L351M69-F347 HydrophobicContact CE-CE1 4.21Å; M69-F347 HydrophobicContact CE-CE2 3.82Å; M69-F347 HydrophobicContact CE-CZ 3.6Å; M69-F347 HydrophobicContact SD-CE1 3.49Å; M69-F347 WeakPolarHBondContact SD-CE1 3.32Å; M69-F347 HydrophobicContact SD-CE2 4.01Å; M69-F347 HydrophobicContact SD-CZ 3.15Å; M69-F347 WeakPolarHBondContact SD-CZ 3.46Å; T126-F347 HydrophobicContact CG2-CB 4.29Å; D158-F347 HydrophobicContact CB-CE2 3.79Å; D158-F347 HydrophobicContact CB-CZ 4.07Å; D158-F347 WeakPolarHBondContact OD1-CD2 3.34Å; D158-F347 WeakPolarHBondContact OD1-CE2 3.34Å; M161-F347 HydrophobicContact CB-CB 4.15Å; M161-F347 HydrophobicContact CB-CD1 3.73Å; M161-F347 HydrophobicContact CB-CE1 4.25Å; M161-F347 HydrophobicContact CB-CG 3.95Å; M161-F347 HydrophobicContact CG-CB 4.18Å; M161-F347 HydrophobicContact CG-CG 4.38Å; V162-F347 HydrophobicContact CG2-CE1 3.68Å; V162-F347 HydrophobicContact CG2-CZ 3.94Å; L165-F347 HydrophobicContact CD1-CD1 4.2Å; L165-F347 HydrophobicContact CD1-CE1 4.48Å; G345-F347 VanDerWaalsContact C-N 3.29Å; G345-F347 PolarHBondContact O-N 3.45Å; F347-F349 VanDerWaalsContact C-N 3.27Å; F347-F349 PolarHBondContact O-N 2.97Å; F347-I350 PolarHBondContact O-N 3.07Å; F347-L351 WeakPolarHBondContact O-CB 3.44Å; F347-L351 PolarHBondContact O-N 3.1Å
348A90.8Very high89Confident0 Ų014.7 Ų14.70%010%0.095CC..Hα-helixtrans-61.8-38.4176.800000111.3C123 I344 G345 E346 A352 V369C123-A348 HydrophobicContact CB-CB 4.39Å; C123-A348 WeakPolarHBondContact O-CB 3.19Å; I344-A348 HydrophobicContact CB-CB 4.19Å; I344-A348 HydrophobicContact CD1-CB 3.92Å; I344-A348 HydrophobicContact CG1-CB 4.32Å; G345-A348 VanDerWaalsContact O-CB 3.28Å; G345-A348 WeakPolarHBondContact O-CB 3.22Å; G345-A348 PolarHBondContact O-N 3.4Å; E346-A348 VanDerWaalsContact C-N 3.33Å; E346-A348 PolarHBondContact O-N 3.2Å; A348-A352 WeakPolarHBondContact O-CB 3.4Å; A348-A352 PolarHBondContact O-N 3.44Å; A348-V369 HydrophobicContact CB-CG1 3.91Å
349F86.9Confident88.9Confident8 Ų820.5 Ų20.54%0.03513%0.125CC..Hα-helixtrans-70.2-45178-52-52.4000112.3L37 F285 F286 V289 G345 E346 F347 A352 G353 L370 A373L37-F349 HydrophobicContact CD1-CZ 4.24Å; L37-F349 HydrophobicContact CD2-CZ 4.35Å; F285-F349 HydrophobicContact CE1-CD2 4.31Å; F285-F349 HydrophobicContact CZ-CB 4.27Å; F285-F349 HydrophobicContact CZ-CD2 4.22Å; F286-F349 HydrophobicContact CD1-CE2 4.49Å; F286-F349 HydrophobicContact CE1-CE2 4.29Å; V289-F349 HydrophobicContact CG1-CB 3.78Å; V289-F349 HydrophobicContact CG1-CD1 3.57Å; V289-F349 HydrophobicContact CG1-CD2 3.93Å; V289-F349 HydrophobicContact CG1-CE1 4.06Å; V289-F349 HydrophobicContact CG1-CE2 4.43Å; V289-F349 HydrophobicContact CG1-CG 3.5Å; V289-F349 VanDerWaalsContact CG1-CG 3.5Å; V289-F349 HydrophobicContact CG1-CZ 4.48Å; V289-F349 HydrophobicContact CG2-CB 3.88Å; V289-F349 HydrophobicContact CG2-CD2 4.44Å; V289-F349 HydrophobicContact CG2-CG 4.28Å; G345-F349 WeakPolarHBondContact O-CD2 3.24Å; E346-F349 PolarHBondContact O-N 2.81Å; F347-F349 VanDerWaalsContact C-N 3.27Å; F347-F349 PolarHBondContact O-N 2.97Å; F349-A352 PolarHBondContact O-N 3.02Å; F349-G353 PolarHBondContact O-N 2.99Å; F349-L370 HydrophobicContact CD1-CD1 3.9Å; F349-L370 HydrophobicContact CD1-CG 3.92Å; F349-L370 HydrophobicContact CE1-CD1 4.49Å; F349-L370 HydrophobicContact CE1-CG 4.11Å; F349-A373 HydrophobicContact CD1-CB 4.46Å; F349-A373 HydrophobicContact CE1-CB 3.29Å; F349-A373 HydrophobicContact CZ-CB 3.37Å
350I83.6Confident89Confident34 Ų3420.7 Ų20.717%0.17413%0.125CC..Hα-helixtrans-63.3-45.7179.2-60.6163.1000109.5V65 L165 F285 E346 F347 G353 L354V65-I350 HydrophobicContact CB-CD1 4.41Å; V65-I350 HydrophobicContact CG1-CD1 3.67Å; V65-I350 HydrophobicContact CG2-CD1 3.78Å; V65-I350 HydrophobicContact CG2-CG1 4.05Å; L165-I350 HydrophobicContact CD1-CG2 3.83Å; L165-I350 HydrophobicContact CD2-CG2 3.83Å; F285-I350 HydrophobicContact CE2-CD1 4.41Å; F285-I350 HydrophobicContact CE2-CG1 3.9Å; F285-I350 HydrophobicContact CZ-CD1 4.38Å; F285-I350 HydrophobicContact CZ-CG1 4.02Å; E346-I350 WeakPolarHBondContact O-CG1 3.47Å; E346-I350 PolarHBondContact O-N 3.19Å; E346-I350 VanDerWaalsContact O-N 3.15Å; F347-I350 PolarHBondContact O-N 3.07Å; I350-G353 PolarHBondContact O-N 3.42Å; I350-L354 WeakPolarHBondContact O-CB 3.38Å; I350-L354 PolarHBondContact O-N 2.89Å
351L90.8Very high89.4Confident2 Ų220.9 Ų20.91%0.0113%0.126CC..Hα-helixtrans-66.7-39179.1-172.463.6000112L122 M161 T164 L165 L168 F347 L354 G355L122-L351 HydrophobicContact CB-CD2 3.63Å; M161-L351 HydrophobicContact SD-CD2 4.31Å; T164-L351 HydrophobicContact CG2-CD1 3.82Å; T164-L351 HydrophobicContact CG2-CD2 4.21Å; L165-L351 HydrophobicContact CD2-CB 4.13Å; L165-L351 HydrophobicContact CD2-CD1 3.73Å; L165-L351 HydrophobicContact CG-CD1 4.41Å; L168-L351 HydrophobicContact CD2-CD1 3.78Å; F347-L351 WeakPolarHBondContact O-CB 3.44Å; F347-L351 PolarHBondContact O-N 3.1Å; L351-L354 PolarHBondContact O-N 3.07Å; L351-G355 PolarHBondContact O-N 3.36Å
352A92.4Very high89.5Confident0 Ų023 Ų230%014%0.14CC..Hα-helixtrans-65.2-41.2174.100000112.1A348 F349 G355 M356 L361 Q366 V369A348-A352 WeakPolarHBondContact O-CB 3.4Å; A348-A352 PolarHBondContact O-N 3.44Å; F349-A352 PolarHBondContact O-N 3.02Å; A352-G355 PolarHBondContact O-N 2.94Å; A352-M356 WeakPolarHBondContact O-CB 3.25Å; A352-M356 VanDerWaalsContact O-CG 3.28Å; A352-M356 WeakPolarHBondContact O-CG 3.38Å; A352-M356 PolarHBondContact O-N 3.33Å; A352-L361 HydrophobicContact CB-CD2 3.79Å; A352-Q366 HydrophobicContact CB-CG 4.36Å; A352-V369 HydrophobicContact CB-CB 4.31Å; A352-V369 HydrophobicContact CB-CG1 4.19Å; A352-V369 HydrophobicContact CB-CG2 4.45Å
353G87.9Confident89.4Confident25 Ų2527.8 Ų27.826%0.25816%0.162SC..Hα-helixtrans-63.7-44.7174.900000112.7F349 I350 M356 A357F349-G353 PolarHBondContact O-N 2.99Å; I350-G353 PolarHBondContact O-N 3.42Å; G353-M356 WeakPolarHBondContact O-CB 3.38Å; G353-M356 PolarHBondContact O-N 2.76Å; G353-A357 PolarHBondContact O-N 2.83Å
354L87.1Confident89.4Confident46 Ų4629 Ų2924%0.24117%0.173CC..Hα-helixtrans-65.3-42.8175.1-177.163000111.5L165 L168 P169 I350 L351 M356 A357 L358L165-L354 HydrophobicContact CB-CD2 4.45Å; L165-L354 HydrophobicContact CD2-CB 4.35Å; L165-L354 HydrophobicContact CD2-CD2 3.68Å; L165-L354 WeakPolarHBondContact O-CD2 3.29Å; L168-L354 HydrophobicContact CB-CD2 4.28Å; L168-L354 HydrophobicContact CD2-CD2 4.09Å; L168-L354 HydrophobicContact CD2-CG 4.19Å; P169-L354 HydrophobicContact CG-CD1 4.5Å; P169-L354 HydrophobicContact CG-CD2 4.33Å; I350-L354 WeakPolarHBondContact O-CB 3.38Å; I350-L354 PolarHBondContact O-N 2.89Å; L351-L354 PolarHBondContact O-N 3.07Å; L354-M356 VanDerWaalsContact C-N 3.27Å; L354-M356 PolarHBondContact O-N 2.89Å; L354-A357 PolarHBondContact O-N 3.36Å; L354-A357 VanDerWaalsContact O-N 3.16Å; L354-L358 HydrophobicContact CD1-CD1 3.93Å; L354-L358 HydrophobicContact CD1-CG 4.11Å; L354-L358 HydrophobicContact CD2-CD1 4.42Å; L354-L358 HydrophobicContact CG-CD1 3.81Å; L354-L358 HydrophobicContact CG-CG 4.36Å; L354-L358 WeakPolarHBondContact O-CB 3.49Å; L354-L358 WeakPolarHBondContact O-CG 3.35Å; L354-L358 PolarHBondContact O-N 3.46Å
355G92Very high89.5Confident0 Ų029 Ų290%017%0.173CC..Hα-helixtrans-58.7-38.8175.400000112.5L351 A352 N359 L360 L361L351-G355 PolarHBondContact O-N 3.36Å; A352-G355 PolarHBondContact O-N 2.94Å; G355-N359 PolarHBondContact O-N 3.33Å; G355-L360 WeakPolarHBondContact O-CA 3.46Å; G355-L360 PolarHBondContact O-N 3.44Å; G355-L361 PolarHBondContact O-N 2.84Å
356M91Very high89.9Confident50 Ų5029.6 Ų29.625%0.24618%0.175CC..Hα-helixtrans-65-47.6172-77.1-73.4-61.700112.2A352 G353 L354 L358 N359 P362 Q363 Q366A352-M356 WeakPolarHBondContact O-CB 3.25Å; A352-M356 VanDerWaalsContact O-CG 3.28Å; A352-M356 WeakPolarHBondContact O-CG 3.38Å; A352-M356 PolarHBondContact O-N 3.33Å; G353-M356 WeakPolarHBondContact O-CB 3.38Å; G353-M356 PolarHBondContact O-N 2.76Å; L354-M356 VanDerWaalsContact C-N 3.27Å; L354-M356 PolarHBondContact O-N 2.89Å; M356-L358 PolarHBondContact O-N 2.92Å; M356-N359 PolarHBondContact O-N 3.04Å; M356-P362 VanDerWaalsContact SD-O 3.4Å; M356-Q363 HydrophobicContact CE-CB 3.83Å; M356-Q363 HydrophobicContact CE-CG 4.23Å; M356-Q363 WeakPolarHBondContact SD-CA 3.3Å; M356-Q363 HydrophobicContact SD-CB 4.33Å; M356-Q363 PolarHBondContact SD-N 3.01Å; M356-Q366 HydrophobicContact CG-CB 3.81Å; M356-Q366 HydrophobicContact CG-CG 4.27Å; M356-Q366 HydrophobicContact SD-CB 4.07Å
357A88Confident90.5Very high77 Ų7729.8 Ų29.864%0.63618%0.176SC*.Hα-helixtrans-62-32.218000000112.8G353 L354G353-A357 PolarHBondContact O-N 2.83Å; L354-A357 PolarHBondContact O-N 3.36Å; L354-A357 VanDerWaalsContact O-N 3.16Å
358L89.3Confident91Very high42 Ų4229.7 Ų29.722%0.2218%0.176CC..THydrogen-bonded Turntrans-90.28176.7-62.4174.3000113.6L168 P169 A172 L354 M356 L360L168-L358 HydrophobicContact CB-CD1 4.39Å; L168-L358 HydrophobicContact CD2-CD1 4.13Å; L168-L358 HydrophobicContact CG-CD1 3.9Å; P169-L358 HydrophobicContact CB-CD1 4.3Å; P169-L358 HydrophobicContact CB-CD2 4.45Å; P169-L358 HydrophobicContact CG-CD1 4.13Å; A172-L358 HydrophobicContact CB-CB 3.93Å; A172-L358 HydrophobicContact CB-CD1 3.98Å; A172-L358 HydrophobicContact CB-CD2 4.11Å; A172-L358 HydrophobicContact CB-CG 4.23Å; L354-L358 HydrophobicContact CD1-CD1 3.93Å; L354-L358 HydrophobicContact CD1-CG 4.11Å; L354-L358 HydrophobicContact CD2-CD1 4.42Å; L354-L358 HydrophobicContact CG-CD1 3.81Å; L354-L358 HydrophobicContact CG-CG 4.36Å; L354-L358 WeakPolarHBondContact O-CB 3.49Å; L354-L358 WeakPolarHBondContact O-CG 3.35Å; L354-L358 PolarHBondContact O-N 3.46Å; M356-L358 PolarHBondContact O-N 2.92Å; L358-L360 HydrophobicContact CB-CD1 4.27Å; L358-L360 HydrophobicContact CB-CG 4.06Å; L358-L360 HydrophobicContact CD1-CD1 4.49Å; L358-L360 PolarHBondContact O-N 2.57Å; L358-L360 VanDerWaalsContact O-N 3.08Å
359N90.9Very high91.2Very high132 Ų13229.7 Ų29.771%0.70618%0.176SC*.THydrogen-bonded Turntrans56.120.8-175.9-58.2-62.3000115G355 M356G355-N359 PolarHBondContact O-N 3.33Å; M356-N359 PolarHBondContact O-N 3.04Å
360L93.2Very high91.4Very high11 Ų1129.5 Ų29.56%0.05818%0.175CC..SBendtrans-88-25.4177.8-63.2-177.4000112.6T116 V119 L168 A172 M175 G355 L358T116-L360 WeakPolarHBondContact CA-O 3.35Å; T116-L360 VanDerWaalsContact CB-O 3.27Å; T116-L360 WeakPolarHBondContact CB-O 3.4Å; T116-L360 WeakPolarHBondContact CG2-O 3.49Å; T116-L360 PolarHBondContact OG1-O 3.21Å; V119-L360 HydrophobicContact CG2-CB 4.01Å; V119-L360 HydrophobicContact CG2-CD1 4.11Å; L168-L360 HydrophobicContact CD1-CD1 3.54Å; L168-L360 HydrophobicContact CD2-CD1 4.3Å; L168-L360 HydrophobicContact CG-CD1 3.79Å; A172-L360 HydrophobicContact CB-CD1 3.92Å; A172-L360 HydrophobicContact CB-CD2 4.43Å; A172-L360 HydrophobicContact CB-CG 4.25Å; M175-L360 HydrophobicContact CE-CD2 4.33Å; M175-L360 HydrophobicContact SD-CD2 3.73Å; G355-L360 WeakPolarHBondContact O-CA 3.46Å; G355-L360 PolarHBondContact O-N 3.44Å; L358-L360 HydrophobicContact CB-CD1 4.27Å; L358-L360 HydrophobicContact CB-CG 4.06Å; L358-L360 HydrophobicContact CD1-CD1 4.49Å; L358-L360 PolarHBondContact O-N 2.57Å; L358-L360 VanDerWaalsContact O-N 3.08Å
361L94.1Very high91.9Very high5 Ų527.9 Ų27.93%0.02617%0.167CC..SBendtrans-120131177.4-164.872.6000109.3T116 V119 F120 A352 G355 Q366T116-L361 HydrophobicContact CG2-CD1 4.12Å; V119-L361 HydrophobicContact CG1-CB 4.4Å; F120-L361 HydrophobicContact CB-CD1 3.8Å; F120-L361 HydrophobicContact CD2-CD1 4.19Å; F120-L361 HydrophobicContact CG-CD1 4.46Å; A352-L361 HydrophobicContact CB-CD2 3.79Å; G355-L361 PolarHBondContact O-N 2.84Å; L361-Q366 HydrophobicContact CD2-CB 4.35Å
362P93.3Very high92.1Very high45 Ų4527.8 Ų27.829%0.29217%0.166SC..  trans-78161.4173.531.4-34.5000111.1W112 T116 M356 A364 G365 Q366W112-P362 HydrophobicContact CD2-CG 4.02Å; W112-P362 HydrophobicContact CG-CG 4.44Å; W112-P362 HydrophobicContact CH2-CG 4.46Å; W112-P362 HydrophobicContact CZ2-CG 3.97Å; T116-P362 HydrophobicContact CG2-CG 4.19Å; M356-P362 VanDerWaalsContact SD-O 3.4Å; P362-A364 PolarHBondContact O-N 2.97Å; P362-A364 VanDerWaalsContact O-N 3.16Å; P362-G365 WeakPolarHBondContact O-CA 3.41Å; P362-G365 PolarHBondContact O-N 3.35Å; P362-Q366 PolarHBondContact O-N 3.38Å; P362-Q366 VanDerWaalsContact O-N 3.12Å
363Q91.2Very high92Very high100 Ų10027.8 Ų27.847%0.46717%0.166SC..Hα-helixtrans-56.1-36.8179.7-168176.127.200112.5M356 G365 Q366 N367M356-Q363 HydrophobicContact CE-CB 3.83Å; M356-Q363 HydrophobicContact CE-CG 4.23Å; M356-Q363 WeakPolarHBondContact SD-CA 3.3Å; M356-Q363 HydrophobicContact SD-CB 4.33Å; M356-Q363 PolarHBondContact SD-N 3.01Å; Q363-G365 VanDerWaalsContact C-N 3.31Å; Q363-G365 PolarHBondContact O-N 3.39Å; Q363-Q366 PolarHBondContact O-N 3.06Å; Q363-N367 WeakPolarHBondContact O-CB 3.34Å; Q363-N367 VanDerWaalsContact O-CG 3.3Å; Q363-N367 PolarHBondContact O-N 2.94Å; Q363-N367 PolarHBondContact O-ND2 3.42Å
364A92.3Very high92.1Very high27 Ų2727.3 Ų27.322%0.22316%0.158CC..Hα-helixtrans-58.9-41.1172.700000112.1W112 P362 N367 L368W112-A364 HydrophobicContact CZ2-CB 3.91Å; P362-A364 PolarHBondContact O-N 2.97Å; P362-A364 VanDerWaalsContact O-N 3.16Å; A364-N367 PolarHBondContact O-N 2.7Å; A364-L368 VanDerWaalsContact O-CG 3.31Å; A364-L368 WeakPolarHBondContact O-CG 3.25Å; A364-L368 PolarHBondContact O-N 2.99Å
365G93.8Very high92.4Very high0 Ų027.5 Ų27.50%016%0.159CC..Hα-helixtrans-63.5-45.5175.700000112.6P362 Q363 N367 L368 V369P362-G365 WeakPolarHBondContact O-CA 3.41Å; P362-G365 PolarHBondContact O-N 3.35Å; Q363-G365 VanDerWaalsContact C-N 3.31Å; Q363-G365 PolarHBondContact O-N 3.39Å; G365-N367 PolarHBondContact O-N 2.99Å; G365-L368 PolarHBondContact O-N 2.84Å; G365-V369 WeakPolarHBondContact O-CG2 3.28Å; G365-V369 PolarHBondContact O-N 3.06Å
366Q93.6Very high92.5Very high13 Ų1327.5 Ų27.56%0.06116%0.159CC..Hα-helixtrans-58.4-48.2173.7-179.9177.648.200111A352 M356 L361 P362 Q363 L368 V369 L370A352-Q366 HydrophobicContact CB-CG 4.36Å; M356-Q366 HydrophobicContact CG-CB 3.81Å; M356-Q366 HydrophobicContact CG-CG 4.27Å; M356-Q366 HydrophobicContact SD-CB 4.07Å; L361-Q366 HydrophobicContact CD2-CB 4.35Å; P362-Q366 PolarHBondContact O-N 3.38Å; P362-Q366 VanDerWaalsContact O-N 3.12Å; Q363-Q366 PolarHBondContact O-N 3.06Å; Q366-L368 VanDerWaalsContact C-N 3.32Å; Q366-L368 PolarHBondContact O-N 3.2Å; Q366-V369 PolarHBondContact O-N 2.87Å; Q366-L370 HydrophobicContact CG-CD1 3.78Å; Q366-L370 WeakPolarHBondContact O-CD1 3.39Å; Q366-L370 PolarHBondContact O-N 3.26Å
367N93.4Very high92.4Very high7 Ų725.2 Ų25.24%0.03715%0.148CC..Hα-helixtrans-61-37.9178.5-73.2-22.7000112.8L292 D294 I297 Q363 A364 G365 A371L292-N367 PolarHBondContact O-OD1 3.48Å; D294-N367 PolarHBondContact N-OD1 3.41Å; I297-N367 HydrophobicContact CB-CB 4.09Å; I297-N367 HydrophobicContact CG1-CB 4.05Å; I297-N367 HydrophobicContact CG2-CB 4.13Å; Q363-N367 WeakPolarHBondContact O-CB 3.34Å; Q363-N367 VanDerWaalsContact O-CG 3.3Å; Q363-N367 PolarHBondContact O-N 2.94Å; Q363-N367 PolarHBondContact O-ND2 3.42Å; A364-N367 PolarHBondContact O-N 2.7Å; G365-N367 PolarHBondContact O-N 2.99Å; N367-A371 VanDerWaalsContact O-CB 3.31Å; N367-A371 WeakPolarHBondContact O-CB 3.44Å; N367-A371 PolarHBondContact O-N 3.06Å
368L95.1Very high92.4Very high0 Ų024.8 Ų24.80%013%0.133CC..Hα-helixtrans-66-42.5174.3-71.3-174.8000112.2L110 W112 F120 I297 A304 V305 T308 A364 G365 Q366 G372L110-L368 HydrophobicContact CD1-CD1 3.81Å; W112-L368 HydrophobicContact CH2-CD1 3.79Å; F120-L368 HydrophobicContact CE2-CB 3.88Å; F120-L368 HydrophobicContact CE2-CD1 4.43Å; F120-L368 HydrophobicContact CZ-CB 4.14Å; F120-L368 HydrophobicContact CZ-CD1 4.18Å; I297-L368 HydrophobicContact CG1-CD2 4.03Å; A304-L368 HydrophobicContact CB-CD1 3.92Å; A304-L368 HydrophobicContact CB-CD2 3.83Å; V305-L368 HydrophobicContact CB-CD2 4.38Å; V305-L368 HydrophobicContact CG2-CD2 3.6Å; T308-L368 HydrophobicContact CG2-CB 4.44Å; A364-L368 VanDerWaalsContact O-CG 3.31Å; A364-L368 WeakPolarHBondContact O-CG 3.25Å; A364-L368 PolarHBondContact O-N 2.99Å; G365-L368 PolarHBondContact O-N 2.84Å; Q366-L368 VanDerWaalsContact C-N 3.32Å; Q366-L368 PolarHBondContact O-N 3.2Å; L368-G372 PolarHBondContact O-N 2.6Å
369V94.9Very high92.5Very high0 Ų026.2 Ų26.20%014%0.141CC..Hα-helixtrans-60.9-47.9175.2173.70000110.2F120 C123 L124 I344 A348 A352 G365 Q366 G372 A373F120-V369 HydrophobicContact CD2-CG2 3.75Å; F120-V369 HydrophobicContact CE2-CG2 3.72Å; C123-V369 HydrophobicContact CB-CG1 4.03Å; C123-V369 HydrophobicContact CB-CG2 3.7Å; L124-V369 HydrophobicContact CD2-CG2 4.33Å; I344-V369 HydrophobicContact CD1-CG1 4.06Å; A348-V369 HydrophobicContact CB-CG1 3.91Å; A352-V369 HydrophobicContact CB-CB 4.31Å; A352-V369 HydrophobicContact CB-CG1 4.19Å; A352-V369 HydrophobicContact CB-CG2 4.45Å; G365-V369 WeakPolarHBondContact O-CG2 3.28Å; G365-V369 PolarHBondContact O-N 3.06Å; Q366-V369 PolarHBondContact O-N 2.87Å; V369-G372 PolarHBondContact O-N 3.09Å; V369-A373 WeakPolarHBondContact O-CB 3.33Å; V369-A373 PolarHBondContact O-N 2.99Å
370L92.4Very high92.3Very high3 Ų320 Ų202%0.01611%0.108CC..Hα-helixtrans-65-43.9-179.5-86.670.3000112V289 L292 F293 F349 Q366 A373 I374V289-L370 HydrophobicContact CG1-CD2 3.96Å; V289-L370 HydrophobicContact CG1-CG 4.16Å; V289-L370 VanDerWaalsContact O-CD2 3.25Å; V289-L370 WeakPolarHBondContact O-CD2 3.42Å; L292-L370 HydrophobicContact CB-CD2 4.19Å; F293-L370 HydrophobicContact CB-CB 4.37Å; F293-L370 HydrophobicContact CB-CD2 3.79Å; F293-L370 HydrophobicContact CD2-CB 3.65Å; F293-L370 HydrophobicContact CE2-CB 4.37Å; F293-L370 HydrophobicContact CG-CB 4.32Å; F349-L370 HydrophobicContact CD1-CD1 3.9Å; F349-L370 HydrophobicContact CD1-CG 3.92Å; F349-L370 HydrophobicContact CE1-CD1 4.49Å; F349-L370 HydrophobicContact CE1-CG 4.11Å; Q366-L370 HydrophobicContact CG-CD1 3.78Å; Q366-L370 WeakPolarHBondContact O-CD1 3.39Å; Q366-L370 PolarHBondContact O-N 3.26Å; L370-A373 PolarHBondContact O-N 3.2Å; L370-I374 WeakPolarHBondContact O-CG1 3.5Å; L370-I374 PolarHBondContact O-N 3.4Å
371A93.7Very high91.9Very high1 Ų122 Ų221%0.00812%0.121CC..Hα-helixtrans-60.1-47.5173.900000111.7F293 I297 L298 V305 N367 A373 I374 L375F293-A371 HydrophobicContact CE2-CB 3.7Å; F293-A371 HydrophobicContact CZ-CB 3.97Å; I297-A371 HydrophobicContact CG2-CB 4.45Å; L298-A371 HydrophobicContact CD2-CB 4.02Å; V305-A371 HydrophobicContact CG1-CB 4.03Å; V305-A371 HydrophobicContact CG2-CB 4.33Å; N367-A371 VanDerWaalsContact O-CB 3.31Å; N367-A371 WeakPolarHBondContact O-CB 3.44Å; N367-A371 PolarHBondContact O-N 3.06Å; A371-A373 VanDerWaalsContact C-N 3.33Å; A371-A373 PolarHBondContact O-N 2.86Å; A371-I374 PolarHBondContact O-N 3.17Å; A371-L375 WeakPolarHBondContact O-CB 3.31Å; A371-L375 VanDerWaalsContact O-CG 3.26Å; A371-L375 WeakPolarHBondContact O-CG 2.82Å; A371-L375 PolarHBondContact O-N 3.43Å
372G94.1Very high91.5Very high0 Ų025.5 Ų25.50%014%0.142CC..Hα-helixtrans-60.5-41.5178.900000112.3L368 V369 S376L368-G372 PolarHBondContact O-N 2.6Å; V369-G372 PolarHBondContact O-N 3.09Å; G372-S376 WeakPolarHBondContact O-CB 3.42Å; G372-S376 PolarHBondContact O-N 3.32Å; G372-S376 PolarHBondContact O-OG 3.33Å
373A91.4Very high91.3Very high0 Ų025.9 Ų25.90%014%0.142CC..Hα-helixtrans-64.5-52.6175.900000112.2I344 F349 V369 L370 A371 L375 S376 I377I344-A373 HydrophobicContact CD1-CB 3.8Å; I344-A373 VanDerWaalsContact CG1-CA 3.48Å; I344-A373 HydrophobicContact CG1-CB 3.51Å; F349-A373 HydrophobicContact CD1-CB 4.46Å; F349-A373 HydrophobicContact CE1-CB 3.29Å; F349-A373 HydrophobicContact CZ-CB 3.37Å; V369-A373 WeakPolarHBondContact O-CB 3.33Å; V369-A373 PolarHBondContact O-N 2.99Å; L370-A373 PolarHBondContact O-N 3.2Å; A371-A373 VanDerWaalsContact C-N 3.33Å; A371-A373 PolarHBondContact O-N 2.86Å; A373-L375 VanDerWaalsContact C-N 3.34Å; A373-L375 PolarHBondContact O-N 3.02Å; A373-S376 PolarHBondContact O-N 3.13Å; A373-S376 PolarHBondContact O-OG 3.44Å; A373-S376 VanDerWaalsContact O-OG 3.07Å; A373-I377 WeakPolarHBondContact O-CB 3.32Å; A373-I377 WeakPolarHBondContact O-CG1 3.36Å; A373-I377 PolarHBondContact O-N 3.43Å
374I90.2Very high90.9Very high14 Ų1421.3 Ų21.37%0.07212%0.12CC..Hα-helixtrans-57-50.2179.7-68.5165.4000110.1L37 F293 L370 A371 M378L37-I374 HydrophobicContact CB-CD1 4.39Å; L37-I374 HydrophobicContact CB-CG1 4.22Å; L37-I374 HydrophobicContact CD1-CG1 3.77Å; L37-I374 HydrophobicContact CG-CG1 4.48Å; F293-I374 HydrophobicContact CD1-CD1 4.2Å; F293-I374 HydrophobicContact CE1-CD1 4.38Å; F293-I374 HydrophobicContact CG-CD1 4.41Å; L370-I374 WeakPolarHBondContact O-CG1 3.5Å; L370-I374 PolarHBondContact O-N 3.4Å; A371-I374 PolarHBondContact O-N 3.17Å; I374-M378 HydrophobicContact CG2-SD 3.97Å; I374-M378 WeakPolarHBondContact O-CB 3.43Å; I374-M378 WeakPolarHBondContact O-CG 3.41Å; I374-M378 PolarHBondContact O-N 3.5Å
375L92.6Very high90.6Very high51 Ų5122.5 Ų22.527%0.26713%0.13SC..Hα-helixtrans-67.2-40-177.9-67.9173.7000112.3L298 V305 L309 A371 A373 M378 L379L298-L375 HydrophobicContact CD2-CD1 4.43Å; V305-L375 HydrophobicContact CG1-CD1 3.78Å; L309-L375 HydrophobicContact CD1-CB 3.76Å; L309-L375 HydrophobicContact CD2-CB 4.03Å; L309-L375 HydrophobicContact CD2-CD1 4.17Å; L309-L375 HydrophobicContact CG-CB 4.49Å; A371-L375 WeakPolarHBondContact O-CB 3.31Å; A371-L375 VanDerWaalsContact O-CG 3.26Å; A371-L375 WeakPolarHBondContact O-CG 2.82Å; A371-L375 PolarHBondContact O-N 3.43Å; A373-L375 VanDerWaalsContact C-N 3.34Å; A373-L375 PolarHBondContact O-N 3.02Å; L375-M378 PolarHBondContact O-N 3.46Å; L375-L379 WeakPolarHBondContact O-CB 3.44Å; L375-L379 VanDerWaalsContact O-CG 3.25Å; L375-L379 WeakPolarHBondContact O-CG 3.41Å; L375-L379 PolarHBondContact O-N 3Å
376S93.3Very high90.3Very high0 Ų027.5 Ų27.50%016%0.156CC..Hα-helixtrans-68.6-41.8178.161.70000112.5I344 G372 A373 M378 L379 N380I344-S376 PolarHBondContact N-OG 2.92Å; G372-S376 WeakPolarHBondContact O-CB 3.42Å; G372-S376 PolarHBondContact O-N 3.32Å; G372-S376 PolarHBondContact O-OG 3.33Å; A373-S376 PolarHBondContact O-N 3.13Å; A373-S376 PolarHBondContact O-OG 3.44Å; A373-S376 VanDerWaalsContact O-OG 3.07Å; S376-M378 VanDerWaalsContact C-N 3.33Å; S376-M378 PolarHBondContact O-N 3.26Å; S376-L379 PolarHBondContact O-N 3.31Å; S376-N380 WeakPolarHBondContact O-CB 3.24Å; S376-N380 PolarHBondContact O-N 3.3Å
377I89.1Confident90Very high2 Ų227.6 Ų27.61%0.0116%0.157CC..Hα-helixtrans-62-41173.7-64.8168.5000110.7V34 V131 Q343 A373 P381V34-I377 HydrophobicContact CG2-CB 4.29Å; V34-I377 HydrophobicContact CG2-CG2 3.66Å; V131-I377 HydrophobicContact CG2-CG1 4.33Å; V131-I377 HydrophobicContact CG2-CG2 4.1Å; Q343-I377 HydrophobicContact CB-CG1 4.36Å; A373-I377 WeakPolarHBondContact O-CB 3.32Å; A373-I377 WeakPolarHBondContact O-CG1 3.36Å; A373-I377 PolarHBondContact O-N 3.43Å; I377-P381 WeakPolarHBondContact O-CD 3.32Å
378M89.1Confident89.4Confident67 Ų6731.6 Ų31.633%0.3318%0.175SC..Hα-helixtrans-63.4-38.8175.9-77-179.872.900113I30 V34 I374 L375 S376I30-M378 HydrophobicContact CD1-CE 4.43Å; I30-M378 HydrophobicContact CG2-CG 4.23Å; V34-M378 HydrophobicContact CB-CG 4.19Å; V34-M378 HydrophobicContact CG1-CG 3.51Å; V34-M378 HydrophobicContact CG1-SD 3.76Å; V34-M378 HydrophobicContact CG2-CG 3.59Å; I374-M378 HydrophobicContact CG2-SD 3.97Å; I374-M378 WeakPolarHBondContact O-CB 3.43Å; I374-M378 WeakPolarHBondContact O-CG 3.41Å; I374-M378 PolarHBondContact O-N 3.5Å; L375-M378 PolarHBondContact O-N 3.46Å; S376-M378 VanDerWaalsContact C-N 3.33Å; S376-M378 PolarHBondContact O-N 3.26Å
379L90.4Very high88.9Confident72 Ų7239.2 Ų39.238%0.37721%0.209SC..Hα-helixtrans-84.2-18-177.5-70.3170.9000113.4L309 L313 L375 S376 V382 L383L309-L379 HydrophobicContact CD1-CD1 4.46Å; L309-L379 HydrophobicContact CD2-CD1 4.01Å; L313-L379 HydrophobicContact CD1-CD1 3.78Å; L375-L379 WeakPolarHBondContact O-CB 3.44Å; L375-L379 VanDerWaalsContact O-CG 3.25Å; L375-L379 WeakPolarHBondContact O-CG 3.41Å; L375-L379 PolarHBondContact O-N 3Å; S376-L379 PolarHBondContact O-N 3.31Å; L379-V382 WeakPolarHBondContact O-CB 3.26Å; L379-V382 PolarHBondContact O-N 2.98Å; L379-V382 VanDerWaalsContact O-N 3.07Å; L379-L383 PolarHBondContact O-N 3.41Å
380N88.1Confident88.6Confident3 Ų344.9 Ų44.92%0.01623%0.231CC..Hα-helixtrans-57.2-46.4-175.6-171.453.1000114.1V131 A339 Q343 S376 V382 L383 F384V131-N380 WeakPolarHBondContact CG1-ND2 3.18Å; A339-N380 PolarHBondContact O-OD1 2.98Å; A339-N380 VanDerWaalsContact O-OD1 3.13Å; Q343-N380 HydrophobicContact CB-CB 4.42Å; Q343-N380 HydrophobicContact CG-CB 4.42Å; S376-N380 WeakPolarHBondContact O-CB 3.24Å; S376-N380 PolarHBondContact O-N 3.3Å; N380-V382 PolarHBondContact O-N 2.94Å; N380-L383 WeakPolarHBondContact O-CB 3.4Å; N380-L383 PolarHBondContact O-N 2.88Å; N380-L383 VanDerWaalsContact O-N 3.13Å; N380-F384 PolarHBondContact O-N 3.11Å
381P82.8Confident88.1Confident52 Ų5245.3 Ų45.334%0.33823%0.233SC..Hα-helixtrans-59.6-35.3175.6-23.734.6000113I377 F384 A385I377-P381 WeakPolarHBondContact O-CD 3.32Å; P381-F384 PolarHBondContact O-N 3.44Å; P381-A385 WeakPolarHBondContact O-CB 3.47Å; P381-A385 PolarHBondContact O-N 3.5Å
382V87.2Confident87.3Confident78 Ų7848.7 Ų48.747%0.47326%0.261SS..Hα-helixtrans-68.5-42.1177-177.40000110.4L379 N380 F384 A385 L386L379-V382 WeakPolarHBondContact O-CB 3.26Å; L379-V382 PolarHBondContact O-N 2.98Å; L379-V382 VanDerWaalsContact O-N 3.07Å; N380-V382 PolarHBondContact O-N 2.94Å; V382-F384 VanDerWaalsContact C-N 3.32Å; V382-F384 PolarHBondContact O-N 3Å; V382-A385 PolarHBondContact O-N 3.36Å; V382-L386 HydrophobicContact CG1-CD1 4.04Å; V382-L386 HydrophobicContact CG1-CG 4.33Å; V382-L386 WeakPolarHBondContact O-CB 3.36Å; V382-L386 VanDerWaalsContact O-CG 3.26Å; V382-L386 WeakPolarHBondContact O-CG 3.37Å; V382-L386 PolarHBondContact O-N 3.32Å
383L88Confident86.5Confident53 Ų5357.3 Ų57.328%0.27730%0.299SS..Hα-helixtrans-60.2-43.8176.9-175.464.6000111.5A339 A342 L379 N380 L386 L387A339-L383 HydrophobicContact CB-CD2 4.15Å; A339-L383 HydrophobicContact CB-CG 4.23Å; A342-L383 HydrophobicContact CB-CD2 3.27Å; L379-L383 PolarHBondContact O-N 3.41Å; N380-L383 WeakPolarHBondContact O-CB 3.4Å; N380-L383 PolarHBondContact O-N 2.88Å; N380-L383 VanDerWaalsContact O-N 3.13Å; L383-L386 PolarHBondContact O-N 3.06Å; L383-L387 WeakPolarHBondContact O-CB 3.38Å; L383-L387 PolarHBondContact O-N 3.22Å
384F83.9Confident85.6Confident5 Ų560.3 Ų60.32%0.02232%0.317CS..Hα-helixtrans-63.7-43.4175.5-94.7-69.3000113.2A135 R139 A339 S340 N380 P381 V382 L386 L387 E388A135-F384 HydrophobicContact CB-CD2 4.47Å; A135-F384 HydrophobicContact CB-CE2 3.93Å; A135-F384 HydrophobicContact CB-CZ 4.17Å; R139-F384 VanDerWaalsContact CZ-CD1 3.47Å; A339-F384 HydrophobicContact CB-CD1 4.32Å; A339-F384 HydrophobicContact CB-CE1 4.2Å; A339-F384 HydrophobicContact CB-CZ 4.34Å; S340-F384 VanDerWaalsContact CA-CZ 3.46Å; N380-F384 PolarHBondContact O-N 3.11Å; P381-F384 PolarHBondContact O-N 3.44Å; V382-F384 VanDerWaalsContact C-N 3.32Å; V382-F384 PolarHBondContact O-N 3Å; F384-L386 VanDerWaalsContact C-N 3.35Å; F384-L386 PolarHBondContact O-N 3.11Å; F384-L387 WeakPolarHBondContact O-CB 3.42Å; F384-L387 PolarHBondContact O-N 2.75Å; F384-E388 PolarHBondContact O-N 3.2Å
385A85Confident84.3Confident52 Ų5260.6 Ų60.643%0.4332%0.318SS..Hα-helixtrans-65.3-37.8176.100000112.5P381 V382 K389P381-A385 WeakPolarHBondContact O-CB 3.47Å; P381-A385 PolarHBondContact O-N 3.5Å; V382-A385 PolarHBondContact O-N 3.36Å; A385-K389 WeakPolarHBondContact O-CB 3.27Å; A385-K389 PolarHBondContact O-N 3.29Å; A385-K389 VanDerWaalsContact O-N 3.12Å
386L88.2Confident82.7Confident104 Ų10461.5 Ų61.555%0.54533%0.325SS..Hα-helixtrans-66.5-40173.8-72.9173.3000111.5V382 L383 F384 K389 Y390V382-L386 HydrophobicContact CG1-CD1 4.04Å; V382-L386 HydrophobicContact CG1-CG 4.33Å; V382-L386 WeakPolarHBondContact O-CB 3.36Å; V382-L386 VanDerWaalsContact O-CG 3.26Å; V382-L386 WeakPolarHBondContact O-CG 3.37Å; V382-L386 PolarHBondContact O-N 3.32Å; L383-L386 PolarHBondContact O-N 3.06Å; F384-L386 VanDerWaalsContact C-N 3.35Å; F384-L386 PolarHBondContact O-N 3.11Å; L386-K389 PolarHBondContact O-N 2.84Å; L386-Y390 WeakPolarHBondContact O-CB 3.12Å; L386-Y390 PolarHBondContact O-N 2.86Å
387L86.2Confident80.9Confident16 Ų1667.9 Ų67.98%0.08436%0.359CS..Hα-helixtrans-60.3-50.7175.417360.4000111.1L335 A339 L383 F384 K389 Y390 L391L335-L387 HydrophobicContact CB-CD1 3.46Å; L335-L387 VanDerWaalsContact CB-CD1 3.46Å; L335-L387 HydrophobicContact CB-CD2 4.24Å; L335-L387 HydrophobicContact CB-CG 4.5Å; L335-L387 HydrophobicContact CD1-CD1 3.87Å; L335-L387 HydrophobicContact CD2-CD1 4.47Å; L335-L387 HydrophobicContact CG-CD1 4.13Å; L335-L387 WeakPolarHBondContact O-CD2 3.28Å; A339-L387 HydrophobicContact CB-CD2 3.74Å; L383-L387 WeakPolarHBondContact O-CB 3.38Å; L383-L387 PolarHBondContact O-N 3.22Å; F384-L387 WeakPolarHBondContact O-CB 3.42Å; F384-L387 PolarHBondContact O-N 2.75Å; L387-K389 VanDerWaalsContact C-N 3.3Å; L387-K389 PolarHBondContact O-N 3.39Å; L387-Y390 WeakPolarHBondContact O-CB 3.31Å; L387-Y390 PolarHBondContact O-N 3.42Å; L387-Y390 VanDerWaalsContact O-N 3.08Å; L387-L391 HydrophobicContact CD1-CD1 3.71Å; L387-L391 HydrophobicContact CD1-CD2 4.15Å; L387-L391 HydrophobicContact CD1-CG 3.7Å; L387-L391 HydrophobicContact CD2-CD1 4.35Å; L387-L391 HydrophobicContact CG-CD1 3.74Å; L387-L391 HydrophobicContact CG-CG 4.19Å; L387-L391 VanDerWaalsContact O-CG 3.31Å; L387-L391 WeakPolarHBondContact O-CG 2.97Å; L387-L391 PolarHBondContact O-N 2.65Å
388E81.9Confident79.1Confident90 Ų9075.2 Ų75.242%0.42139%0.393SS..Hα-helixtrans-58-44.1177.7-76.9175.9155.700112.3R139 F384 Y390 L391 A392R139-E388 VanDerWaalsContact CZ-CD 3.43Å; R139-E388 IonicContact CZ-OE1 3.49Å; R139-E388 IonicContact CZ-OE2 3.81Å; R139-E388 IonicContact NE-OE1 2.7Å; R139-E388 VanDerWaalsContact NH1-CG 3.3Å; R139-E388 IonicContact NH1-OE1 3.26Å; R139-E388 PolarHBondContact NH1-OE1 2.85Å; R139-E388 IonicContact NH1-OE2 3.01Å; R139-E388 IonicContact NH2-OE1 2.88Å; R139-E388 PolarHBondContact NH2-OE1 3.5Å; R139-E388 IonicContact NH2-OE2 3.92Å; R139-E388 PolarHBondContact NH2-OE2 2.91Å; F384-E388 PolarHBondContact O-N 3.2Å; E388-Y390 VanDerWaalsContact C-N 3.26Å; E388-Y390 PolarHBondContact O-N 2.89Å; E388-L391 PolarHBondContact O-N 3.36Å; E388-A392 VanDerWaalsContact O-CB 3.23Å; E388-A392 WeakPolarHBondContact O-CB 3.42Å; E388-A392 PolarHBondContact O-N 2.8Å
389K85.2Confident77.4Confident161 Ų16176.8 Ų76.870%0.740%0.4SS*.Hα-helixtrans-63.8-34.6177.2-173177.1-178.5178.90112.2A385 L386 L387 K393A385-K389 WeakPolarHBondContact O-CB 3.27Å; A385-K389 PolarHBondContact O-N 3.29Å; A385-K389 VanDerWaalsContact O-N 3.12Å; L386-K389 PolarHBondContact O-N 2.84Å; L387-K389 VanDerWaalsContact C-N 3.3Å; L387-K389 PolarHBondContact O-N 3.39Å; K389-K393 WeakPolarHBondContact O-CB 3.44Å
390Y86.7Confident75.4Confident118 Ų11875.3 Ų75.346%0.46339%0.391SS..Hα-helixtrans-69.8-53.6175.8178.6-97.3000110.7L335 L386 L387 E388 A392 K393 T394L335-Y390 HydrophobicContact CD1-CD1 4.22Å; L335-Y390 HydrophobicContact CD1-CE1 4.08Å; L386-Y390 WeakPolarHBondContact O-CB 3.12Å; L386-Y390 PolarHBondContact O-N 2.86Å; L387-Y390 WeakPolarHBondContact O-CB 3.31Å; L387-Y390 PolarHBondContact O-N 3.42Å; L387-Y390 VanDerWaalsContact O-N 3.08Å; E388-Y390 VanDerWaalsContact C-N 3.26Å; E388-Y390 PolarHBondContact O-N 2.89Å; Y390-A392 VanDerWaalsContact C-N 3.33Å; Y390-A392 PolarHBondContact O-N 2.92Å; Y390-K393 WeakPolarHBondContact O-CA 3.41Å; Y390-K393 WeakPolarHBondContact O-CB 3.09Å; Y390-K393 PolarHBondContact O-N 3.3Å; Y390-T394 HydrophobicContact CD2-CG2 4.3Å; Y390-T394 HydrophobicContact CE1-CG2 4.28Å; Y390-T394 WeakPolarHBondContact CE1-OG1 3.18Å; Y390-T394 HydrophobicContact CE2-CG2 3.76Å; Y390-T394 PolarHBondContact O-N 3.26Å; Y390-T394 PolarHBondContact O-OG1 2.83Å
391L81.8Confident73.3Confident12 Ų1278.9 Ų78.96%0.06341%0.413CS..Hα-helixtrans-56.5-45.4179.1-65.8171.3000111.8R332 L335 L387 E388 K393 T394 E395R332-L391 HydrophobicContact CB-CD2 4.43Å; R332-L391 HydrophobicContact CG-CD1 3.8Å; R332-L391 HydrophobicContact CG-CD2 4.08Å; L335-L391 HydrophobicContact CD1-CD2 3.75Å; L387-L391 HydrophobicContact CD1-CD1 3.71Å; L387-L391 HydrophobicContact CD1-CD2 4.15Å; L387-L391 HydrophobicContact CD1-CG 3.7Å; L387-L391 HydrophobicContact CD2-CD1 4.35Å; L387-L391 HydrophobicContact CG-CD1 3.74Å; L387-L391 HydrophobicContact CG-CG 4.19Å; L387-L391 VanDerWaalsContact O-CG 3.31Å; L387-L391 WeakPolarHBondContact O-CG 2.97Å; L387-L391 PolarHBondContact O-N 2.65Å; E388-L391 PolarHBondContact O-N 3.36Å; L391-K393 PolarHBondContact O-N 2.66Å; L391-K393 VanDerWaalsContact O-N 3.09Å; L391-T394 PolarHBondContact O-N 2.83Å; L391-E395 HydrophobicContact CD2-CG 4.41Å; L391-E395 WeakPolarHBondContact CD2-OE1 3.46Å; L391-E395 WeakPolarHBondContact O-CB 3.31Å; L391-E395 WeakPolarHBondContact O-CG 3.23Å; L391-E395 PolarHBondContact O-N 3.42Å
392A77.8Confident71.5Confident72 Ų7281.5 Ų81.560%0.59542%0.423SS*.Hα-helixtrans-61.8-19.3176.500000114.1E388 Y390E388-A392 VanDerWaalsContact O-CB 3.23Å; E388-A392 WeakPolarHBondContact O-CB 3.42Å; E388-A392 PolarHBondContact O-N 2.8Å; Y390-A392 VanDerWaalsContact C-N 3.33Å; Y390-A392 PolarHBondContact O-N 2.92Å
393K78.1Confident69.5Low182 Ų18279 Ų7979%0.79141%0.407SS*.Hα-helixtrans-99.4-34.5179.9-172.4177.9179.1-173.70112.9K389 Y390 L391K389-K393 WeakPolarHBondContact O-CB 3.44Å; Y390-K393 WeakPolarHBondContact O-CA 3.41Å; Y390-K393 WeakPolarHBondContact O-CB 3.09Å; Y390-K393 PolarHBondContact O-N 3.3Å; L391-K393 PolarHBondContact O-N 2.66Å; L391-K393 VanDerWaalsContact O-N 3.09Å
394T71.2Confident67.5Low62 Ų6280.2 Ų80.238%0.3841%0.411SS..Hα-helixtrans-98.3-27.8-173.841.90000114.3Y390 L391 T396Y390-T394 HydrophobicContact CD2-CG2 4.3Å; Y390-T394 HydrophobicContact CE1-CG2 4.28Å; Y390-T394 WeakPolarHBondContact CE1-OG1 3.18Å; Y390-T394 HydrophobicContact CE2-CG2 3.76Å; Y390-T394 PolarHBondContact O-N 3.26Å; Y390-T394 PolarHBondContact O-OG1 2.83Å; L391-T394 PolarHBondContact O-N 2.83Å; T394-T396 PolarHBondContact O-N 3.36Å
395E63.1Low65.3Low21 Ų2181.2 Ų81.210%0.09842%0.42CS..SBendtrans-72.4121.9176.5-64.9-176.5161.700108.7R332 L391 Q400R332-E395 VanDerWaalsContact CB-OE1 3.23Å; R332-E395 WeakPolarHBondContact CB-OE1 3.43Å; R332-E395 WeakPolarHBondContact CD-OE1 3.48Å; R332-E395 WeakPolarHBondContact CD-OE2 3.35Å; R332-E395 VanDerWaalsContact CG-OE1 3.31Å; R332-E395 WeakPolarHBondContact CG-OE1 3.42Å; R332-E395 IonicContact CZ-OE2 2.97Å; R332-E395 IonicContact NE-OE2 3.5Å; R332-E395 IonicContact NH1-OE2 3.86Å; R332-E395 PolarHBondContact NH1-OE2 2.93Å; L391-E395 HydrophobicContact CD2-CG 4.41Å; L391-E395 WeakPolarHBondContact CD2-OE1 3.46Å; L391-E395 WeakPolarHBondContact O-CB 3.31Å; L391-E395 WeakPolarHBondContact O-CG 3.23Å; L391-E395 PolarHBondContact O-N 3.42Å; E395-Q400 HydrophobicContact CB-CG 3.46Å; E395-Q400 VanDerWaalsContact CB-CG 3.46Å; E395-Q400 HydrophobicContact CG-CG 4.48Å
396T58.6Low63.4Low69 Ų6983.9 Ų83.942%0.42343%0.426SS..  trans-62.1147.6168.555.30000108.7T394 E398 E399 Q400T394-T396 PolarHBondContact O-N 3.36Å; T396-E398 PolarHBondContact O-N 3.39Å; T396-E399 PolarHBondContact N-OE2 3.17Å; T396-E399 PolarHBondContact O-N 3.16Å; T396-E399 WeakPolarHBondContact OG1-CB 3.45Å; T396-E399 VanDerWaalsContact OG1-CG 3.27Å; T396-E399 WeakPolarHBondContact OG1-CG 3.48Å; T396-E399 PolarHBondContact OG1-N 3.3Å; T396-E399 PolarHBondContact OG1-OE2 3.08Å; T396-Q400 PolarHBondContact O-N 2.94Å
397L57.2Low61.4Low135 Ų13581 Ų8171%0.70741%0.41SS*.Hα-helixtrans-51.6-30.5173.1-77160.4000111.3T401L397-T401 VanDerWaalsContact O-CB 3.24Å; L397-T401 WeakPolarHBondContact O-CB 3.45Å; L397-T401 WeakPolarHBondContact O-CG2 3.24Å; L397-T401 PolarHBondContact O-N 3.31Å; L397-T401 PolarHBondContact O-OG1 3.33Å
398E50.8Low59.4Low156 Ų15685 Ų8573%0.72943%0.428SS*.Hα-helixtrans-68.6-39.5173.2-71.7-176.716300113.5T396 T401 L402T396-E398 PolarHBondContact O-N 3.39Å; E398-T401 VanDerWaalsContact CA-OG1 3.3Å; E398-T401 WeakPolarHBondContact CA-OG1 3.31Å; E398-T401 PolarHBondContact O-OG1 2.91Å; E398-L402 WeakPolarHBondContact O-CA 3.49Å; E398-L402 WeakPolarHBondContact O-CB 3.44Å; E398-L402 PolarHBondContact O-N 3.36Å
399E52.4Low57.8Low100 Ų10085.4 Ų85.447%0.46743%0.43SS..Hα-helixtrans-73.3-37174.7-74.9165148.800112.3T396 L402 E403T396-E399 PolarHBondContact N-OE2 3.17Å; T396-E399 PolarHBondContact O-N 3.16Å; T396-E399 WeakPolarHBondContact OG1-CB 3.45Å; T396-E399 VanDerWaalsContact OG1-CG 3.27Å; T396-E399 WeakPolarHBondContact OG1-CG 3.48Å; T396-E399 PolarHBondContact OG1-N 3.3Å; T396-E399 PolarHBondContact OG1-OE2 3.08Å; E399-L402 PolarHBondContact O-N 2.99Å; E399-E403 WeakPolarHBondContact O-CB 3.35Å; E399-E403 PolarHBondContact O-N 3.11Å
400Q50.1Low56Low41 Ų4186 Ų8619%0.19243%0.432CS..Hα-helixtrans-60-52.2171.1-66.9-174-34.700109.7E395 T396 L402 E403 E404E395-Q400 HydrophobicContact CB-CG 3.46Å; E395-Q400 VanDerWaalsContact CB-CG 3.46Å; E395-Q400 HydrophobicContact CG-CG 4.48Å; T396-Q400 PolarHBondContact O-N 2.94Å; Q400-L402 VanDerWaalsContact C-N 3.33Å; Q400-L402 PolarHBondContact O-N 2.89Å; Q400-E403 PolarHBondContact O-N 3.23Å; Q400-E404 WeakPolarHBondContact O-CB 3.43Å; Q400-E404 WeakPolarHBondContact O-CG 3.35Å; Q400-E404 PolarHBondContact O-N 2.89Å
401T43.3Very low55Low77 Ų7781.5 Ų81.547%0.47242%0.415SS..Hα-helixtrans-70.1-24.5179.254.30000113.6L397 E398 A405L397-T401 VanDerWaalsContact O-CB 3.24Å; L397-T401 WeakPolarHBondContact O-CB 3.45Å; L397-T401 WeakPolarHBondContact O-CG2 3.24Å; L397-T401 PolarHBondContact O-N 3.31Å; L397-T401 PolarHBondContact O-OG1 3.33Å; E398-T401 VanDerWaalsContact CA-OG1 3.3Å; E398-T401 WeakPolarHBondContact CA-OG1 3.31Å; E398-T401 PolarHBondContact O-OG1 2.91Å; T401-A405 WeakPolarHBondContact O-CA 3.29Å; T401-A405 WeakPolarHBondContact O-CB 3.44Å; T401-A405 PolarHBondContact O-N 3.12Å
402L44.3Very low54Low107 Ų10788 Ų8856%0.5645%0.449SS*.Hα-helixtrans-81.2-40.7176.7-172.472000111.5E398 E399 Q400 A405 I406E398-L402 WeakPolarHBondContact O-CA 3.49Å; E398-L402 WeakPolarHBondContact O-CB 3.44Å; E398-L402 PolarHBondContact O-N 3.36Å; E399-L402 PolarHBondContact O-N 2.99Å; Q400-L402 VanDerWaalsContact C-N 3.33Å; Q400-L402 PolarHBondContact O-N 2.89Å; L402-A405 CarbonylContact O-C 3.38Å; L402-A405 PolarHBondContact O-N 3.06Å; L402-I406 HydrophobicContact CD1-CD1 4.37Å; L402-I406 HydrophobicContact CD2-CD1 4.48Å; L402-I406 HydrophobicContact CG-CD1 3.91Å; L402-I406 VanDerWaalsContact O-CB 3.31Å; L402-I406 WeakPolarHBondContact O-CB 3.21Å; L402-I406 WeakPolarHBondContact O-CD1 3.36Å; L402-I406 WeakPolarHBondContact O-CG1 3.48Å; L402-I406 PolarHBondContact O-N 3.49Å
403E46.2Very low53.9Low26 Ų2687.6 Ų87.612%0.12144%0.44CS..Hα-helixtrans-69.3-41.8171.5-79-174.3178.900111.5R146 S330 R332 E399 Q400 A405 I406 E407R146-E403 IonicContact CZ-OE2 2.98Å; R146-E403 IonicContact NH2-OE2 2.98Å; R146-E403 PolarHBondContact NH2-OE2 3.42Å; S330-E403 WeakPolarHBondContact CB-OE1 3.14Å; S330-E403 PolarHBondContact OG-OE1 3.47Å; R332-E403 WeakPolarHBondContact CB-OE1 3.49Å; R332-E403 WeakPolarHBondContact CB-OE2 3.37Å; R332-E403 WeakPolarHBondContact CD-OE2 3.5Å; E399-E403 WeakPolarHBondContact O-CB 3.35Å; E399-E403 PolarHBondContact O-N 3.11Å; Q400-E403 PolarHBondContact O-N 3.23Å; E403-A405 VanDerWaalsContact C-N 3.28Å; E403-A405 PolarHBondContact O-N 2.97Å; E403-I406 PolarHBondContact O-N 2.89Å; E403-E407 WeakPolarHBondContact O-CB 3.23Å; E403-E407 PolarHBondContact O-N 2.7Å
404E45.3Very low54.1Low79 Ų7979.4 Ų79.437%0.36941%0.406SS..Hα-helixtrans-60.4-39.5168.3-71.1162-174.700109.5Q400 I406 E408Q400-E404 WeakPolarHBondContact O-CB 3.43Å; Q400-E404 WeakPolarHBondContact O-CG 3.35Å; Q400-E404 PolarHBondContact O-N 2.89Å; E404-I406 VanDerWaalsContact C-N 3.34Å; E404-I406 PolarHBondContact O-N 2.88Å; E404-E408 CarbonylContact O-C 3.54Å; E404-E408 WeakPolarHBondContact O-CA 3.23Å; E404-E408 WeakPolarHBondContact O-CB 3.44Å; E404-E408 VanDerWaalsContact O-CG 3.31Å; E404-E408 WeakPolarHBondContact O-CG 3.39Å; E404-E408 PolarHBondContact O-N 3.21Å
405A37.3Very low54.6Low25 Ų2582.4 Ų82.421%0.20742%0.419CS..Hα-helixtrans-75.9-12175.600000115.7T401 L402 E403 E408 K410T401-A405 WeakPolarHBondContact O-CA 3.29Å; T401-A405 WeakPolarHBondContact O-CB 3.44Å; T401-A405 PolarHBondContact O-N 3.12Å; L402-A405 CarbonylContact O-C 3.38Å; L402-A405 PolarHBondContact O-N 3.06Å; E403-A405 VanDerWaalsContact C-N 3.28Å; E403-A405 PolarHBondContact O-N 2.97Å; A405-E408 CarbonylContact C-O 3.52Å; A405-E408 WeakPolarHBondContact CA-O 3.43Å; A405-E408 CarbonylContact O-C 3.51Å; A405-K410 HydrophobicContact CB-CG 4.07Å
406I45.2Very low55.9Low109 Ų10982.7 Ų82.756%0.55942%0.421SS*.Hα-helixtrans-96.5-34.3175-72.2166.5000110.1L402 E403 E404L402-I406 HydrophobicContact CD1-CD1 4.37Å; L402-I406 HydrophobicContact CD2-CD1 4.48Å; L402-I406 HydrophobicContact CG-CD1 3.91Å; L402-I406 VanDerWaalsContact O-CB 3.31Å; L402-I406 WeakPolarHBondContact O-CB 3.21Å; L402-I406 WeakPolarHBondContact O-CD1 3.36Å; L402-I406 WeakPolarHBondContact O-CG1 3.48Å; L402-I406 PolarHBondContact O-N 3.49Å; E403-I406 PolarHBondContact O-N 2.89Å; E404-I406 VanDerWaalsContact C-N 3.34Å; E404-I406 PolarHBondContact O-N 2.88Å
407E47.6Very low57.4Low44 Ų4482.6 Ų82.621%0.20642%0.422CS..Hα-helixtrans-80.8-43.3172.9-73.6-178.4179.700111.6R146 E403 R450R146-E407 IonicContact CZ-OE1 3.76Å; R146-E407 IonicContact CZ-OE2 2.68Å; R146-E407 VanDerWaalsContact CZ-OE2 3.31Å; R146-E407 IonicContact NE-OE1 3.73Å; R146-E407 PolarHBondContact NE-OE1 2.72Å; R146-E407 IonicContact NE-OE2 2.73Å; R146-E407 PolarHBondContact NE-OE2 3.21Å; R146-E407 IonicContact NH1-OE2 3.03Å; R146-E407 VanDerWaalsContact NH2-CD 3.35Å; R146-E407 IonicContact NH2-OE1 2.93Å; R146-E407 PolarHBondContact NH2-OE1 3.13Å; R146-E407 IonicContact NH2-OE2 2.95Å; R146-E407 PolarHBondContact NH2-OE2 3.36Å; E403-E407 WeakPolarHBondContact O-CB 3.23Å; E403-E407 PolarHBondContact O-N 2.7Å; E407-R450 PolarHBondContact O-NH1 3.43Å
408E43.2Very low59Low98 Ų9881.8 Ų81.846%0.45842%0.419SS..THydrogen-bonded Turntrans-91.391.1160.5-46180153.800107.6E404 A405 K410E404-E408 CarbonylContact O-C 3.54Å; E404-E408 WeakPolarHBondContact O-CA 3.23Å; E404-E408 WeakPolarHBondContact O-CB 3.44Å; E404-E408 VanDerWaalsContact O-CG 3.31Å; E404-E408 WeakPolarHBondContact O-CG 3.39Å; E404-E408 PolarHBondContact O-N 3.21Å; A405-E408 CarbonylContact C-O 3.52Å; A405-E408 WeakPolarHBondContact CA-O 3.43Å; A405-E408 CarbonylContact O-C 3.51Å; E408-K410 PolarHBondContact O-N 2.93Å
409E48.3Very low61.1Low99 Ų9974.3 Ų74.346%0.46338%0.384SS..THydrogen-bonded Turntrans-43.3107.1163-171-176.9-136.800108.1Q411 R457E409-Q411 VanDerWaalsContact C-N 3.32Å; E409-Q411 VanDerWaalsContact O-CA 3.3Å; E409-Q411 WeakPolarHBondContact O-CA 3.48Å; E409-Q411 WeakPolarHBondContact O-CG 3.41Å; E409-Q411 PolarHBondContact O-N 2.65Å; E409-R457 IonicContact OE2-CZ 2.65Å; E409-R457 IonicContact OE2-NH1 3.8Å; E409-R457 PolarHBondContact OE2-NH1 2.98Å
410K48.5Very low63.2Low173 Ų17369.6 Ų69.675%0.75236%0.362SS*.  trans-40.499.6-168.4-109.2-175.9-175.9178.50109.1A405 E408 I412A405-K410 HydrophobicContact CB-CG 4.07Å; E408-K410 PolarHBondContact O-N 2.93Å; K410-I412 PolarHBondContact O-N 2.98Å
411Q64.9Low65.4Low24 Ų2467.6 Ų67.611%0.11235%0.353CS..  trans-73.7113.9-168.4-64.9-16758.300105.2E409 P413 L465 L476E409-Q411 VanDerWaalsContact C-N 3.32Å; E409-Q411 VanDerWaalsContact O-CA 3.3Å; E409-Q411 WeakPolarHBondContact O-CA 3.48Å; E409-Q411 WeakPolarHBondContact O-CG 3.41Å; E409-Q411 PolarHBondContact O-N 2.65Å; Q411-P413 VanDerWaalsContact O-CD 3.3Å; Q411-P413 WeakPolarHBondContact O-CD 3.47Å; Q411-L465 PolarHBondContact NE2-O 3.16Å; Q411-L476 HydrophobicContact CB-CD1 3.94Å; Q411-L476 HydrophobicContact CB-CD2 4.41Å; Q411-L476 WeakPolarHBondContact O-CD2 3.24Å
412I61.4Low68Low149 Ų14964 Ų6476%0.76433%0.33SS*.PPolyproline II helixtrans-65.4121.4176.9-57170.9000105K410 V414K410-I412 PolarHBondContact O-N 2.98Å; I412-V414 PolarHBondContact O-N 3.33Å
413P74.9Confident70.5Confident64 Ų6459.1 Ų59.142%0.41631%0.305SS..PPolyproline II helixtrans-50.5133.4174.3-23.330.9000109Q411 D415 L476Q411-P413 VanDerWaalsContact O-CD 3.3Å; Q411-P413 WeakPolarHBondContact O-CD 3.47Å; P413-D415 PolarHBondContact O-N 3.27Å; P413-L476 WeakPolarHBondContact CA-O 3.18Å; P413-L476 HydrophobicContact CB-CD2 4.41Å; P413-L476 HydrophobicContact CG-CD2 3.94Å
414V81.7Confident72.7Confident10 Ų1058.2 Ų58.26%0.06130%0.303CS..PPolyproline II helixtrans-63.4126.2-177.7-65.40000109.6I412 I416 V444 R462 V464 L476 A477 H478I412-V414 PolarHBondContact O-N 3.33Å; V414-I416 PolarHBondContact O-N 2.88Å; V414-V444 HydrophobicContact CB-CG2 4.12Å; V414-V444 HydrophobicContact CG1-CG1 3.96Å; V414-V444 HydrophobicContact CG1-CG2 4.24Å; V414-V444 HydrophobicContact CG2-CG1 4.13Å; V414-V444 HydrophobicContact CG2-CG2 3.79Å; V414-R462 HydrophobicContact CG1-CB 3.99Å; V414-V464 HydrophobicContact CG1-CG2 4.02Å; V414-L476 WeakPolarHBondContact CG2-O 3.43Å; V414-L476 PolarHBondContact N-O 3.46Å; V414-A477 VanDerWaalsContact CG2-C 3.41Å; V414-A477 WeakPolarHBondContact CG2-O 3.38Å; V414-H478 HydrophobicContact CG2-CB 3.89Å; V414-H478 PolarHBondContact O-CD2 2.67Å; V414-H478 PolarHBondContact O-CE1 3.16Å; V414-H478 PolarHBondContact O-ND1 2.88Å; V414-H478 PolarHBondContact O-NE2 2.95Å
415D82.8Confident74.9Confident125 Ų12555.3 Ų55.367%0.66829%0.288SS*.  trans-8633.4-171.466.9-24.7000113.9P413 R462P413-D415 PolarHBondContact O-N 3.27Å; D415-R462 IonicContact OD1-CZ 3.26Å; D415-R462 IonicContact OD1-NE 3.95Å; D415-R462 PolarHBondContact OD1-NE 3.15Å; D415-R462 IonicContact OD1-NH2 3.31Å
416I89.5Confident77.4Confident26 Ų2655.5 Ų55.513%0.13329%0.293CS..  trans-129.2154.4-175.663.9169.7000112.6V414 H419 P442 V444 R462 H478 C481V414-I416 PolarHBondContact O-N 2.88Å; I416-H419 HydrophobicContact CD1-CB 3.81Å; I416-H419 HydrophobicContact CG1-CB 4.27Å; I416-H419 PolarHBondContact O-CE1 3.41Å; I416-H419 PolarHBondContact O-ND1 3.41Å; I416-P442 HydrophobicContact CD1-CB 4.13Å; I416-V444 HydrophobicContact CD1-CG2 3.64Å; I416-V444 HydrophobicContact CG1-CG2 3.86Å; I416-R462 VanDerWaalsContact CG2-CZ 3.47Å; I416-H478 PolarHBondContact O-ND1 3.16Å; I416-C481 PolarHBondContact O-SG 3.08Å
417C90.8Very high79.5Confident67 Ų6760.2 Ų60.245%0.45330%0.304SS..  trans-134.8167.3175.2-72.60000110.1H419 C481C417-H419 PolarHBondContact O-N 2.68Å; C417-C481 WeakPolarHBondContact CA-SG 3.46Å; C417-C481 HydrophobicContact CB-CB 3.59Å; C417-C481 WeakPolarHBondContact CB-SG 3.45Å; C417-C481 WeakPolarHBondContact SG-CB 3.26Å; C417-C481 CovalentContact SG-SG 2.04Å; C417-C481 PolarHBondContact SG-SG 3.23Å
418N91.2Very high81.6Confident118 Ų11860.7 Ų60.763%0.63131%0.31SS*.SBendtrans57.729.2-172.4-64.1-49.6000113.6C481N418-C481 PolarHBondContact N-O 2.96Å
419H94.2Very high84Confident0 Ų056 Ų560%029%0.288CS..  trans-92.8165178.858.2-75.8000112.7I416 C417 P442 V444 A477 H478 K483 W484I416-H419 HydrophobicContact CD1-CB 3.81Å; I416-H419 HydrophobicContact CG1-CB 4.27Å; I416-H419 PolarHBondContact O-CE1 3.41Å; I416-H419 PolarHBondContact O-ND1 3.41Å; C417-H419 PolarHBondContact O-N 2.68Å; H419-P442 CarbonylContact C-O 3.4Å; H419-P442 VanDerWaalsContact CA-O 3.26Å; H419-P442 WeakPolarHBondContact CA-O 3.29Å; H419-P442 HydrophobicContact CB-CB 3.89Å; H419-P442 VanDerWaalsContact CB-O 3.26Å; H419-P442 WeakPolarHBondContact CB-O 3.06Å; H419-V444 HydrophobicContact CB-CG2 4.46Å; H419-V444 WeakPolarHBondContact CD2-CG2 3.31Å; H419-A477 PolarHBondContact NE2-O 3.02Å; H419-H478 PolarHBondContact CE1-O 2.79Å; H419-K483 PolarHBondContact O-N 3.03Å; H419-W484 PolarHBondContact O-N 2.97Å
420A96.6Very high86.2Confident0 Ų053 Ų530%028%0.278CS..EExtended strand (participates in β ladder)trans-84.7125161.300000109L436 I441 P442 L443 V444 W484 I486A420-L436 HydrophobicContact CB-CD1 4.12Å; A420-I441 HydrophobicContact CB-CG2 4.2Å; A420-P442 PolarHBondContact N-O 3.2Å; A420-L443 HydrophobicContact CB-CD1 4.32Å; A420-V444 PolarHBondContact O-N 2.71Å; A420-W484 HydrophobicContact CB-CB 4.45Å; A420-W484 HydrophobicContact CB-CE3 4.27Å; A420-I486 HydrophobicContact CB-CD1 4.37Å
421L96.9Very high88.4Confident0 Ų050.6 Ų50.60%027%0.273CS..EExtended strand (participates in β ladder)trans-97.3108171.2179.854.5000109.1V444 I446 M474 A477 L479 A482 W484 L485 I486L421-V444 WeakPolarHBondContact CA-O 3.3Å; L421-V444 HydrophobicContact CD1-CB 3.96Å; L421-V444 HydrophobicContact CD1-CG1 3.78Å; L421-I446 HydrophobicContact CD1-CD1 3.74Å; L421-I446 HydrophobicContact CD1-CG1 3.9Å; L421-I446 HydrophobicContact CD2-CD1 4.06Å; L421-I446 HydrophobicContact CG-CD1 4.21Å; L421-M474 HydrophobicContact CD2-CE 4.03Å; L421-M474 HydrophobicContact CD2-SD 4.35Å; L421-A477 HydrophobicContact CD1-CB 3.65Å; L421-A477 HydrophobicContact CD2-CB 4.03Å; L421-L479 HydrophobicContact CD2-CB 4.27Å; L421-L479 HydrophobicContact CD2-CD1 3.87Å; L421-A482 HydrophobicContact CB-CB 4.22Å; L421-W484 PolarHBondContact N-O 3.28Å; L421-L485 HydrophobicContact CB-CD1 4.23Å; L421-L485 HydrophobicContact CD2-CD1 3.99Å; L421-L485 HydrophobicContact CG-CD1 3.93Å; L421-L485 WeakPolarHBondContact O-CA 3.29Å; L421-I486 PolarHBondContact O-N 3.04Å
422L97.3Very high89.8Confident0 Ų052.2 Ų52.20%028%0.282CS..EExtended strand (participates in β ladder)trans-98.5118.9-179.8176.763000110.1Y425 G429 L432 L443 V444 V445 I446 I486 T488L422-Y425 HydrophobicContact CD2-CD2 3.75Å; L422-Y425 HydrophobicContact CD2-CE2 4.09Å; L422-G429 WeakPolarHBondContact CD2-O 3.06Å; L422-L432 HydrophobicContact CD1-CD2 4.11Å; L422-L443 HydrophobicContact CB-CD1 3.8Å; L422-L443 HydrophobicContact CD2-CD1 4.41Å; L422-V444 PolarHBondContact N-O 3.48Å; L422-V445 HydrophobicContact CB-CG2 4.45Å; L422-V445 HydrophobicContact CD2-CG2 4.39Å; L422-V445 CarbonylContact O-C 3.53Å; L422-V445 VanDerWaalsContact O-CA 3.31Å; L422-V445 WeakPolarHBondContact O-CA 2.99Å; L422-I446 PolarHBondContact O-N 2.93Å; L422-I486 HydrophobicContact CD1-CB 4.1Å; L422-I486 HydrophobicContact CD1-CG2 4.12Å; L422-T488 HydrophobicContact CD1-CG2 3.59Å
423V96.2Very high91.3Very high6 Ų645.1 Ų45.14%0.03625%0.245CC..EExtended strand (participates in β ladder)trans-100.1120174.4-175.50000109.2I446 A468 L485 I486 L487 T488 I489V423-I446 HydrophobicContact CG2-CB 4.41Å; V423-I446 HydrophobicContact CG2-CD1 4.23Å; V423-A468 HydrophobicContact CB-CB 4.29Å; V423-A468 HydrophobicContact CG1-CB 3.47Å; V423-A468 VanDerWaalsContact CG1-CB 3.47Å; V423-A468 HydrophobicContact CG2-CB 3.76Å; V423-L485 HydrophobicContact CG2-CD1 3.81Å; V423-I486 PolarHBondContact N-O 3.19Å; V423-L487 HydrophobicContact CB-CD2 3.57Å; V423-L487 HydrophobicContact CG1-CD2 4.25Å; V423-L487 HydrophobicContact CG2-CD2 3.48Å; V423-L487 VanDerWaalsContact CG2-CD2 3.48Å; V423-T488 PolarHBondContact O-N 3.49Å; V423-T488 PolarHBondContact O-OG1 3.27Å; V423-I489 HydrophobicContact CG1-CG2 3.94Å
424G92.5Very high92.2Very high7 Ų745.9 Ų45.97%0.07224%0.243CC..  trans88.1114.3-174.800000111.9G429 I446 E447 T488G424-G429 WeakPolarHBondContact O-CA 3.32Å; G424-I446 PolarHBondContact N-O 3.01Å; G424-E447 VanDerWaalsContact CA-OE2 3.23Å; G424-E447 WeakPolarHBondContact CA-OE2 3.15Å; G424-T488 PolarHBondContact O-OG1 2.94Å
425Y92.9Very high92.8Very high17 Ų1752.6 Ų52.67%0.06727%0.272CS..  trans-105.350172.1-151.4-94.1000111L422 E434 V445 E447 R452 L456L422-Y425 HydrophobicContact CD2-CD2 3.75Å; L422-Y425 HydrophobicContact CD2-CE2 4.09Å; Y425-E434 PolarHBondContact OH-OE1 2.77Å; Y425-E434 VanDerWaalsContact OH-OE1 3.13Å; Y425-V445 HydrophobicContact CD2-CB 4.47Å; Y425-V445 HydrophobicContact CD2-CG1 3.75Å; Y425-V445 HydrophobicContact CD2-CG2 3.85Å; Y425-V445 HydrophobicContact CE2-CG2 4.13Å; Y425-V445 HydrophobicContact CG-CG1 4.16Å; Y425-E447 PolarHBondContact N-OE2 2.93Å; Y425-R452 VanDerWaalsContact C-NH1 3.35Å; Y425-R452 WeakPolarHBondContact O-CD 3.5Å; Y425-R452 PolarHBondContact O-NH1 3.16Å; Y425-R452 VanDerWaalsContact O-NH1 3.16Å; Y425-L456 HydrophobicContact CD1-CD1 4.2Å; Y425-L456 HydrophobicContact CD1-CD2 4.07Å; Y425-L456 HydrophobicContact CD1-CG 4.42Å; Y425-L456 HydrophobicContact CD2-CD1 4.09Å; Y425-L456 HydrophobicContact CD2-CD2 4.11Å; Y425-L456 HydrophobicContact CE1-CD2 3.74Å; Y425-L456 HydrophobicContact CE2-CD2 3.77Å; Y425-L456 HydrophobicContact CG-CD1 3.88Å; Y425-L456 HydrophobicContact CG-CD2 4.25Å
426G88.5Confident93.4Very high30 Ų3047.7 Ų47.731%0.30925%0.245SC..SBendtrans-88.3-147.9179.900000112.6V428 S430G426-V428 PolarHBondContact O-N 3.47Å; G426-S430 VanDerWaalsContact O-CB 3.23Å; G426-S430 WeakPolarHBondContact O-CB 3.27Å; G426-S430 PolarHBondContact O-N 3.5Å; G426-S430 PolarHBondContact O-OG 2.87Å
427R89Confident93.5Very high207 Ų20749.1 Ų49.178%0.78125%0.253SS*.Hα-helixtrans-57.8-44.5179-69178.4-72.8173.3-2.5113.8S430 L431R427-S430 PolarHBondContact O-OG 3.15Å; R427-L431 WeakPolarHBondContact O-CD1 3.3Å; R427-L431 WeakPolarHBondContact O-CG 3.5Å
428V92.4Very high93.6Very high54 Ų5450 Ų5033%0.32727%0.265SS..Hα-helixtrans-84.7-44.7178.6174.50000110.8G426 S430 L431 L432 T488 R514G426-V428 PolarHBondContact O-N 3.47Å; V428-S430 PolarHBondContact O-N 3.17Å; V428-L431 PolarHBondContact O-N 2.79Å; V428-L432 PolarHBondContact O-N 2.97Å; V428-T488 HydrophobicContact CG1-CG2 4.08Å; V428-R514 VanDerWaalsContact CG2-CZ 3.46Å; V428-R514 VanDerWaalsContact CG2-NH1 3.32Å
429G93.7Very high93.7Very high0 Ų048 Ų480%026%0.261CS..Hα-helixtrans-57.6-43.4179.600000113.8L422 G424 L432 G433 T488L422-G429 WeakPolarHBondContact CD2-O 3.06Å; G424-G429 WeakPolarHBondContact O-CA 3.32Å; G429-L432 PolarHBondContact O-N 3.29Å; G429-G433 PolarHBondContact O-N 2.99Å; G429-T488 WeakPolarHBondContact CA-OG1 3.4Å; G429-T488 PolarHBondContact N-OG1 2.82Å
430S93.8Very high93.5Very high36 Ų3655.3 Ų55.325%0.25230%0.3SS..Hα-helixtrans-62.1-49.817755.60000112.3G426 R427 V428 L432 G433 E434G426-S430 VanDerWaalsContact O-CB 3.23Å; G426-S430 WeakPolarHBondContact O-CB 3.27Å; G426-S430 PolarHBondContact O-N 3.5Å; G426-S430 PolarHBondContact O-OG 2.87Å; R427-S430 PolarHBondContact O-OG 3.15Å; V428-S430 PolarHBondContact O-N 3.17Å; S430-L432 VanDerWaalsContact C-N 3.25Å; S430-L432 PolarHBondContact O-N 3.32Å; S430-G433 PolarHBondContact O-N 2.86Å; S430-G433 VanDerWaalsContact O-N 3.16Å; S430-E434 WeakPolarHBondContact O-CG 2.9Å; S430-E434 PolarHBondContact O-N 3.17Å
431L94.3Very high93.3Very high123 Ų12357.7 Ų57.764%0.64431%0.312SS*.Hα-helixtrans-57.4-39.4176.9-67.3174.8000112.5R427 V428 K435R427-L431 WeakPolarHBondContact O-CD1 3.3Å; R427-L431 WeakPolarHBondContact O-CG 3.5Å; V428-L431 PolarHBondContact O-N 2.79Å; L431-K435 WeakPolarHBondContact O-CG 3.15Å; L431-K435 PolarHBondContact O-N 3.41Å
432L94.6Very high93.2Very high57 Ų5760.8 Ų60.830%0.29833%0.332SS..Hα-helixtrans-71.2-45.3176.7-173.565.2000111.5L422 V428 G429 S430 E434 K435 L436 I486 T488L422-L432 HydrophobicContact CD1-CD2 4.11Å; V428-L432 PolarHBondContact O-N 2.97Å; G429-L432 PolarHBondContact O-N 3.29Å; S430-L432 VanDerWaalsContact C-N 3.25Å; S430-L432 PolarHBondContact O-N 3.32Å; L432-E434 PolarHBondContact O-N 3.48Å; L432-K435 PolarHBondContact O-N 2.87Å; L432-K435 VanDerWaalsContact O-N 3.15Å; L432-L436 HydrophobicContact CG-CD1 4.03Å; L432-L436 HydrophobicContact CG-CG 4.35Å; L432-L436 WeakPolarHBondContact O-CG 3.46Å; L432-L436 PolarHBondContact O-N 3.17Å; L432-I486 HydrophobicContact CD2-CB 4.32Å; L432-I486 HydrophobicContact CD2-CD1 3.95Å; L432-I486 HydrophobicContact CD2-CG2 3.46Å; L432-I486 VanDerWaalsContact CD2-CG2 3.46Å; L432-T488 HydrophobicContact CD2-CG2 4.37Å
433G94.3Very high93.1Very high0 Ų061 Ų610%033%0.333CS..Hα-helixtrans-58.9-44.9178.600000112.6G429 S430 K435 L436 L437G429-G433 PolarHBondContact O-N 2.99Å; S430-G433 PolarHBondContact O-N 2.86Å; S430-G433 VanDerWaalsContact O-N 3.16Å; G433-K435 VanDerWaalsContact C-N 3.31Å; G433-K435 PolarHBondContact O-N 2.79Å; G433-L436 PolarHBondContact O-N 2.78Å; G433-L437 WeakPolarHBondContact O-CB 3.4Å; G433-L437 VanDerWaalsContact O-CG 3.29Å; G433-L437 WeakPolarHBondContact O-CG 3.13Å; G433-L437 PolarHBondContact O-N 3.28Å
434E93.4Very high93.1Very high80 Ų8060.8 Ų60.837%0.37433%0.331SS..Hα-helixtrans-57.6-43.6174.2-67.4-51.3146.100111.9Y425 S430 L432 A438 R459Y425-E434 PolarHBondContact OH-OE1 2.77Å; Y425-E434 VanDerWaalsContact OH-OE1 3.13Å; S430-E434 WeakPolarHBondContact O-CG 2.9Å; S430-E434 PolarHBondContact O-N 3.17Å; L432-E434 PolarHBondContact O-N 3.48Å; E434-A438 VanDerWaalsContact O-CB 3.29Å; E434-A438 WeakPolarHBondContact O-CB 3.11Å; E434-A438 PolarHBondContact O-N 2.96Å; E434-R459 IonicContact OE1-CZ 3.18Å; E434-R459 IonicContact OE1-NH1 3.93Å; E434-R459 PolarHBondContact OE1-NH1 3.36Å; E434-R459 IonicContact OE1-NH2 3.39Å; E434-R459 PolarHBondContact OE1-NH2 3.38Å; E434-R459 IonicContact OE2-CZ 3.55Å; E434-R459 IonicContact OE2-NH2 3.25Å; E434-R459 PolarHBondContact OE2-NH2 3.4Å
435K94.5Very high93.2Very high152 Ų15260.4 Ų60.466%0.66133%0.328SS*.Hα-helixtrans-69.4-37.5179.1-73.3-173.5177.2-167.90112.9L431 L432 G433 A438 S439L431-K435 WeakPolarHBondContact O-CG 3.15Å; L431-K435 PolarHBondContact O-N 3.41Å; L432-K435 PolarHBondContact O-N 2.87Å; L432-K435 VanDerWaalsContact O-N 3.15Å; G433-K435 VanDerWaalsContact C-N 3.31Å; G433-K435 PolarHBondContact O-N 2.79Å; K435-A438 PolarHBondContact O-N 2.92Å; K435-S439 WeakPolarHBondContact O-CB 3.35Å; K435-S439 PolarHBondContact O-N 3.36Å; K435-S439 VanDerWaalsContact O-N 3.09Å; K435-S439 PolarHBondContact O-OG 2.68Å
436L94.4Very high93.3Very high21 Ų2159.7 Ų59.711%0.1133%0.325CS..Hα-helixtrans-64.5-45.6176.1-71.1173.1000110.8A420 L432 G433 S439 D440 I441 L443 I486A420-L436 HydrophobicContact CB-CD1 4.12Å; L432-L436 HydrophobicContact CG-CD1 4.03Å; L432-L436 HydrophobicContact CG-CG 4.35Å; L432-L436 WeakPolarHBondContact O-CG 3.46Å; L432-L436 PolarHBondContact O-N 3.17Å; G433-L436 PolarHBondContact O-N 2.78Å; L436-S439 PolarHBondContact O-N 3.32Å; L436-D440 PolarHBondContact O-N 2.89Å; L436-I441 HydrophobicContact CD2-CB 4.29Å; L436-I441 HydrophobicContact CD2-CD1 3.7Å; L436-I441 HydrophobicContact CD2-CG2 4.27Å; L436-I441 PolarHBondContact O-N 2.89Å; L436-I441 VanDerWaalsContact O-N 3.08Å; L436-L443 HydrophobicContact CD1-CD1 3.84Å; L436-I486 HydrophobicContact CD1-CD1 4.1Å
437L91.7Very high93.3Very high56 Ų5658.8 Ų58.829%0.29331%0.313SS..Hα-helixtrans-62.1-44.6175-69.1168.7000111.8G433 S439 D440 L443 V461G433-L437 WeakPolarHBondContact O-CB 3.4Å; G433-L437 VanDerWaalsContact O-CG 3.29Å; G433-L437 WeakPolarHBondContact O-CG 3.13Å; G433-L437 PolarHBondContact O-N 3.28Å; L437-S439 PolarHBondContact O-N 2.92Å; L437-D440 PolarHBondContact O-N 3.09Å; L437-D440 VanDerWaalsContact O-N 3.14Å; L437-L443 HydrophobicContact CD1-CD2 4.25Å; L437-L443 HydrophobicContact CD2-CB 4.18Å; L437-L443 HydrophobicContact CD2-CD2 4.15Å; L437-L443 HydrophobicContact CG-CD2 3.9Å; L437-V461 HydrophobicContact CD1-CG2 3.64Å; L437-V461 HydrophobicContact CD2-CG2 4.2Å
438A93.2Very high93Very high85 Ų8552.6 Ų52.670%0.70230%0.298SS*.Hα-helixtrans-65.7-17.6177.200000113.7E434 K435E434-A438 VanDerWaalsContact O-CB 3.29Å; E434-A438 WeakPolarHBondContact O-CB 3.11Å; E434-A438 PolarHBondContact O-N 2.96Å; K435-A438 PolarHBondContact O-N 2.92Å
439S93.4Very high92.3Very high78 Ų7851.7 Ų51.755%0.54529%0.294SS..THydrogen-bonded Turntrans-99.512.6177.4-52.40000113K435 L436 L437 I441K435-S439 WeakPolarHBondContact O-CB 3.35Å; K435-S439 PolarHBondContact O-N 3.36Å; K435-S439 VanDerWaalsContact O-N 3.09Å; K435-S439 PolarHBondContact O-OG 2.68Å; L436-S439 PolarHBondContact O-N 3.32Å; L437-S439 PolarHBondContact O-N 2.92Å; S439-I441 PolarHBondContact O-N 2.96Å; S439-I441 VanDerWaalsContact O-N 3.16Å
440D90.7Very high91.6Very high153 Ų15356.5 Ų56.582%0.81831%0.312SS*.THydrogen-bonded Turntrans54.528.3-176.8-65.9-47.8000114.1L436 L437L436-D440 PolarHBondContact O-N 2.89Å; L437-D440 PolarHBondContact O-N 3.09Å; L437-D440 VanDerWaalsContact O-N 3.14Å
441I92.7Very high90.7Very high50 Ų5059.2 Ų59.226%0.25633%0.327SS..  trans-84.7123.4174.8-63171.2000108.4A420 L436 S439 L443 W484A420-I441 HydrophobicContact CB-CG2 4.2Å; L436-I441 HydrophobicContact CD2-CB 4.29Å; L436-I441 HydrophobicContact CD2-CD1 3.7Å; L436-I441 HydrophobicContact CD2-CG2 4.27Å; L436-I441 PolarHBondContact O-N 2.89Å; L436-I441 VanDerWaalsContact O-N 3.08Å; S439-I441 PolarHBondContact O-N 2.96Å; S439-I441 VanDerWaalsContact O-N 3.16Å; I441-L443 PolarHBondContact O-N 2.78Å; I441-W484 HydrophobicContact CG2-CZ3 4.1Å
442P93.4Very high90.1Very high64 Ų6457 Ų5742%0.41631%0.31SS..  trans-57.3126.4176.5-23.333.4000110.7I416 H419 A420I416-P442 HydrophobicContact CD1-CB 4.13Å; H419-P442 CarbonylContact C-O 3.4Å; H419-P442 VanDerWaalsContact CA-O 3.26Å; H419-P442 WeakPolarHBondContact CA-O 3.29Å; H419-P442 HydrophobicContact CB-CB 3.89Å; H419-P442 VanDerWaalsContact CB-O 3.26Å; H419-P442 WeakPolarHBondContact CB-O 3.06Å; A420-P442 PolarHBondContact N-O 3.2Å
443L95.4Very high89.7Confident6 Ų654.2 Ų54.23%0.03130%0.296CS..EExtended strand (participates in β ladder)trans-122.1131.9-173179.565.1000110.7A420 L422 L436 L437 I441 V445 V461A420-L443 HydrophobicContact CB-CD1 4.32Å; L422-L443 HydrophobicContact CB-CD1 3.8Å; L422-L443 HydrophobicContact CD2-CD1 4.41Å; L436-L443 HydrophobicContact CD1-CD1 3.84Å; L437-L443 HydrophobicContact CD1-CD2 4.25Å; L437-L443 HydrophobicContact CD2-CB 4.18Å; L437-L443 HydrophobicContact CD2-CD2 4.15Å; L437-L443 HydrophobicContact CG-CD2 3.9Å; I441-L443 PolarHBondContact O-N 2.78Å; L443-V445 HydrophobicContact CD1-CG2 4.31Å; L443-V445 HydrophobicContact CD2-CG2 3.96Å; L443-V445 HydrophobicContact CG-CG2 3.92Å; L443-V461 HydrophobicContact CD2-CG1 4.22Å; L443-V461 HydrophobicContact CG-CG1 4.5Å
444V96.1Very high89.1Confident0 Ų057.2 Ų57.20%031%0.312CS..EExtended strand (participates in β ladder)trans-118.3135.2163.5179.20000107.9V414 I416 H419 A420 L421 L422 R462 V464 A477V414-V444 HydrophobicContact CB-CG2 4.12Å; V414-V444 HydrophobicContact CG1-CG1 3.96Å; V414-V444 HydrophobicContact CG1-CG2 4.24Å; V414-V444 HydrophobicContact CG2-CG1 4.13Å; V414-V444 HydrophobicContact CG2-CG2 3.79Å; I416-V444 HydrophobicContact CD1-CG2 3.64Å; I416-V444 HydrophobicContact CG1-CG2 3.86Å; H419-V444 HydrophobicContact CB-CG2 4.46Å; H419-V444 WeakPolarHBondContact CD2-CG2 3.31Å; A420-V444 PolarHBondContact O-N 2.71Å; L421-V444 WeakPolarHBondContact CA-O 3.3Å; L421-V444 HydrophobicContact CD1-CB 3.96Å; L421-V444 HydrophobicContact CD1-CG1 3.78Å; L422-V444 PolarHBondContact N-O 3.48Å; V444-R462 WeakPolarHBondContact CA-O 3.35Å; V444-R462 HydrophobicContact CG2-CB 4.37Å; V444-V464 HydrophobicContact CG1-CG2 4.28Å; V444-A477 HydrophobicContact CG1-CB 4.03Å
445V95.5Very high88.8Confident0 Ų058.6 Ų58.60%032%0.318CS..EExtended strand (participates in β ladder)trans-114.2131.2179-177.10000109.9L422 Y425 L443 L456 V461 R462 A463 V464L422-V445 HydrophobicContact CB-CG2 4.45Å; L422-V445 HydrophobicContact CD2-CG2 4.39Å; L422-V445 CarbonylContact O-C 3.53Å; L422-V445 VanDerWaalsContact O-CA 3.31Å; L422-V445 WeakPolarHBondContact O-CA 2.99Å; Y425-V445 HydrophobicContact CD2-CB 4.47Å; Y425-V445 HydrophobicContact CD2-CG1 3.75Å; Y425-V445 HydrophobicContact CD2-CG2 3.85Å; Y425-V445 HydrophobicContact CE2-CG2 4.13Å; Y425-V445 HydrophobicContact CG-CG1 4.16Å; L443-V445 HydrophobicContact CD1-CG2 4.31Å; L443-V445 HydrophobicContact CD2-CG2 3.96Å; L443-V445 HydrophobicContact CG-CG2 3.92Å; V445-L456 HydrophobicContact CB-CD1 4Å; V445-L456 HydrophobicContact CG1-CD1 3.73Å; V445-L456 HydrophobicContact CG2-CD1 4.25Å; V445-V461 HydrophobicContact CG2-CG1 4.04Å; V445-R462 PolarHBondContact N-O 3.29Å; V445-A463 HydrophobicContact CB-CB 4.35Å; V445-A463 CarbonylContact O-C 3.56Å; V445-A463 VanDerWaalsContact O-CA 3.25Å; V445-A463 WeakPolarHBondContact O-CA 3.32Å; V445-V464 PolarHBondContact O-N 3.17Å
446I94.3Very high88.5Confident1 Ų151.5 Ų51.51%0.00529%0.288CS..EExtended strand (participates in β ladder)trans-102.6128.6164.6-65.1162.9000108.4L421 L422 V423 G424 V464 G466 A468 I473 M474 A477L421-I446 HydrophobicContact CD1-CD1 3.74Å; L421-I446 HydrophobicContact CD1-CG1 3.9Å; L421-I446 HydrophobicContact CD2-CD1 4.06Å; L421-I446 HydrophobicContact CG-CD1 4.21Å; L422-I446 PolarHBondContact O-N 2.93Å; V423-I446 HydrophobicContact CG2-CB 4.41Å; V423-I446 HydrophobicContact CG2-CD1 4.23Å; G424-I446 PolarHBondContact N-O 3.01Å; I446-V464 WeakPolarHBondContact CA-O 3.46Å; I446-V464 HydrophobicContact CG1-CB 4.19Å; I446-G466 VanDerWaalsContact CG2-O 3.24Å; I446-G466 WeakPolarHBondContact CG2-O 3.45Å; I446-A468 HydrophobicContact CD1-CB 4.11Å; I446-A468 HydrophobicContact CG2-CB 4.08Å; I446-I473 HydrophobicContact CD1-CG2 4.22Å; I446-I473 HydrophobicContact CG1-CG2 4.24Å; I446-I473 HydrophobicContact CG2-CG2 3.73Å; I446-M474 HydrophobicContact CD1-SD 3.53Å; I446-M474 VanDerWaalsContact CD1-SD 3.53Å; I446-A477 HydrophobicContact CD1-CB 3.67Å; I446-A477 HydrophobicContact CG1-CB 3.86Å
447E89.4Confident88.3Confident11 Ų1154.2 Ų54.25%0.05130%0.297CS..EExtended strand (participates in β ladder)trans-144.5144.4178.9-17748.4-137.200111.3G424 Y425 S449 R452 V453 V464 L465 G466G424-E447 VanDerWaalsContact CA-OE2 3.23Å; G424-E447 WeakPolarHBondContact CA-OE2 3.15Å; Y425-E447 PolarHBondContact N-OE2 2.93Å; E447-S449 PolarHBondContact OE1-N 2.83Å; E447-R452 HydrophobicContact CG-CB 3.97Å; E447-R452 IonicContact OE1-CZ 3.87Å; E447-R452 IonicContact OE1-NE 2.99Å; E447-R452 IonicContact OE1-NH1 2.65Å; E447-R452 PolarHBondContact OE1-NH1 3.47Å; E447-R452 IonicContact OE1-NH2 2.84Å; E447-R452 PolarHBondContact OE1-NH2 2.77Å; E447-R452 IonicContact OE2-CZ 3.85Å; E447-R452 IonicContact OE2-NH1 3.89Å; E447-R452 PolarHBondContact OE2-NH1 3.29Å; E447-V453 HydrophobicContact CB-CG2 3.9Å; E447-V453 HydrophobicContact CG-CG2 4.49Å; E447-V464 PolarHBondContact N-O 2.95Å; E447-L465 CarbonylContact O-C 3.54Å; E447-L465 VanDerWaalsContact O-CA 3.3Å; E447-L465 WeakPolarHBondContact O-CA 3.44Å; E447-G466 CarbonylContact C-O 3.51Å; E447-G466 PolarHBondContact O-N 3.38Å
448T81.3Confident88Confident78 Ų7859.6 Ų59.648%0.47932%0.32SS..SBendtrans-84.9-22.4178.6540000112.6L465 G466 N467T448-L465 VanDerWaalsContact O-CD1 3.29Å; T448-L465 WeakPolarHBondContact O-CD1 3.4Å; T448-G466 WeakPolarHBondContact CG2-O 3.48Å; T448-N467 HydrophobicContact CG2-CB 4.31Å
449S78.4Confident87.8Confident34 Ų3461.6 Ų61.624%0.23831%0.31CS..  trans-82.8113.9178.3177.30000112.4E447 T451 R452 V453E447-S449 PolarHBondContact OE1-N 2.83Å; S449-T451 VanDerWaalsContact C-N 3.34Å; S449-T451 PolarHBondContact O-N 3.4Å; S449-R452 PolarHBondContact O-N 3.15Å; S449-V453 PolarHBondContact O-N 2.9Å; S449-V453 VanDerWaalsContact O-N 3.11Å
450R78.2Confident87.5Confident102 Ų10260.9 Ų60.939%0.38532%0.315SS..Hα-helixtrans-56.1-45.1176-171.5164.8-174.3159.43.4112.9E407 R452 V453 D454 L465E407-R450 PolarHBondContact O-NH1 3.43Å; R450-R452 VanDerWaalsContact C-N 3.27Å; R450-R452 PolarHBondContact O-N 2.87Å; R450-V453 WeakPolarHBondContact O-CB 3.23Å; R450-V453 PolarHBondContact O-N 3.33Å; R450-D454 VanDerWaalsContact O-CG 3.31Å; R450-D454 PolarHBondContact O-N 2.73Å; R450-L465 HydrophobicContact CB-CD1 4.21Å; R450-L465 HydrophobicContact CB-CD2 4.2Å; R450-L465 HydrophobicContact CG-CD2 4.19Å
451T75Confident87.5Confident92 Ų9254 Ų5456%0.56428%0.278SS*.Hα-helixtrans-53.5-43.4177.5-44.80000112.4S449 E455S449-T451 VanDerWaalsContact C-N 3.34Å; S449-T451 PolarHBondContact O-N 3.4Å; T451-E455 VanDerWaalsContact O-CG 3.32Å; T451-E455 WeakPolarHBondContact O-CG 3.25Å; T451-E455 PolarHBondContact O-N 2.93Å
452R82.8Confident87.5Confident76 Ų7656.7 Ų56.729%0.28729%0.285SS..Hα-helixtrans-72.4-36.2178.8-77.5-172.3-90.3145.83.8112.6Y425 E447 S449 R450 D454 L456Y425-R452 VanDerWaalsContact C-NH1 3.35Å; Y425-R452 WeakPolarHBondContact O-CD 3.5Å; Y425-R452 PolarHBondContact O-NH1 3.16Å; Y425-R452 VanDerWaalsContact O-NH1 3.16Å; E447-R452 HydrophobicContact CG-CB 3.97Å; E447-R452 IonicContact OE1-CZ 3.87Å; E447-R452 IonicContact OE1-NE 2.99Å; E447-R452 IonicContact OE1-NH1 2.65Å; E447-R452 PolarHBondContact OE1-NH1 3.47Å; E447-R452 IonicContact OE1-NH2 2.84Å; E447-R452 PolarHBondContact OE1-NH2 2.77Å; E447-R452 IonicContact OE2-CZ 3.85Å; E447-R452 IonicContact OE2-NH1 3.89Å; E447-R452 PolarHBondContact OE2-NH1 3.29Å; S449-R452 PolarHBondContact O-N 3.15Å; R450-R452 VanDerWaalsContact C-N 3.27Å; R450-R452 PolarHBondContact O-N 2.87Å; R452-D454 VanDerWaalsContact C-N 3.34Å; R452-L456 WeakPolarHBondContact O-CB 3.45Å; R452-L456 WeakPolarHBondContact O-CD1 3.31Å; R452-L456 WeakPolarHBondContact O-CG 3.29Å; R452-L456 PolarHBondContact O-N 3.24Å
453V85.3Confident87.4Confident0 Ų053.9 Ų53.90%027%0.267CS..Hα-helixtrans-62.7-43.9174.5172.20000110.7E447 S449 R450 L456 R457 A463 L465E447-V453 HydrophobicContact CB-CG2 3.9Å; E447-V453 HydrophobicContact CG-CG2 4.49Å; S449-V453 PolarHBondContact O-N 2.9Å; S449-V453 VanDerWaalsContact O-N 3.11Å; R450-V453 WeakPolarHBondContact O-CB 3.23Å; R450-V453 PolarHBondContact O-N 3.33Å; V453-L456 PolarHBondContact O-N 2.83Å; V453-R457 HydrophobicContact CG1-CG 4.43Å; V453-R457 WeakPolarHBondContact O-CB 3.37Å; V453-R457 VanDerWaalsContact O-CG 3.29Å; V453-R457 WeakPolarHBondContact O-CG 3.47Å; V453-R457 PolarHBondContact O-N 3.01Å; V453-A463 HydrophobicContact CB-CB 4.47Å; V453-A463 HydrophobicContact CG1-CB 3.98Å; V453-A463 HydrophobicContact CG2-CB 4.49Å; V453-L465 HydrophobicContact CG1-CB 4.29Å; V453-L465 HydrophobicContact CG2-CB 4.07Å; V453-L465 HydrophobicContact CG2-CD1 4.03Å
454D81.6Confident87.2Confident62 Ų6253.7 Ų53.733%0.33227%0.266SS..Hα-helixtrans-63.1-48.8178-64.6-20.7000110.8R450 R452 L456 R457 E458R450-D454 VanDerWaalsContact O-CG 3.31Å; R450-D454 PolarHBondContact O-N 2.73Å; R452-D454 VanDerWaalsContact C-N 3.34Å; D454-L456 VanDerWaalsContact C-N 3.29Å; D454-L456 PolarHBondContact O-N 3.33Å; D454-R457 PolarHBondContact O-N 3.44Å; D454-E458 WeakPolarHBondContact O-CG 3.29Å; D454-E458 PolarHBondContact O-N 3.19Å
455E86.7Confident86.7Confident110 Ų11055.2 Ų55.251%0.51427%0.274SS..Hα-helixtrans-56.9-40.3175.1-75173.2-176.300112.7T451 R459T451-E455 VanDerWaalsContact O-CG 3.32Å; T451-E455 WeakPolarHBondContact O-CG 3.25Å; T451-E455 PolarHBondContact O-N 2.93Å; E455-R459 WeakPolarHBondContact O-CD 3.38Å; E455-R459 VanDerWaalsContact O-CG 3.24Å; E455-R459 WeakPolarHBondContact O-CG 3.33Å; E455-R459 PolarHBondContact O-N 3.43Å
456L89.7Confident86.1Confident3 Ų356 Ų562%0.01628%0.283CS..Hα-helixtrans-67.6-43.7177.1-77168.1000112Y425 V445 R452 V453 D454 R459 G460 V461 A463Y425-L456 HydrophobicContact CD1-CD1 4.2Å; Y425-L456 HydrophobicContact CD1-CD2 4.07Å; Y425-L456 HydrophobicContact CD1-CG 4.42Å; Y425-L456 HydrophobicContact CD2-CD1 4.09Å; Y425-L456 HydrophobicContact CD2-CD2 4.11Å; Y425-L456 HydrophobicContact CE1-CD2 3.74Å; Y425-L456 HydrophobicContact CE2-CD2 3.77Å; Y425-L456 HydrophobicContact CG-CD1 3.88Å; Y425-L456 HydrophobicContact CG-CD2 4.25Å; V445-L456 HydrophobicContact CB-CD1 4Å; V445-L456 HydrophobicContact CG1-CD1 3.73Å; V445-L456 HydrophobicContact CG2-CD1 4.25Å; R452-L456 WeakPolarHBondContact O-CB 3.45Å; R452-L456 WeakPolarHBondContact O-CD1 3.31Å; R452-L456 WeakPolarHBondContact O-CG 3.29Å; R452-L456 PolarHBondContact O-N 3.24Å; V453-L456 PolarHBondContact O-N 2.83Å; D454-L456 VanDerWaalsContact C-N 3.29Å; D454-L456 PolarHBondContact O-N 3.33Å; L456-R459 CarbonylContact O-C 3.5Å; L456-R459 WeakPolarHBondContact O-CB 3.33Å; L456-R459 PolarHBondContact O-N 2.93Å; L456-R459 VanDerWaalsContact O-N 3.16Å; L456-G460 PolarHBondContact O-N 3.14Å; L456-V461 HydrophobicContact CB-CB 4.18Å; L456-V461 HydrophobicContact CD2-CB 4.09Å; L456-V461 HydrophobicContact CD2-CG1 4.14Å; L456-V461 HydrophobicContact CD2-CG2 4.23Å; L456-V461 WeakPolarHBondContact O-CA 3.3Å; L456-V461 WeakPolarHBondContact O-CB 3.49Å; L456-V461 PolarHBondContact O-N 2.81Å; L456-A463 HydrophobicContact CB-CB 3.85Å; L456-A463 HydrophobicContact CD1-CB 4.01Å
457R88.7Confident85.6Confident78 Ų7858.8 Ų58.829%0.29430%0.297SS..Hα-helixtrans-67-38.4179.2-73.6172.5177.8179.2-1.4111.9E409 V453 D454 R459 G460 A463E409-R457 IonicContact OE2-CZ 2.65Å; E409-R457 IonicContact OE2-NH1 3.8Å; E409-R457 PolarHBondContact OE2-NH1 2.98Å; V453-R457 HydrophobicContact CG1-CG 4.43Å; V453-R457 WeakPolarHBondContact O-CB 3.37Å; V453-R457 VanDerWaalsContact O-CG 3.29Å; V453-R457 WeakPolarHBondContact O-CG 3.47Å; V453-R457 PolarHBondContact O-N 3.01Å; D454-R457 PolarHBondContact O-N 3.44Å; R457-R459 PolarHBondContact O-N 3.17Å; R457-G460 WeakPolarHBondContact O-CA 3.24Å; R457-G460 PolarHBondContact O-N 3.44Å; R457-A463 HydrophobicContact CG-CB 4.29Å; R457-A463 PolarHBondContact NE-O 3.41Å; R457-A463 PolarHBondContact NH2-O 3.22Å
458E86.5Confident85.5Confident169 Ų16958.3 Ų58.379%0.7930%0.295SS*.Hα-helixtrans-59.6-32.7172.3-76.1-176.117400112.2D454 G460D454-E458 WeakPolarHBondContact O-CG 3.29Å; D454-E458 PolarHBondContact O-N 3.19Å; E458-G460 PolarHBondContact O-N 2.76Å
459R88.6Confident85.6Confident127 Ų12757 Ų5748%0.47929%0.292SS..THydrogen-bonded Turntrans-81.22.1174.4-66171.460.6-166.5-0.9113.7E434 E455 L456 R457 V461E434-R459 IonicContact OE1-CZ 3.18Å; E434-R459 IonicContact OE1-NH1 3.93Å; E434-R459 PolarHBondContact OE1-NH1 3.36Å; E434-R459 IonicContact OE1-NH2 3.39Å; E434-R459 PolarHBondContact OE1-NH2 3.38Å; E434-R459 IonicContact OE2-CZ 3.55Å; E434-R459 IonicContact OE2-NH2 3.25Å; E434-R459 PolarHBondContact OE2-NH2 3.4Å; E455-R459 WeakPolarHBondContact O-CD 3.38Å; E455-R459 VanDerWaalsContact O-CG 3.24Å; E455-R459 WeakPolarHBondContact O-CG 3.33Å; E455-R459 PolarHBondContact O-N 3.43Å; L456-R459 CarbonylContact O-C 3.5Å; L456-R459 WeakPolarHBondContact O-CB 3.33Å; L456-R459 PolarHBondContact O-N 2.93Å; L456-R459 VanDerWaalsContact O-N 3.16Å; R457-R459 PolarHBondContact O-N 3.17Å; R459-V461 VanDerWaalsContact C-N 3.3Å; R459-V461 HydrophobicContact CB-CG2 4.34Å
460G87.3Confident85.7Confident63 Ų6358.7 Ų58.765%0.64930%0.298SS*.THydrogen-bonded Turntrans76.812.4-177.500000114.5L456 R457 E458L456-G460 PolarHBondContact O-N 3.14Å; R457-G460 WeakPolarHBondContact O-CA 3.24Å; R457-G460 PolarHBondContact O-N 3.44Å; E458-G460 PolarHBondContact O-N 2.76Å
461V90.6Very high85.9Confident9 Ų959.1 Ų59.16%0.05531%0.305CS..  trans-84.2132.6175.1-174.50000109L437 L443 V445 L456 R459 A463L437-V461 HydrophobicContact CD1-CG2 3.64Å; L437-V461 HydrophobicContact CD2-CG2 4.2Å; L443-V461 HydrophobicContact CD2-CG1 4.22Å; L443-V461 HydrophobicContact CG-CG1 4.5Å; V445-V461 HydrophobicContact CG2-CG1 4.04Å; L456-V461 HydrophobicContact CB-CB 4.18Å; L456-V461 HydrophobicContact CD2-CB 4.09Å; L456-V461 HydrophobicContact CD2-CG1 4.14Å; L456-V461 HydrophobicContact CD2-CG2 4.23Å; L456-V461 WeakPolarHBondContact O-CA 3.3Å; L456-V461 WeakPolarHBondContact O-CB 3.49Å; L456-V461 PolarHBondContact O-N 2.81Å; R459-V461 VanDerWaalsContact C-N 3.3Å; R459-V461 HydrophobicContact CB-CG2 4.34Å; V461-A463 PolarHBondContact O-N 2.8Å
462R92.2Very high86.3Confident105 Ų10560.6 Ų60.640%0.39631%0.305SS..EExtended strand (participates in β ladder)trans-71.5112.6175.9-66.7177.8-178.679.1-2.7108.9V414 D415 I416 V444 V445V414-R462 HydrophobicContact CG1-CB 3.99Å; D415-R462 IonicContact OD1-CZ 3.26Å; D415-R462 IonicContact OD1-NE 3.95Å; D415-R462 PolarHBondContact OD1-NE 3.15Å; D415-R462 IonicContact OD1-NH2 3.31Å; I416-R462 VanDerWaalsContact CG2-CZ 3.47Å; V444-R462 WeakPolarHBondContact CA-O 3.35Å; V444-R462 HydrophobicContact CG2-CB 4.37Å; V445-R462 PolarHBondContact N-O 3.29Å
463A91.8Very high86.5Confident5 Ų557.4 Ų57.44%0.04129%0.294CS..EExtended strand (participates in β ladder)trans-128.1137.8-179.700000111.7V445 V453 L456 R457 V461V445-A463 HydrophobicContact CB-CB 4.35Å; V445-A463 CarbonylContact O-C 3.56Å; V445-A463 VanDerWaalsContact O-CA 3.25Å; V445-A463 WeakPolarHBondContact O-CA 3.32Å; V453-A463 HydrophobicContact CB-CB 4.47Å; V453-A463 HydrophobicContact CG1-CB 3.98Å; V453-A463 HydrophobicContact CG2-CB 4.49Å; L456-A463 HydrophobicContact CB-CB 3.85Å; L456-A463 HydrophobicContact CD1-CB 4.01Å; R457-A463 HydrophobicContact CG-CB 4.29Å; R457-A463 PolarHBondContact NE-O 3.41Å; R457-A463 PolarHBondContact NH2-O 3.22Å; V461-A463 PolarHBondContact O-N 2.8Å
464V90.8Very high86.6Confident2 Ų257.5 Ų57.51%0.01229%0.294CS..EExtended strand (participates in β ladder)trans-112.2125.1178.8-178.30000107.9V414 V444 V445 I446 E447 I473 L476 A477V414-V464 HydrophobicContact CG1-CG2 4.02Å; V444-V464 HydrophobicContact CG1-CG2 4.28Å; V445-V464 PolarHBondContact O-N 3.17Å; I446-V464 WeakPolarHBondContact CA-O 3.46Å; I446-V464 HydrophobicContact CG1-CB 4.19Å; E447-V464 PolarHBondContact N-O 2.95Å; V464-I473 HydrophobicContact CG1-CG2 3.92Å; V464-L476 HydrophobicContact CG1-CB 3.93Å; V464-L476 HydrophobicContact CG1-CD1 4.32Å; V464-A477 HydrophobicContact CG2-CB 4.18Å
465L86Confident87Confident33 Ų3358.9 Ų58.917%0.17330%0.299CS..EExtended strand (participates in β ladder)trans-81.3122.8175.3177.963.9000109.7Q411 E447 T448 R450 V453 I473Q411-L465 PolarHBondContact NE2-O 3.16Å; E447-L465 CarbonylContact O-C 3.54Å; E447-L465 VanDerWaalsContact O-CA 3.3Å; E447-L465 WeakPolarHBondContact O-CA 3.44Å; T448-L465 VanDerWaalsContact O-CD1 3.29Å; T448-L465 WeakPolarHBondContact O-CD1 3.4Å; R450-L465 HydrophobicContact CB-CD1 4.21Å; R450-L465 HydrophobicContact CB-CD2 4.2Å; R450-L465 HydrophobicContact CG-CD2 4.19Å; V453-L465 HydrophobicContact CG1-CB 4.29Å; V453-L465 HydrophobicContact CG2-CB 4.07Å; V453-L465 HydrophobicContact CG2-CD1 4.03Å; L465-I473 WeakPolarHBondContact O-CD1 3.41Å
466G83.6Confident87.1Confident17 Ų1755.5 Ų55.518%0.17528%0.284CS..SBendtrans150.3178.4173.100000113.8I446 E447 T448I446-G466 VanDerWaalsContact CG2-O 3.24Å; I446-G466 WeakPolarHBondContact CG2-O 3.45Å; E447-G466 CarbonylContact C-O 3.51Å; E447-G466 PolarHBondContact O-N 3.38Å; T448-G466 WeakPolarHBondContact CG2-O 3.48Å
467N83.3Confident87.2Confident59 Ų5955.4 Ų55.432%0.31628%0.283SS..  trans-89.4126.1174.8-168.3-31.4000109.9T448 A469 N470 I473 E494T448-N467 HydrophobicContact CG2-CB 4.31Å; N467-A469 PolarHBondContact O-N 3.01Å; N467-A469 VanDerWaalsContact OD1-CB 3.32Å; N467-A469 WeakPolarHBondContact OD1-CB 3.47Å; N467-A469 PolarHBondContact OD1-N 3.45Å; N467-N470 WeakPolarHBondContact O-CB 3.42Å; N467-N470 PolarHBondContact O-N 3.16Å; N467-I473 WeakPolarHBondContact O-CB 3.14Å; N467-E494 PolarHBondContact ND2-OE1 3.35Å; N467-E494 PolarHBondContact OD1-OE1 3.38Å
468A87.8Confident87.3Confident1 Ų154.6 Ų54.61%0.00828%0.283CS..THydrogen-bonded Turntrans-64.6-14.6176.500000114.1V423 I446 N470 M474 I498V423-A468 HydrophobicContact CB-CB 4.29Å; V423-A468 HydrophobicContact CG1-CB 3.47Å; V423-A468 VanDerWaalsContact CG1-CB 3.47Å; V423-A468 HydrophobicContact CG2-CB 3.76Å; I446-A468 HydrophobicContact CD1-CB 4.11Å; I446-A468 HydrophobicContact CG2-CB 4.08Å; A468-N470 PolarHBondContact O-N 3.31Å; A468-M474 HydrophobicContact CB-SD 3.68Å; A468-M474 WeakPolarHBondContact O-CG 3.02Å; A468-M474 VanDerWaalsContact O-SD 3.4Å; A468-I498 HydrophobicContact CB-CD1 3.85Å; A468-I498 HydrophobicContact CB-CG1 4.23Å; A468-I498 HydrophobicContact CB-CG2 4.19Å
469A82.1Confident87.6Confident49 Ų4946.6 Ų46.641%0.40525%0.246SC..THydrogen-bonded Turntrans-69.1-22.3169.500000112.1N467 I498N467-A469 PolarHBondContact O-N 3.01Å; N467-A469 VanDerWaalsContact OD1-CB 3.32Å; N467-A469 WeakPolarHBondContact OD1-CB 3.47Å; N467-A469 PolarHBondContact OD1-N 3.45Å; A469-I498 HydrophobicContact CB-CG1 4.11Å
470N80.9Confident87.8Confident70 Ų7046.7 Ų46.737%0.37425%0.252SS..SBendtrans-78127.5173.8-175.1-14.2000110.2N467 A468 E472 I473 M474N467-N470 WeakPolarHBondContact O-CB 3.42Å; N467-N470 PolarHBondContact O-N 3.16Å; A468-N470 PolarHBondContact O-N 3.31Å; N470-E472 VanDerWaalsContact C-N 3.28Å; N470-E472 PolarHBondContact O-N 2.93Å; N470-E472 PolarHBondContact OD1-N 3.46Å; N470-I473 HydrophobicContact CB-CB 4.38Å; N470-I473 HydrophobicContact CB-CG1 3.92Å; N470-I473 PolarHBondContact O-N 2.95Å; N470-M474 PolarHBondContact O-N 3.38Å
471E83.3Confident88Confident111 Ų11145.5 Ų45.552%0.51923%0.233SC..Hα-helixtrans-58.4-37.7-178.6-163.8172.117600113.5M474 Q475 K505E471-M474 PolarHBondContact O-N 3.1Å; E471-Q475 PolarHBondContact O-N 3.48Å; E471-Q475 VanDerWaalsContact O-N 3.16Å; E471-K505 PolarHBondContact O-NZ 3.33Å; E471-K505 VanDerWaalsContact O-NZ 3.12Å; E471-K505 WeakPolarHBondContact OE1-CE 3.39Å; E471-K505 IonicContact OE1-NZ 2.7Å; E471-K505 PolarHBondContact OE1-NZ 3.42Å
472E83.2Confident88.2Confident123 Ų12345.3 Ų45.358%0.57523%0.232SC*.Hα-helixtrans-70.3-41-178.7-65.3176.6167.400111.6N470 M474 Q475 L476N470-E472 VanDerWaalsContact C-N 3.28Å; N470-E472 PolarHBondContact O-N 2.93Å; N470-E472 PolarHBondContact OD1-N 3.46Å; E472-M474 VanDerWaalsContact C-N 3.29Å; E472-M474 PolarHBondContact O-N 2.9Å; E472-Q475 WeakPolarHBondContact O-CB 3.4Å; E472-Q475 PolarHBondContact O-N 3.43Å; E472-Q475 VanDerWaalsContact O-N 3.11Å; E472-L476 WeakPolarHBondContact O-CG 3.13Å; E472-L476 PolarHBondContact O-N 3.29Å
473I86.8Confident88.3Confident10 Ų1045.4 Ų45.45%0.05124%0.235CC..Hα-helixtrans-62.1-40.3176.2-60.8-56.2000110.7I446 V464 L465 N467 N470 Q475 L476 A477I446-I473 HydrophobicContact CD1-CG2 4.22Å; I446-I473 HydrophobicContact CG1-CG2 4.24Å; I446-I473 HydrophobicContact CG2-CG2 3.73Å; V464-I473 HydrophobicContact CG1-CG2 3.92Å; L465-I473 WeakPolarHBondContact O-CD1 3.41Å; N467-I473 WeakPolarHBondContact O-CB 3.14Å; N470-I473 HydrophobicContact CB-CB 4.38Å; N470-I473 HydrophobicContact CB-CG1 3.92Å; N470-I473 PolarHBondContact O-N 2.95Å; I473-Q475 VanDerWaalsContact C-N 3.31Å; I473-Q475 PolarHBondContact O-N 2.85Å; I473-L476 HydrophobicContact CD1-CD1 4.17Å; I473-L476 PolarHBondContact O-N 3.02Å; I473-A477 PolarHBondContact O-N 3.34Å; I473-A477 VanDerWaalsContact O-N 3.08Å
474M88.2Confident88.6Confident1 Ų148.7 Ų48.71%0.00525%0.247CC..Hα-helixtrans-67-32.3176.3-66.7-63.8-76.100112.6L421 I446 A468 N470 E471 E472 A477 H478 L479 L485 I498 A502L421-M474 HydrophobicContact CD2-CE 4.03Å; L421-M474 HydrophobicContact CD2-SD 4.35Å; I446-M474 HydrophobicContact CD1-SD 3.53Å; I446-M474 VanDerWaalsContact CD1-SD 3.53Å; A468-M474 HydrophobicContact CB-SD 3.68Å; A468-M474 WeakPolarHBondContact O-CG 3.02Å; A468-M474 VanDerWaalsContact O-SD 3.4Å; N470-M474 PolarHBondContact O-N 3.38Å; E471-M474 PolarHBondContact O-N 3.1Å; E472-M474 VanDerWaalsContact C-N 3.29Å; E472-M474 PolarHBondContact O-N 2.9Å; M474-A477 PolarHBondContact O-N 3.34Å; M474-H478 PolarHBondContact O-N 2.66Å; M474-L479 HydrophobicContact CB-CB 4.39Å; M474-L479 HydrophobicContact CB-CD2 4.26Å; M474-L479 HydrophobicContact CE-CB 4.19Å; M474-L479 HydrophobicContact CE-CD1 3.58Å; M474-L479 HydrophobicContact CE-CD2 3.42Å; M474-L479 VanDerWaalsContact CE-CD2 3.42Å; M474-L479 HydrophobicContact CE-CG 3.88Å; M474-L479 WeakPolarHBondContact O-CB 3.37Å; M474-L479 PolarHBondContact O-N 3.33Å; M474-L479 VanDerWaalsContact O-N 3.14Å; M474-L485 HydrophobicContact CE-CD1 4.28Å; M474-L485 HydrophobicContact CE-CD2 4.41Å; M474-I498 HydrophobicContact CE-CG2 4.35Å; M474-A502 HydrophobicContact CE-CB 4.33Å
475Q88.5Confident88.9Confident92 Ų9248.6 Ų48.643%0.4325%0.246SC..Hα-helixtrans-69.6-44.2172.4-75.1173.5-4.500111.4E471 E472 I473 A477 H478E471-Q475 PolarHBondContact O-N 3.48Å; E471-Q475 VanDerWaalsContact O-N 3.16Å; E472-Q475 WeakPolarHBondContact O-CB 3.4Å; E472-Q475 PolarHBondContact O-N 3.43Å; E472-Q475 VanDerWaalsContact O-N 3.11Å; I473-Q475 VanDerWaalsContact C-N 3.31Å; I473-Q475 PolarHBondContact O-N 2.85Å; Q475-A477 PolarHBondContact O-N 3.05Å; Q475-H478 WeakPolarHBondContact O-CA 3.3Å; Q475-H478 PolarHBondContact O-CD2 3.27Å; Q475-H478 PolarHBondContact O-N 3.25Å
476L89.2Confident89.4Confident39 Ų3947.9 Ų47.920%0.20424%0.242CC..Hα-helixtrans-57.4-31.2174.8-71.5173.1000112.6Q411 P413 V414 V464 E472 I473 H478Q411-L476 HydrophobicContact CB-CD1 3.94Å; Q411-L476 HydrophobicContact CB-CD2 4.41Å; Q411-L476 WeakPolarHBondContact O-CD2 3.24Å; P413-L476 WeakPolarHBondContact CA-O 3.18Å; P413-L476 HydrophobicContact CB-CD2 4.41Å; P413-L476 HydrophobicContact CG-CD2 3.94Å; V414-L476 WeakPolarHBondContact CG2-O 3.43Å; V414-L476 PolarHBondContact N-O 3.46Å; V464-L476 HydrophobicContact CG1-CB 3.93Å; V464-L476 HydrophobicContact CG1-CD1 4.32Å; E472-L476 WeakPolarHBondContact O-CG 3.13Å; E472-L476 PolarHBondContact O-N 3.29Å; I473-L476 HydrophobicContact CD1-CD1 4.17Å; I473-L476 PolarHBondContact O-N 3.02Å; L476-H478 VanDerWaalsContact C-N 3.31Å
477A91.3Very high90.1Very high0 Ų047.1 Ų47.10%023%0.234CC..THydrogen-bonded Turntrans-86.14.8176.400000114.6V414 H419 L421 V444 I446 V464 I473 M474 Q475 L479V414-A477 VanDerWaalsContact CG2-C 3.41Å; V414-A477 WeakPolarHBondContact CG2-O 3.38Å; H419-A477 PolarHBondContact NE2-O 3.02Å; L421-A477 HydrophobicContact CD1-CB 3.65Å; L421-A477 HydrophobicContact CD2-CB 4.03Å; V444-A477 HydrophobicContact CG1-CB 4.03Å; I446-A477 HydrophobicContact CD1-CB 3.67Å; I446-A477 HydrophobicContact CG1-CB 3.86Å; V464-A477 HydrophobicContact CG2-CB 4.18Å; I473-A477 PolarHBondContact O-N 3.34Å; I473-A477 VanDerWaalsContact O-N 3.08Å; M474-A477 PolarHBondContact O-N 3.34Å; Q475-A477 PolarHBondContact O-N 3.05Å; A477-L479 PolarHBondContact O-N 3.03Å
478H91.4Very high90.7Very high62 Ų6244.8 Ų44.829%0.28722%0.222SC..THydrogen-bonded Turntrans5346.1-179.7-82.5-158.6000113.5V414 I416 H419 M474 Q475 L476 E480 C481 A482V414-H478 HydrophobicContact CG2-CB 3.89Å; V414-H478 PolarHBondContact O-CD2 2.67Å; V414-H478 PolarHBondContact O-CE1 3.16Å; V414-H478 PolarHBondContact O-ND1 2.88Å; V414-H478 PolarHBondContact O-NE2 2.95Å; I416-H478 PolarHBondContact O-ND1 3.16Å; H419-H478 PolarHBondContact CE1-O 2.79Å; M474-H478 PolarHBondContact O-N 2.66Å; Q475-H478 WeakPolarHBondContact O-CA 3.3Å; Q475-H478 PolarHBondContact O-CD2 3.27Å; Q475-H478 PolarHBondContact O-N 3.25Å; L476-H478 VanDerWaalsContact C-N 3.31Å; H478-E480 PolarHBondContact O-N 3.21Å; H478-E480 VanDerWaalsContact O-N 3.13Å; H478-C481 PolarHBondContact O-N 3.14Å; H478-A482 PolarHBondContact O-N 2.83Å
479L92.7Very high90.9Very high1 Ų145.9 Ų45.91%0.00523%0.227CC..G310 helixtrans-52.1-35.7177.5176.668.7000113.2L421 M474 A477 C481 A482 L485 A502 K505 N506 I509L421-L479 HydrophobicContact CD2-CB 4.27Å; L421-L479 HydrophobicContact CD2-CD1 3.87Å; M474-L479 HydrophobicContact CB-CB 4.39Å; M474-L479 HydrophobicContact CB-CD2 4.26Å; M474-L479 HydrophobicContact CE-CB 4.19Å; M474-L479 HydrophobicContact CE-CD1 3.58Å; M474-L479 HydrophobicContact CE-CD2 3.42Å; M474-L479 VanDerWaalsContact CE-CD2 3.42Å; M474-L479 HydrophobicContact CE-CG 3.88Å; M474-L479 WeakPolarHBondContact O-CB 3.37Å; M474-L479 PolarHBondContact O-N 3.33Å; M474-L479 VanDerWaalsContact O-N 3.14Å; A477-L479 PolarHBondContact O-N 3.03Å; L479-C481 PolarHBondContact O-N 3.44Å; L479-C481 VanDerWaalsContact O-N 3.16Å; L479-A482 PolarHBondContact O-N 2.91Å; L479-A482 VanDerWaalsContact O-N 3.14Å; L479-L485 HydrophobicContact CD1-CD2 4.4Å; L479-A502 HydrophobicContact CD1-CB 4.19Å; L479-A502 HydrophobicContact CD2-CB 3.8Å; L479-K505 HydrophobicContact CD2-CB 4.22Å; L479-K505 HydrophobicContact CD2-CD 4.04Å; L479-N506 PolarHBondContact O-ND2 3.09Å; L479-I509 HydrophobicContact CD1-CD1 3.46Å; L479-I509 VanDerWaalsContact CD1-CD1 3.46Å
480E92Very high90.9Very high129 Ų12948 Ų4860%0.60324%0.237SC*.G310 helixtrans-58.8-27.9-176.3-61177.7-169.700113.4H478 N506H478-E480 PolarHBondContact O-N 3.21Å; H478-E480 VanDerWaalsContact O-N 3.13Å; E480-N506 PolarHBondContact O-ND2 3.18Å
481C91.9Very high91.1Very high38 Ų3847.9 Ų47.926%0.25724%0.236SC..G310 helixtrans-118.910.6177.470.80000113.5I416 C417 N418 H478 L479I416-C481 PolarHBondContact O-SG 3.08Å; C417-C481 WeakPolarHBondContact CA-SG 3.46Å; C417-C481 HydrophobicContact CB-CB 3.59Å; C417-C481 WeakPolarHBondContact CB-SG 3.45Å; C417-C481 WeakPolarHBondContact SG-CB 3.26Å; C417-C481 CovalentContact SG-SG 2.04Å; C417-C481 PolarHBondContact SG-SG 3.23Å; N418-C481 PolarHBondContact N-O 2.96Å; H478-C481 PolarHBondContact O-N 3.14Å; L479-C481 PolarHBondContact O-N 3.44Å; L479-C481 VanDerWaalsContact O-N 3.16Å
482A94.8Very high91.1Very high4 Ų442.6 Ų42.63%0.03321%0.212CC..  trans-70.1143.5171.500000110.2L421 H478 L479 N506 I509L421-A482 HydrophobicContact CB-CB 4.22Å; H478-A482 PolarHBondContact O-N 2.83Å; L479-A482 PolarHBondContact O-N 2.91Å; L479-A482 VanDerWaalsContact O-N 3.14Å; A482-N506 PolarHBondContact O-ND2 3.02Å; A482-I509 HydrophobicContact CB-CD1 3.92Å
483K94.9Very high91.1Very high107 Ų10741.8 Ų41.847%0.46521%0.205SC..SBendtrans-90.7-36.2178.9-177.1173173.7-171.10112.1H419 E510H419-K483 PolarHBondContact O-N 3.03Å; K483-E510 PolarHBondContact O-N 3.33Å
484W97.1Very high91Very high75 Ų7544.1 Ų44.128%0.28422%0.215SC..EExtended strand (participates in β ladder)trans-129137.9178-60.2-80.6000110.1H419 A420 L421 I441 I486 E510H419-W484 PolarHBondContact O-N 2.97Å; A420-W484 HydrophobicContact CB-CB 4.45Å; A420-W484 HydrophobicContact CB-CE3 4.27Å; L421-W484 PolarHBondContact N-O 3.28Å; I441-W484 HydrophobicContact CG2-CZ3 4.1Å; W484-I486 HydrophobicContact CB-CG1 4.3Å; W484-E510 CarbonylContact C-O 3.57Å; W484-E510 WeakPolarHBondContact CA-O 3.45Å
485L97.5Very high91.1Very high0 Ų044 Ų440%022%0.215CC..EExtended strand (participates in β ladder)trans-110.9120164.2174.763.4000108.4L421 V423 M474 L479 L487 I498 A502 I509 E510 I511 I512L421-L485 HydrophobicContact CB-CD1 4.23Å; L421-L485 HydrophobicContact CD2-CD1 3.99Å; L421-L485 HydrophobicContact CG-CD1 3.93Å; L421-L485 WeakPolarHBondContact O-CA 3.29Å; V423-L485 HydrophobicContact CG2-CD1 3.81Å; M474-L485 HydrophobicContact CE-CD1 4.28Å; M474-L485 HydrophobicContact CE-CD2 4.41Å; L479-L485 HydrophobicContact CD1-CD2 4.4Å; L485-L487 HydrophobicContact CD1-CD2 3.78Å; L485-L487 HydrophobicContact CD2-CD2 4.2Å; L485-L487 HydrophobicContact CG-CD2 3.87Å; L485-L487 HydrophobicContact CG-CG 4.26Å; L485-I498 HydrophobicContact CD2-CG2 4.39Å; L485-A502 HydrophobicContact CD2-CB 3.38Å; L485-I509 HydrophobicContact CB-CD1 3.66Å; L485-I509 HydrophobicContact CB-CG1 4.23Å; L485-E510 PolarHBondContact N-O 2.96Å; L485-I511 HydrophobicContact CB-CG1 4.27Å; L485-I511 HydrophobicContact CD2-CD1 4.43Å; L485-I511 HydrophobicContact CD2-CG1 4.34Å; L485-I511 HydrophobicContact CD2-CG2 4.29Å; L485-I511 HydrophobicContact CG-CG2 4.49Å; L485-I511 WeakPolarHBondContact O-CA 3.35Å; L485-I512 PolarHBondContact O-N 3.16Å
486I97.7Very high91.2Very high18 Ų1839.7 Ų39.79%0.09219%0.194CC..EExtended strand (participates in β ladder)trans-118.6110.3-176.7-49.3170.5000109.2A420 L421 L422 V423 L432 L436 W484 T488 I512A420-I486 HydrophobicContact CB-CD1 4.37Å; L421-I486 PolarHBondContact O-N 3.04Å; L422-I486 HydrophobicContact CD1-CB 4.1Å; L422-I486 HydrophobicContact CD1-CG2 4.12Å; V423-I486 PolarHBondContact N-O 3.19Å; L432-I486 HydrophobicContact CD2-CB 4.32Å; L432-I486 HydrophobicContact CD2-CD1 3.95Å; L432-I486 HydrophobicContact CD2-CG2 3.46Å; L432-I486 VanDerWaalsContact CD2-CG2 3.46Å; L436-I486 HydrophobicContact CD1-CD1 4.1Å; W484-I486 HydrophobicContact CB-CG1 4.3Å; I486-T488 HydrophobicContact CG2-CG2 4.04Å; I486-I512 CarbonylContact C-O 3.58Å; I486-I512 VanDerWaalsContact CA-O 3.32Å; I486-I512 WeakPolarHBondContact CA-O 3.19Å
487L97.4Very high91.2Very high1 Ų142 Ų421%0.00520%0.204CC..EExtended strand (participates in β ladder)trans-97.9111.6-178.5-53.7-177.9000109.5V423 L485 A495 I498 V499 I512 A513 R514V423-L487 HydrophobicContact CB-CD2 3.57Å; V423-L487 HydrophobicContact CG1-CD2 4.25Å; V423-L487 HydrophobicContact CG2-CD2 3.48Å; V423-L487 VanDerWaalsContact CG2-CD2 3.48Å; L485-L487 HydrophobicContact CD1-CD2 3.78Å; L485-L487 HydrophobicContact CD2-CD2 4.2Å; L485-L487 HydrophobicContact CG-CD2 3.87Å; L485-L487 HydrophobicContact CG-CG 4.26Å; L487-A495 HydrophobicContact CB-CB 4.43Å; L487-A495 HydrophobicContact CD1-CB 3.9Å; L487-A495 WeakPolarHBondContact CD1-O 3.32Å; L487-I498 HydrophobicContact CD1-CB 4.2Å; L487-I498 HydrophobicContact CD1-CG2 4.15Å; L487-I498 HydrophobicContact CD2-CG2 3.78Å; L487-V499 HydrophobicContact CD1-CG2 3.46Å; L487-V499 VanDerWaalsContact CD1-CG2 3.46Å; L487-I512 PolarHBondContact N-O 3.11Å; L487-A513 HydrophobicContact CB-CB 4.14Å; L487-A513 HydrophobicContact CD1-CB 4.3Å; L487-R514 WeakPolarHBondContact O-CB 3.4Å; L487-R514 PolarHBondContact O-N 2.77Å
488T96Very high91.3Very high10 Ų1042 Ų426%0.06120%0.204CC..  trans-112.67.917974.80000113.9L422 V423 G424 V428 G429 L432 I486L422-T488 HydrophobicContact CD1-CG2 3.59Å; V423-T488 PolarHBondContact O-N 3.49Å; V423-T488 PolarHBondContact O-OG1 3.27Å; G424-T488 PolarHBondContact O-OG1 2.94Å; V428-T488 HydrophobicContact CG1-CG2 4.08Å; G429-T488 WeakPolarHBondContact CA-OG1 3.4Å; G429-T488 PolarHBondContact N-OG1 2.82Å; L432-T488 HydrophobicContact CD2-CG2 4.37Å; I486-T488 HydrophobicContact CG2-CG2 4.04Å
489I91.8Very high91.5Very high23 Ų2339.1 Ų39.112%0.11819%0.191CC..  trans-62.9149.4174.961.7174.5000111.2V423 E494 A495 I498V423-I489 HydrophobicContact CG1-CG2 3.94Å; I489-E494 HydrophobicContact CD1-CB 4.26Å; I489-E494 HydrophobicContact CD1-CG 4.01Å; I489-A495 HydrophobicContact CD1-CB 4.05Å; I489-A495 HydrophobicContact CG1-CB 4.11Å; I489-I498 HydrophobicContact CD1-CD1 3.69Å
490P81.9Confident91.5Very high93 Ų9340.3 Ų40.360%0.60420%0.201SC*.SBendtrans-78.4-19.5-175.130.7-35.4000114.2
491N85.8Confident91.5Very high68 Ų6836 Ų3636%0.36419%0.185SC..  trans-90.1104.2-177.2-178-10.7000110.2Y493 E494 A495N491-Y493 VanDerWaalsContact C-N 3.32Å; N491-Y493 PolarHBondContact O-N 2.84Å; N491-Y493 PolarHBondContact OD1-N 2.87Å; N491-E494 HydrophobicContact CB-CB 3.95Å; N491-E494 PolarHBondContact O-N 3.48Å; N491-E494 PolarHBondContact OD1-N 2.88Å; N491-A495 PolarHBondContact O-N 3.46Å
492G83Confident91.6Very high1 Ų134.1 Ų34.11%0.0117%0.172CC..Hα-helixtrans-66.4-30.6-177.200000114.1A495 G496 E520 I524G492-A495 WeakPolarHBondContact O-CB 3.49Å; G492-A495 PolarHBondContact O-N 3.03Å; G492-G496 PolarHBondContact O-N 2.96Å; G492-E520 PolarHBondContact N-OE1 2.84Å; G492-E520 VanDerWaalsContact N-OE1 3.17Å; G492-I524 WeakPolarHBondContact O-CD1 3.38Å; G492-I524 WeakPolarHBondContact O-CG1 3.26Å
493Y83Confident91.6Very high106 Ų10636.8 Ų36.842%0.41618%0.182SC..Hα-helixtrans-72.2-42.2177.7-62.9-72.7000112.1N491 A495 G496 E497 D519 E520 Y523N491-Y493 VanDerWaalsContact C-N 3.32Å; N491-Y493 PolarHBondContact O-N 2.84Å; N491-Y493 PolarHBondContact OD1-N 2.87Å; Y493-A495 VanDerWaalsContact C-N 3.29Å; Y493-A495 PolarHBondContact O-N 3.24Å; Y493-G496 PolarHBondContact O-N 3.17Å; Y493-E497 PolarHBondContact O-N 3.01Å; Y493-E497 VanDerWaalsContact O-N 3.11Å; Y493-D519 PolarHBondContact OH-OD2 3.2Å; Y493-E520 HydrophobicContact CE2-CG 4.44Å; Y493-Y523 AromaticContact CD1-CD1 3.76Å; Y493-Y523 HydrophobicContact CD1-CD1 3.76Å; Y493-Y523 HydrophobicContact CD1-CD2 4.2Å; Y493-Y523 AromaticContact CD1-CE1 3.92Å; Y493-Y523 HydrophobicContact CD1-CE1 3.92Å; Y493-Y523 HydrophobicContact CD1-CE2 4.33Å; Y493-Y523 AromaticContact CD1-CG 3.89Å; Y493-Y523 HydrophobicContact CD1-CG 3.89Å; Y493-Y523 HydrophobicContact CE1-CD1 4.47Å; Y493-Y523 HydrophobicContact CE1-CD2 4.44Å; Y493-Y523 HydrophobicContact CE1-CG 4.21Å; Y493-Y523 WeakPolarHBondContact O-CE1 3.36Å
494E85.6Confident91.4Very high58 Ų5835.7 Ų35.727%0.27119%0.192SC..Hα-helixtrans-61.3-41.4172.1-178.2175.9-167.500110.9N467 I489 N491 G496 E497 I498N467-E494 PolarHBondContact ND2-OE1 3.35Å; N467-E494 PolarHBondContact OD1-OE1 3.38Å; I489-E494 HydrophobicContact CD1-CB 4.26Å; I489-E494 HydrophobicContact CD1-CG 4.01Å; N491-E494 HydrophobicContact CB-CB 3.95Å; N491-E494 PolarHBondContact O-N 3.48Å; N491-E494 PolarHBondContact OD1-N 2.88Å; E494-G496 VanDerWaalsContact C-N 3.31Å; E494-G496 PolarHBondContact O-N 3.43Å; E494-E497 PolarHBondContact O-N 3.43Å; E494-I498 HydrophobicContact CG-CD1 4.15Å; E494-I498 WeakPolarHBondContact O-CG1 3.47Å; E494-I498 PolarHBondContact O-N 3.02Å
495A90.6Very high91.1Very high0 Ų034.4 Ų34.40%019%0.189CC..Hα-helixtrans-57.3-44.9173.600000111.3L487 I489 N491 G492 Y493 E497 I498 V499 I524L487-A495 HydrophobicContact CB-CB 4.43Å; L487-A495 HydrophobicContact CD1-CB 3.9Å; L487-A495 WeakPolarHBondContact CD1-O 3.32Å; I489-A495 HydrophobicContact CD1-CB 4.05Å; I489-A495 HydrophobicContact CG1-CB 4.11Å; N491-A495 PolarHBondContact O-N 3.46Å; G492-A495 WeakPolarHBondContact O-CB 3.49Å; G492-A495 PolarHBondContact O-N 3.03Å; Y493-A495 VanDerWaalsContact C-N 3.29Å; Y493-A495 PolarHBondContact O-N 3.24Å; A495-E497 PolarHBondContact O-N 3.39Å; A495-I498 WeakPolarHBondContact O-CB 3.35Å; A495-I498 PolarHBondContact O-N 2.95Å; A495-V499 VanDerWaalsContact O-CG2 3.23Å; A495-V499 WeakPolarHBondContact O-CG2 3.44Å; A495-V499 PolarHBondContact O-N 2.8Å; A495-I524 HydrophobicContact CB-CD1 4.25Å; A495-I524 HydrophobicContact CB-CG1 4.46Å
496G89.4Confident90.9Very high0 Ų035.2 Ų35.20%019%0.193CC..Hα-helixtrans-62.7-36.7178.100000114G492 Y493 E494 V499 A500 R527G492-G496 PolarHBondContact O-N 2.96Å; Y493-G496 PolarHBondContact O-N 3.17Å; E494-G496 VanDerWaalsContact C-N 3.31Å; E494-G496 PolarHBondContact O-N 3.43Å; G496-V499 PolarHBondContact O-N 3.4Å; G496-A500 PolarHBondContact O-N 2.88Å; G496-R527 VanDerWaalsContact O-CB 3.3Å; G496-R527 WeakPolarHBondContact O-CB 3.22Å; G496-R527 WeakPolarHBondContact O-CG 3.38Å
497E90.4Very high90.7Very high88 Ų8838.4 Ų38.441%0.41122%0.215SC..Hα-helixtrans-68.1-39.2173.3-66.2-61.3161.100111.9Y493 E494 A495 V499 A500 S501 Y523 R527Y493-E497 PolarHBondContact O-N 3.01Å; Y493-E497 VanDerWaalsContact O-N 3.11Å; E494-E497 PolarHBondContact O-N 3.43Å; A495-E497 PolarHBondContact O-N 3.39Å; E497-V499 VanDerWaalsContact C-N 3.33Å; E497-V499 PolarHBondContact O-N 3.11Å; E497-A500 PolarHBondContact O-N 3.32Å; E497-S501 PolarHBondContact O-N 3.3Å; E497-Y523 PolarHBondContact OE1-OH 3.03Å; E497-R527 VanDerWaalsContact CD-NH1 3.27Å; E497-R527 IonicContact OE1-CZ 3.98Å; E497-R527 VanDerWaalsContact OE1-CZ 3.23Å; E497-R527 IonicContact OE1-NH1 2.88Å; E497-R527 PolarHBondContact OE1-NH1 2.72Å; E497-R527 VanDerWaalsContact OE1-NH1 3.16Å; E497-R527 IonicContact OE1-NH2 3.13Å; E497-R527 PolarHBondContact OE1-NH2 2.69Å; E497-R527 IonicContact OE2-CZ 2.69Å; E497-R527 IonicContact OE2-NH1 3.28Å; E497-R527 PolarHBondContact OE2-NH1 2.88Å; E497-R527 IonicContact OE2-NH2 3.16Å
498I93.2Very high90.4Very high1 Ų145.7 Ų45.71%0.00525%0.254CS..Hα-helixtrans-61.5-43.3172.7-64.1161.9000110.5A468 A469 M474 L485 L487 I489 E494 A495 A500 S501 A502A468-I498 HydrophobicContact CB-CD1 3.85Å; A468-I498 HydrophobicContact CB-CG1 4.23Å; A468-I498 HydrophobicContact CB-CG2 4.19Å; A469-I498 HydrophobicContact CB-CG1 4.11Å; M474-I498 HydrophobicContact CE-CG2 4.35Å; L485-I498 HydrophobicContact CD2-CG2 4.39Å; L487-I498 HydrophobicContact CD1-CB 4.2Å; L487-I498 HydrophobicContact CD1-CG2 4.15Å; L487-I498 HydrophobicContact CD2-CG2 3.78Å; I489-I498 HydrophobicContact CD1-CD1 3.69Å; E494-I498 HydrophobicContact CG-CD1 4.15Å; E494-I498 WeakPolarHBondContact O-CG1 3.47Å; E494-I498 PolarHBondContact O-N 3.02Å; A495-I498 WeakPolarHBondContact O-CB 3.35Å; A495-I498 PolarHBondContact O-N 2.95Å; I498-A500 PolarHBondContact O-N 3.46Å; I498-S501 PolarHBondContact O-N 3.26Å; I498-A502 VanDerWaalsContact O-CB 3.22Å; I498-A502 WeakPolarHBondContact O-CB 3.38Å; I498-A502 PolarHBondContact O-N 3.35Å
499V96Very high90.4Very high0 Ų045.3 Ų45.30%025%0.252CS..Hα-helixtrans-58.3-47.4176.2170.70000110.9L487 A495 G496 E497 S501 A502 R503 I511 I524 R527 A529L487-V499 HydrophobicContact CD1-CG2 3.46Å; L487-V499 VanDerWaalsContact CD1-CG2 3.46Å; A495-V499 VanDerWaalsContact O-CG2 3.23Å; A495-V499 WeakPolarHBondContact O-CG2 3.44Å; A495-V499 PolarHBondContact O-N 2.8Å; G496-V499 PolarHBondContact O-N 3.4Å; E497-V499 VanDerWaalsContact C-N 3.33Å; E497-V499 PolarHBondContact O-N 3.11Å; V499-S501 PolarHBondContact O-N 2.92Å; V499-A502 PolarHBondContact O-N 2.63Å; V499-R503 WeakPolarHBondContact O-CB 3.23Å; V499-R503 PolarHBondContact O-N 3.13Å; V499-I511 HydrophobicContact CB-CG2 4.49Å; V499-I511 HydrophobicContact CG1-CD1 3.93Å; V499-I511 HydrophobicContact CG1-CG2 4.3Å; V499-I511 HydrophobicContact CG2-CG2 3.64Å; V499-I524 HydrophobicContact CG2-CG2 3.98Å; V499-R527 HydrophobicContact CB-CB 4.36Å; V499-R527 HydrophobicContact CG1-CB 4.14Å; V499-A529 HydrophobicContact CG1-CB 4.02Å; V499-A529 VanDerWaalsContact CG1-N 3.31Å; V499-A529 HydrophobicContact CG2-CB 4.27Å
500A92.6Very high90.6Very high27 Ų2747.4 Ų47.422%0.22326%0.261CS..Hα-helixtrans-60.5-46.7179.700000111.8G496 E497 I498 A504 R527G496-A500 PolarHBondContact O-N 2.88Å; E497-A500 PolarHBondContact O-N 3.32Å; I498-A500 PolarHBondContact O-N 3.46Å; A500-A504 PolarHBondContact O-N 3.38Å; A500-A504 VanDerWaalsContact O-N 3.17Å; A500-R527 HydrophobicContact CB-CB 4.24Å; A500-R527 HydrophobicContact CB-CG 4.45Å
501S91.5Very high91.4Very high37 Ų3743 Ų4326%0.25923%0.232SC..Hα-helixtrans-63.8-43.5177.2-176.30000112E497 I498 V499 A504 K505E497-S501 PolarHBondContact O-N 3.3Å; I498-S501 PolarHBondContact O-N 3.26Å; V499-S501 PolarHBondContact O-N 2.92Å; S501-A504 PolarHBondContact O-N 2.94Å; S501-K505 PolarHBondContact O-N 3.5Å
502A94.8Very high91.9Very high0 Ų042.3 Ų42.30%023%0.228CC..Hα-helixtrans-64.8-45179.800000112.7M474 L479 L485 I498 V499 A504 K505 N506 I511M474-A502 HydrophobicContact CE-CB 4.33Å; L479-A502 HydrophobicContact CD1-CB 4.19Å; L479-A502 HydrophobicContact CD2-CB 3.8Å; L485-A502 HydrophobicContact CD2-CB 3.38Å; I498-A502 VanDerWaalsContact O-CB 3.22Å; I498-A502 WeakPolarHBondContact O-CB 3.38Å; I498-A502 PolarHBondContact O-N 3.35Å; V499-A502 PolarHBondContact O-N 2.63Å; A502-A504 VanDerWaalsContact C-N 3.29Å; A502-A504 PolarHBondContact O-N 2.83Å; A502-K505 PolarHBondContact O-N 2.97Å; A502-N506 PolarHBondContact O-N 3.4Å; A502-I511 HydrophobicContact CB-CD1 4.32Å
503R93.7Very high92.6Very high59 Ų5942.3 Ų42.322%0.22323%0.228CC..Hα-helixtrans-63.8-34.6178.2-176.966.173.3-156.8-4.4112V499 K505 P507 I509 I511 G528 N530V499-R503 WeakPolarHBondContact O-CB 3.23Å; V499-R503 PolarHBondContact O-N 3.13Å; R503-K505 VanDerWaalsContact C-N 3.3Å; R503-K505 PolarHBondContact O-N 3.37Å; R503-P507 PolarHBondContact NH1-O 2.9Å; R503-P507 WeakPolarHBondContact O-CA 3.32Å; R503-I509 PolarHBondContact NH1-O 3.18Å; R503-I511 HydrophobicContact CB-CD1 4.37Å; R503-G528 PolarHBondContact NE-O 3.05Å; R503-G528 VanDerWaalsContact NE-O 3.14Å; R503-G528 PolarHBondContact NH2-O 3.26Å; R503-N530 PolarHBondContact NH2-OD1 3.28Å
504A91.6Very high93.2Very high84 Ų8439.7 Ų39.769%0.69422%0.217SC*.Hα-helixtrans-65.4-33.2176.300000112.7A500 S501 A502A500-A504 PolarHBondContact O-N 3.38Å; A500-A504 VanDerWaalsContact O-N 3.17Å; S501-A504 PolarHBondContact O-N 2.94Å; A502-A504 VanDerWaalsContact C-N 3.29Å; A502-A504 PolarHBondContact O-N 2.83Å
505K90.7Very high93.5Very high49 Ų4936.9 Ų36.921%0.21320%0.204CC..Hα-helixtrans-88.7-41.3-179.1-71.2-178.9167.2-161.70114.2E471 L479 S501 A502 R503E471-K505 PolarHBondContact O-NZ 3.33Å; E471-K505 VanDerWaalsContact O-NZ 3.12Å; E471-K505 WeakPolarHBondContact OE1-CE 3.39Å; E471-K505 IonicContact OE1-NZ 2.7Å; E471-K505 PolarHBondContact OE1-NZ 3.42Å; L479-K505 HydrophobicContact CD2-CB 4.22Å; L479-K505 HydrophobicContact CD2-CD 4.04Å; S501-K505 PolarHBondContact O-N 3.5Å; A502-K505 PolarHBondContact O-N 2.97Å; R503-K505 VanDerWaalsContact C-N 3.3Å; R503-K505 PolarHBondContact O-N 3.37Å
506N93.2Very high93.3Very high17 Ų1738.6 Ų38.69%0.09121%0.212CC..  trans-127.489.7179.3-173.5-12.1000108.6L479 E480 A482 A502 D508 I509L479-N506 PolarHBondContact O-ND2 3.09Å; E480-N506 PolarHBondContact O-ND2 3.18Å; A482-N506 PolarHBondContact O-ND2 3.02Å; A502-N506 PolarHBondContact O-N 3.4Å; N506-D508 PolarHBondContact O-N 3.39Å; N506-D508 PolarHBondContact OD1-N 2.96Å; N506-I509 HydrophobicContact CB-CB 4.13Å; N506-I509 HydrophobicContact CB-CG2 4.22Å; N506-I509 WeakPolarHBondContact O-CG2 3.47Å; N506-I509 PolarHBondContact O-N 3.5Å; N506-I509 PolarHBondContact OD1-N 3.08Å
507P91.9Very high93.1Very high84 Ų8445.9 Ų45.955%0.54524%0.241SC..THydrogen-bonded Turntrans-59.8-28.6-177.3-2736.4000113.9R503R503-P507 PolarHBondContact NH1-O 2.9Å; R503-P507 WeakPolarHBondContact O-CA 3.32Å
508D92.1Very high92.9Very high155 Ų15546.4 Ų46.483%0.82925%0.247SC*.THydrogen-bonded Turntrans-93.6-2.5-172.4-64.7-35.2000113.8N506N506-D508 PolarHBondContact O-N 3.39Å; N506-D508 PolarHBondContact OD1-N 2.96Å
509I95.4Very high92.5Very high2 Ų250.4 Ų50.41%0.0127%0.268CS..  trans-67.3138.6-178.2-163.6168.5000112.1L479 A482 L485 R503 N506 I511 N530L479-I509 HydrophobicContact CD1-CD1 3.46Å; L479-I509 VanDerWaalsContact CD1-CD1 3.46Å; A482-I509 HydrophobicContact CB-CD1 3.92Å; L485-I509 HydrophobicContact CB-CD1 3.66Å; L485-I509 HydrophobicContact CB-CG1 4.23Å; R503-I509 PolarHBondContact NH1-O 3.18Å; N506-I509 HydrophobicContact CB-CB 4.13Å; N506-I509 HydrophobicContact CB-CG2 4.22Å; N506-I509 WeakPolarHBondContact O-CG2 3.47Å; N506-I509 PolarHBondContact O-N 3.5Å; N506-I509 PolarHBondContact OD1-N 3.08Å; I509-I511 HydrophobicContact CG2-CD1 3.92Å; I509-I511 HydrophobicContact CG2-CG1 3.68Å; I509-N530 PolarHBondContact O-OD1 3.08Å
510E97.1Very high92.2Very high66 Ų6651 Ų5131%0.30827%0.27SS..EExtended strand (participates in β ladder)trans-84.5115.8172.5-176.570.4-17100109.5K483 W484 L485 N530K483-E510 PolarHBondContact O-N 3.33Å; W484-E510 CarbonylContact C-O 3.57Å; W484-E510 WeakPolarHBondContact CA-O 3.45Å; L485-E510 PolarHBondContact N-O 2.96Å; E510-N530 VanDerWaalsContact CD-CB 3.49Å; E510-N530 VanDerWaalsContact CD-CG 3.47Å; E510-N530 WeakPolarHBondContact OE1-CB 3.43Å; E510-N530 PolarHBondContact OE2-ND2 3.32Å
511I97.7Very high92.1Very high0 Ų050.6 Ų50.60%027%0.265CS..EExtended strand (participates in β ladder)trans-106.2118.6-175.9-53.3179.2000109.9L485 V499 A502 R503 I509 A529 N530 Q531L485-I511 HydrophobicContact CB-CG1 4.27Å; L485-I511 HydrophobicContact CD2-CD1 4.43Å; L485-I511 HydrophobicContact CD2-CG1 4.34Å; L485-I511 HydrophobicContact CD2-CG2 4.29Å; L485-I511 HydrophobicContact CG-CG2 4.49Å; L485-I511 WeakPolarHBondContact O-CA 3.35Å; V499-I511 HydrophobicContact CB-CG2 4.49Å; V499-I511 HydrophobicContact CG1-CD1 3.93Å; V499-I511 HydrophobicContact CG1-CG2 4.3Å; V499-I511 HydrophobicContact CG2-CG2 3.64Å; A502-I511 HydrophobicContact CB-CD1 4.32Å; R503-I511 HydrophobicContact CB-CD1 4.37Å; I509-I511 HydrophobicContact CG2-CD1 3.92Å; I509-I511 HydrophobicContact CG2-CG1 3.68Å; I511-A529 HydrophobicContact CB-CB 4.48Å; I511-A529 HydrophobicContact CG2-CB 4.13Å; I511-N530 PolarHBondContact N-OD1 2.92Å; I511-N530 WeakPolarHBondContact O-CB 3.4Å; I511-N530 PolarHBondContact O-N 3.46Å; I511-Q531 PolarHBondContact O-N 3.47Å; I511-Q531 VanDerWaalsContact O-N 3.14Å
512I97.2Very high92Very high55 Ų5551 Ų5128%0.28227%0.271SS..EExtended strand (participates in β ladder)trans-115.8118.2174.2-52.5176.4000108.2L485 I486 L487 Q531 V533L485-I512 PolarHBondContact O-N 3.16Å; I486-I512 CarbonylContact C-O 3.58Å; I486-I512 VanDerWaalsContact CA-O 3.32Å; I486-I512 WeakPolarHBondContact CA-O 3.19Å; L487-I512 PolarHBondContact N-O 3.11Å; I512-Q531 WeakPolarHBondContact CA-O 3.19Å; I512-Q531 HydrophobicContact CG1-CB 4.28Å; I512-Q531 HydrophobicContact CG2-CB 4.3Å; I512-V533 HydrophobicContact CG2-CG2 4.14Å
513A97.1Very high91.6Very high1 Ų153.2 Ų53.21%0.00828%0.28CS..EExtended strand (participates in β ladder)trans-119145.7-177.600000112L487 I524 Q531 V532 V533L487-A513 HydrophobicContact CB-CB 4.14Å; L487-A513 HydrophobicContact CD1-CB 4.3Å; A513-I524 HydrophobicContact CB-CD1 4.46Å; A513-I524 HydrophobicContact CB-CG2 3.6Å; A513-Q531 PolarHBondContact N-O 3.36Å; A513-V532 CarbonylContact O-C 3.56Å; A513-V532 WeakPolarHBondContact O-CA 3.46Å; A513-V533 PolarHBondContact O-N 3.4Å
514R94.7Very high91.6Very high50 Ų5050.4 Ų50.419%0.18927%0.269CS..EExtended strand (participates in β ladder)trans-87.3141.2170.2-175.2-175.2-179.7-168.14.3110.4V428 L487 H516 V533V428-R514 VanDerWaalsContact CG2-CZ 3.46Å; V428-R514 VanDerWaalsContact CG2-NH1 3.32Å; L487-R514 WeakPolarHBondContact O-CB 3.4Å; L487-R514 PolarHBondContact O-N 2.77Å; R514-H516 PolarHBondContact NH2-CE1 3.16Å; R514-H516 PolarHBondContact NH2-NE2 2.83Å; R514-V533 WeakPolarHBondContact CA-O 3.38Å
515A92.7Very high91.8Very high0 Ų049.9 Ų49.90%026%0.257CS..EExtended strand (participates in β ladder)trans-132.5163.6169.200000111.2E520 V521 I524 V532 V533 M534 G535A515-E520 HydrophobicContact CB-CB 4.04Å; A515-V521 HydrophobicContact CB-CG2 3.57Å; A515-I524 HydrophobicContact CB-CD1 4.12Å; A515-V532 HydrophobicContact CB-CG1 3.71Å; A515-V533 PolarHBondContact N-O 3.38Å; A515-M534 WeakPolarHBondContact O-CA 3.38Å; A515-G535 PolarHBondContact O-N 3.4Å
516H86.3Confident92Very high36 Ų3655.2 Ų55.217%0.16728%0.283CS..SBendtrans-119.9-23.5177-77.5-72000113.3R514 E520 M534 E536R514-H516 PolarHBondContact NH2-CE1 3.16Å; R514-H516 PolarHBondContact NH2-NE2 2.83Å; H516-E520 PolarHBondContact N-OE2 2.9Å; H516-M534 WeakPolarHBondContact O-CE 3.3Å; H516-E536 IonicContact ND1-OE1 3.69Å; H516-E536 PolarHBondContact ND1-OE1 3.14Å
517Y85.8Confident92Very high152 Ų15258.6 Ų58.660%0.59630%0.295SS*.SBendtrans-127.7155.4-178.6-56.7-76.7000111.7D519 E520 V521Y517-D519 VanDerWaalsContact C-N 3.3Å; Y517-D519 WeakPolarHBondContact CB-OD1 3.47Å; Y517-D519 PolarHBondContact O-N 3.14Å; Y517-E520 HydrophobicContact CD2-CG 4.41Å; Y517-E520 PolarHBondContact N-OE2 2.99Å; Y517-E520 VanDerWaalsContact N-OE2 3.17Å; Y517-E520 WeakPolarHBondContact O-CB 3.47Å; Y517-E520 PolarHBondContact O-N 2.87Å; Y517-V521 WeakPolarHBondContact O-CG2 3.48Å; Y517-V521 PolarHBondContact O-N 3.31Å; Y517-V521 VanDerWaalsContact O-N 3.11Å
518D86.1Confident92.2Very high100 Ų10055.8 Ų55.854%0.53528%0.281SS..Hα-helixtrans-65.3-33-176.2-68.6-44.4000113V521 A522 R537D518-V521 WeakPolarHBondContact O-CB 3.32Å; D518-V521 PolarHBondContact O-N 3.38Å; D518-A522 PolarHBondContact O-N 3.44Å; D518-A522 VanDerWaalsContact O-N 3.13Å; D518-R537 IonicContact OD1-CZ 3.78Å; D518-R537 IonicContact OD1-NE 3.63Å; D518-R537 IonicContact OD1-NH2 2.83Å; D518-R537 PolarHBondContact OD1-NH2 3.24Å
519D85.1Confident92.3Very high84 Ų8449 Ų4945%0.44925%0.246SC..Hα-helixtrans-71.1-37.617660-23.7000112.3Y493 Y517 V521 A522 Y523Y493-D519 PolarHBondContact OH-OD2 3.2Å; Y517-D519 VanDerWaalsContact C-N 3.3Å; Y517-D519 WeakPolarHBondContact CB-OD1 3.47Å; Y517-D519 PolarHBondContact O-N 3.14Å; D519-V521 VanDerWaalsContact C-N 3.32Å; D519-A522 PolarHBondContact O-N 3.47Å; D519-Y523 WeakPolarHBondContact O-CB 3.46Å; D519-Y523 PolarHBondContact O-N 3.12Å
520E89.2Confident92.4Very high12 Ų1252.3 Ų52.36%0.05626%0.264CS..Hα-helixtrans-60.8-42169.6-66.2-179.8152.200111.3G492 Y493 A515 H516 Y517 A522 Y523 I524G492-E520 PolarHBondContact N-OE1 2.84Å; G492-E520 VanDerWaalsContact N-OE1 3.17Å; Y493-E520 HydrophobicContact CE2-CG 4.44Å; A515-E520 HydrophobicContact CB-CB 4.04Å; H516-E520 PolarHBondContact N-OE2 2.9Å; Y517-E520 HydrophobicContact CD2-CG 4.41Å; Y517-E520 PolarHBondContact N-OE2 2.99Å; Y517-E520 VanDerWaalsContact N-OE2 3.17Å; Y517-E520 WeakPolarHBondContact O-CB 3.47Å; Y517-E520 PolarHBondContact O-N 2.87Å; E520-A522 VanDerWaalsContact C-N 3.35Å; E520-A522 PolarHBondContact O-N 2.81Å; E520-Y523 PolarHBondContact O-N 2.89Å; E520-I524 HydrophobicContact CB-CD1 4.45Å; E520-I524 WeakPolarHBondContact O-CB 3.42Å; E520-I524 WeakPolarHBondContact O-CD1 3.05Å; E520-I524 WeakPolarHBondContact O-CG1 3.26Å; E520-I524 PolarHBondContact O-N 3.48Å
521V90.5Very high92.4Very high19 Ų1954.8 Ų54.812%0.11528%0.275CS..Hα-helixtrans-58.1-48.7176.51730000110.8A515 Y517 D518 D519 T525 V532 M534A515-V521 HydrophobicContact CB-CG2 3.57Å; Y517-V521 WeakPolarHBondContact O-CG2 3.48Å; Y517-V521 PolarHBondContact O-N 3.31Å; Y517-V521 VanDerWaalsContact O-N 3.11Å; D518-V521 WeakPolarHBondContact O-CB 3.32Å; D518-V521 PolarHBondContact O-N 3.38Å; D519-V521 VanDerWaalsContact C-N 3.32Å; V521-T525 WeakPolarHBondContact O-CB 3.33Å; V521-T525 PolarHBondContact O-N 2.99Å; V521-T525 VanDerWaalsContact O-N 3.08Å; V521-T525 PolarHBondContact O-OG1 3.33Å; V521-V532 HydrophobicContact CB-CG1 4.33Å; V521-V532 HydrophobicContact CG1-CB 4.23Å; V521-V532 HydrophobicContact CG1-CG1 4.27Å; V521-V532 HydrophobicContact CG2-CG1 4.03Å; V521-M534 HydrophobicContact CG2-CB 4.16Å; V521-M534 HydrophobicContact CG2-CG 4.5Å
522A88.9Confident92.3Very high46 Ų4656 Ų5638%0.3828%0.283SS..Hα-helixtrans-60.3-49.6177.700000111.1D518 D519 E520 I524 T525 E526D518-A522 PolarHBondContact O-N 3.44Å; D518-A522 VanDerWaalsContact O-N 3.13Å; D519-A522 PolarHBondContact O-N 3.47Å; E520-A522 VanDerWaalsContact C-N 3.35Å; E520-A522 PolarHBondContact O-N 2.81Å; A522-I524 PolarHBondContact O-N 3.11Å; A522-T525 PolarHBondContact O-N 3.28Å; A522-E526 WeakPolarHBondContact O-CB 3.49Å; A522-E526 WeakPolarHBondContact O-CG 3.49Å; A522-E526 PolarHBondContact O-N 3.48Å
523Y87.6Confident92.2Very high47 Ų4756.2 Ų56.218%0.18429%0.286CS..Hα-helixtrans-59.9-47.9-178.4178.8-96.9000112.9Y493 E497 D519 E520 T525 E526 R527Y493-Y523 AromaticContact CD1-CD1 3.76Å; Y493-Y523 HydrophobicContact CD1-CD1 3.76Å; Y493-Y523 HydrophobicContact CD1-CD2 4.2Å; Y493-Y523 AromaticContact CD1-CE1 3.92Å; Y493-Y523 HydrophobicContact CD1-CE1 3.92Å; Y493-Y523 HydrophobicContact CD1-CE2 4.33Å; Y493-Y523 AromaticContact CD1-CG 3.89Å; Y493-Y523 HydrophobicContact CD1-CG 3.89Å; Y493-Y523 HydrophobicContact CE1-CD1 4.47Å; Y493-Y523 HydrophobicContact CE1-CD2 4.44Å; Y493-Y523 HydrophobicContact CE1-CG 4.21Å; Y493-Y523 WeakPolarHBondContact O-CE1 3.36Å; E497-Y523 PolarHBondContact OE1-OH 3.03Å; D519-Y523 WeakPolarHBondContact O-CB 3.46Å; D519-Y523 PolarHBondContact O-N 3.12Å; E520-Y523 PolarHBondContact O-N 2.89Å; Y523-T525 VanDerWaalsContact C-N 3.33Å; Y523-T525 PolarHBondContact O-N 3.41Å; Y523-E526 PolarHBondContact O-N 3.37Å; Y523-R527 HydrophobicContact CE1-CG 4.34Å; Y523-R527 WeakPolarHBondContact O-CG 3.41Å; Y523-R527 PolarHBondContact O-N 3.16Å; Y523-R527 VanDerWaalsContact O-N 3.11Å; Y523-R527 PolarHBondContact OH-NH2 3.48Å; Y523-R527 VanDerWaalsContact OH-NH2 3.13Å
524I93.7Very high92Very high0 Ų057 Ų570%029%0.29CS..Hα-helixtrans-66.2-38.4179.9-63.2161.9000111.2G492 A495 V499 A513 A515 E520 A522 R527 G528 A529 V532G492-I524 WeakPolarHBondContact O-CD1 3.38Å; G492-I524 WeakPolarHBondContact O-CG1 3.26Å; A495-I524 HydrophobicContact CB-CD1 4.25Å; A495-I524 HydrophobicContact CB-CG1 4.46Å; V499-I524 HydrophobicContact CG2-CG2 3.98Å; A513-I524 HydrophobicContact CB-CD1 4.46Å; A513-I524 HydrophobicContact CB-CG2 3.6Å; A515-I524 HydrophobicContact CB-CD1 4.12Å; E520-I524 HydrophobicContact CB-CD1 4.45Å; E520-I524 WeakPolarHBondContact O-CB 3.42Å; E520-I524 WeakPolarHBondContact O-CD1 3.05Å; E520-I524 WeakPolarHBondContact O-CG1 3.26Å; E520-I524 PolarHBondContact O-N 3.48Å; A522-I524 PolarHBondContact O-N 3.11Å; I524-R527 PolarHBondContact O-N 2.82Å; I524-G528 PolarHBondContact O-N 3.14Å; I524-A529 HydrophobicContact CG2-CB 3.6Å; I524-A529 PolarHBondContact O-N 2.98Å; I524-V532 HydrophobicContact CB-CG2 4.02Å; I524-V532 HydrophobicContact CD1-CG1 4.2Å; I524-V532 HydrophobicContact CG2-CG2 3.71Å
525T95.7Very high91.7Very high73 Ų7355.6 Ų55.645%0.44829%0.291SS..Hα-helixtrans-64.5-44.9176.9-54.90000110.8V521 A522 Y523 R527 G528 V532V521-T525 WeakPolarHBondContact O-CB 3.33Å; V521-T525 PolarHBondContact O-N 2.99Å; V521-T525 VanDerWaalsContact O-N 3.08Å; V521-T525 PolarHBondContact O-OG1 3.33Å; A522-T525 PolarHBondContact O-N 3.28Å; Y523-T525 VanDerWaalsContact C-N 3.33Å; Y523-T525 PolarHBondContact O-N 3.41Å; T525-R527 VanDerWaalsContact C-N 3.25Å; T525-R527 PolarHBondContact O-N 3.13Å; T525-G528 WeakPolarHBondContact O-CA 3.49Å; T525-G528 PolarHBondContact O-N 2.68Å; T525-V532 WeakPolarHBondContact OG1-CG2 3.41Å
526E93.8Very high91.5Very high161 Ų16160 Ų6075%0.75231%0.311SS*.Hα-helixtrans-60.9-32.5176.6-76.1176.4-176.300112.9A522 Y523 G528A522-E526 WeakPolarHBondContact O-CB 3.49Å; A522-E526 WeakPolarHBondContact O-CG 3.49Å; A522-E526 PolarHBondContact O-N 3.48Å; Y523-E526 PolarHBondContact O-N 3.37Å; E526-G528 PolarHBondContact O-N 3.46Å
527R93.7Very high91.8Very high88 Ų8864.1 Ų64.133%0.33233%0.326SS..THydrogen-bonded Turntrans-74.8-7174.6-66.6-54-172.3106.73.7114G496 E497 V499 A500 Y523 I524 T525G496-R527 VanDerWaalsContact O-CB 3.3Å; G496-R527 WeakPolarHBondContact O-CB 3.22Å; G496-R527 WeakPolarHBondContact O-CG 3.38Å; E497-R527 VanDerWaalsContact CD-NH1 3.27Å; E497-R527 IonicContact OE1-CZ 3.98Å; E497-R527 VanDerWaalsContact OE1-CZ 3.23Å; E497-R527 IonicContact OE1-NH1 2.88Å; E497-R527 PolarHBondContact OE1-NH1 2.72Å; E497-R527 VanDerWaalsContact OE1-NH1 3.16Å; E497-R527 IonicContact OE1-NH2 3.13Å; E497-R527 PolarHBondContact OE1-NH2 2.69Å; E497-R527 IonicContact OE2-CZ 2.69Å; E497-R527 IonicContact OE2-NH1 3.28Å; E497-R527 PolarHBondContact OE2-NH1 2.88Å; E497-R527 IonicContact OE2-NH2 3.16Å; V499-R527 HydrophobicContact CB-CB 4.36Å; V499-R527 HydrophobicContact CG1-CB 4.14Å; A500-R527 HydrophobicContact CB-CB 4.24Å; A500-R527 HydrophobicContact CB-CG 4.45Å; Y523-R527 HydrophobicContact CE1-CG 4.34Å; Y523-R527 WeakPolarHBondContact O-CG 3.41Å; Y523-R527 PolarHBondContact O-N 3.16Å; Y523-R527 VanDerWaalsContact O-N 3.11Å; Y523-R527 PolarHBondContact OH-NH2 3.48Å; Y523-R527 VanDerWaalsContact OH-NH2 3.13Å; I524-R527 PolarHBondContact O-N 2.82Å; T525-R527 VanDerWaalsContact C-N 3.25Å; T525-R527 PolarHBondContact O-N 3.13Å
528G94.9Very high92.1Very high25 Ų2560 Ų6026%0.25831%0.312SS..THydrogen-bonded Turntrans105.824.8169.500000114.8R503 I524 T525 E526R503-G528 PolarHBondContact NE-O 3.05Å; R503-G528 VanDerWaalsContact NE-O 3.14Å; R503-G528 PolarHBondContact NH2-O 3.26Å; I524-G528 PolarHBondContact O-N 3.14Å; T525-G528 WeakPolarHBondContact O-CA 3.49Å; T525-G528 PolarHBondContact O-N 2.68Å; E526-G528 PolarHBondContact O-N 3.46Å
529A96.1Very high92.3Very high11 Ų1159.9 Ų59.99%0.09131%0.31CS..  trans-68.6144.717000000110.9V499 I511 I524 V532V499-A529 HydrophobicContact CG1-CB 4.02Å; V499-A529 VanDerWaalsContact CG1-N 3.31Å; V499-A529 HydrophobicContact CG2-CB 4.27Å; I511-A529 HydrophobicContact CB-CB 4.48Å; I511-A529 HydrophobicContact CG2-CB 4.13Å; I524-A529 HydrophobicContact CG2-CB 3.6Å; I524-A529 PolarHBondContact O-N 2.98Å; A529-V532 HydrophobicContact CB-CG2 3.93Å
530N97.2Very high92.6Very high73 Ų7358.1 Ų58.139%0.3931%0.307SS..SBendtrans-76.2-41.1176.7-61.379.7000111.1R503 I509 E510 I511R503-N530 PolarHBondContact NH2-OD1 3.28Å; I509-N530 PolarHBondContact O-OD1 3.08Å; E510-N530 VanDerWaalsContact CD-CB 3.49Å; E510-N530 VanDerWaalsContact CD-CG 3.47Å; E510-N530 WeakPolarHBondContact OE1-CB 3.43Å; E510-N530 PolarHBondContact OE2-ND2 3.32Å; I511-N530 PolarHBondContact N-OD1 2.92Å; I511-N530 WeakPolarHBondContact O-CB 3.4Å; I511-N530 PolarHBondContact O-N 3.46Å
531Q96Very high92.8Very high117 Ų11763.9 Ų63.955%0.54733%0.329SS..EExtended strand (participates in β ladder)trans-138.1135.7-176.9-65.1-91.215.800109.1I511 I512 A513I511-Q531 PolarHBondContact O-N 3.47Å; I511-Q531 VanDerWaalsContact O-N 3.14Å; I512-Q531 WeakPolarHBondContact CA-O 3.19Å; I512-Q531 HydrophobicContact CG1-CB 4.28Å; I512-Q531 HydrophobicContact CG2-CB 4.3Å; A513-Q531 PolarHBondContact N-O 3.36Å
532V96Very high92.8Very high26 Ų2666.2 Ų66.216%0.15834%0.343CS..EExtended strand (participates in β ladder)trans-123.6121171.3-170.60000109.1A513 A515 V521 I524 T525 A529A513-V532 CarbonylContact O-C 3.56Å; A513-V532 WeakPolarHBondContact O-CA 3.46Å; A515-V532 HydrophobicContact CB-CG1 3.71Å; V521-V532 HydrophobicContact CB-CG1 4.33Å; V521-V532 HydrophobicContact CG1-CB 4.23Å; V521-V532 HydrophobicContact CG1-CG1 4.27Å; V521-V532 HydrophobicContact CG2-CG1 4.03Å; I524-V532 HydrophobicContact CB-CG2 4.02Å; I524-V532 HydrophobicContact CD1-CG1 4.2Å; I524-V532 HydrophobicContact CG2-CG2 3.71Å; T525-V532 WeakPolarHBondContact OG1-CG2 3.41Å; A529-V532 HydrophobicContact CB-CG2 3.93Å
533V94.9Very high93Very high59 Ų5969.8 Ų69.836%0.35835%0.353SS..EExtended strand (participates in β ladder)trans-104115.1-176.3-175.70000108.9I512 A513 R514 A515 E538I512-V533 HydrophobicContact CG2-CG2 4.14Å; A513-V533 PolarHBondContact O-N 3.4Å; R514-V533 WeakPolarHBondContact CA-O 3.38Å; A515-V533 PolarHBondContact N-O 3.38Å; V533-E538 HydrophobicContact CG1-CG 3.51Å
534M93.7Very high93.2Very high19 Ų1972.8 Ų72.89%0.09437%0.372CS..EExtended strand (participates in β ladder)trans-93121.9174.7-169.7-173.9177.600109.4A515 H516 V521 E536 R537 E538A515-M534 WeakPolarHBondContact O-CA 3.38Å; H516-M534 WeakPolarHBondContact O-CE 3.3Å; V521-M534 HydrophobicContact CG2-CB 4.16Å; V521-M534 HydrophobicContact CG2-CG 4.5Å; M534-E536 VanDerWaalsContact C-N 3.29Å; M534-E536 HydrophobicContact CE-CB 4.15Å; M534-E536 HydrophobicContact CE-CG 4.43Å; M534-E536 PolarHBondContact O-N 2.91Å; M534-R537 HydrophobicContact CB-CB 4.23Å; M534-R537 HydrophobicContact CB-CG 4.04Å; M534-R537 HydrophobicContact CG-CG 4.26Å; M534-R537 PolarHBondContact O-N 3.34Å; M534-R537 VanDerWaalsContact O-N 3.14Å; M534-R537 HydrophobicContact SD-CG 3.69Å; M534-R537 PolarHBondContact SD-NE 3.5Å; M534-E538 PolarHBondContact O-N 2.04Å; M534-E538 VanDerWaalsContact O-N 3.15Å
535G87.9Confident93.1Very high20 Ų2077.8 Ų77.821%0.20640%0.395CS..Hα-helixtrans-57.9-42.3-173.600000112.8A515 R537 E538 I539A515-G535 PolarHBondContact O-N 3.4Å; G535-R537 VanDerWaalsContact C-N 3.33Å; G535-R537 PolarHBondContact O-N 3.42Å; G535-E538 PolarHBondContact O-N 3.5Å; G535-I539 WeakPolarHBondContact O-CB 3.43Å; G535-I539 WeakPolarHBondContact O-CD1 3.01Å; G535-I539 WeakPolarHBondContact O-CG1 3.49Å; G535-I539 PolarHBondContact O-N 3.23Å
536E87.9Confident92.8Very high91 Ų9180 Ų8043%0.42540%0.404SS..Hα-helixtrans-62.6-38.9-179.9-65.672.1-162.900111.6H516 M534 A540H516-E536 IonicContact ND1-OE1 3.69Å; H516-E536 PolarHBondContact ND1-OE1 3.14Å; M534-E536 VanDerWaalsContact C-N 3.29Å; M534-E536 HydrophobicContact CE-CB 4.15Å; M534-E536 HydrophobicContact CE-CG 4.43Å; M534-E536 PolarHBondContact O-N 2.91Å; E536-A540 WeakPolarHBondContact O-CB 3.32Å; E536-A540 PolarHBondContact O-N 3.13Å
537R92.2Very high92.5Very high123 Ų12379 Ų7946%0.46440%0.403SS..Hα-helixtrans-70.4-42.1178-67.4-179.5-170.9171.5-1.1111.8D518 M534 G535 A540 R541D518-R537 IonicContact OD1-CZ 3.78Å; D518-R537 IonicContact OD1-NE 3.63Å; D518-R537 IonicContact OD1-NH2 2.83Å; D518-R537 PolarHBondContact OD1-NH2 3.24Å; M534-R537 HydrophobicContact CB-CB 4.23Å; M534-R537 HydrophobicContact CB-CG 4.04Å; M534-R537 HydrophobicContact CG-CG 4.26Å; M534-R537 PolarHBondContact O-N 3.34Å; M534-R537 VanDerWaalsContact O-N 3.14Å; M534-R537 HydrophobicContact SD-CG 3.69Å; M534-R537 PolarHBondContact SD-NE 3.5Å; G535-R537 VanDerWaalsContact C-N 3.33Å; G535-R537 PolarHBondContact O-N 3.42Å; R537-A540 PolarHBondContact O-N 3Å; R537-R541 WeakPolarHBondContact O-CB 3.35Å; R537-R541 PolarHBondContact O-N 3.28Å
538E92.1Very high92.1Very high66 Ų6682.8 Ų82.831%0.30842%0.424SS..Hα-helixtrans-71.5-33.6178.8-66.6-50.7125.500112.3V533 M534 G535 R541 T542V533-E538 HydrophobicContact CG1-CG 3.51Å; M534-E538 PolarHBondContact O-N 2.04Å; M534-E538 VanDerWaalsContact O-N 3.15Å; G535-E538 PolarHBondContact O-N 3.5Å; E538-R541 PolarHBondContact O-N 3.25Å; E538-R541 IonicContact OE1-CZ 3.69Å; E538-R541 IonicContact OE1-NE 3.23Å; E538-R541 PolarHBondContact OE1-NE 2.83Å; E538-R541 IonicContact OE1-NH2 2.82Å; E538-R541 PolarHBondContact OE1-NH2 3.16Å; E538-R541 IonicContact OE2-CZ 3.52Å; E538-R541 IonicContact OE2-NE 3.81Å; E538-R541 PolarHBondContact OE2-NE 3.2Å; E538-R541 IonicContact OE2-NH2 2.63Å; E538-T542 WeakPolarHBondContact O-CB 2.91Å; E538-T542 PolarHBondContact O-N 3.41Å; E538-T542 PolarHBondContact O-OG1 3.33Å
539I90.4Very high91.3Very high98 Ų9885.8 Ų85.850%0.50344%0.438SS..Hα-helixtrans-61.3-48169.4-69.5164.4000109.8G535 R541 T542 M543G535-I539 WeakPolarHBondContact O-CB 3.43Å; G535-I539 WeakPolarHBondContact O-CD1 3.01Å; G535-I539 WeakPolarHBondContact O-CG1 3.49Å; G535-I539 PolarHBondContact O-N 3.23Å; I539-R541 PolarHBondContact O-N 3.19Å; I539-T542 PolarHBondContact O-N 3.17Å; I539-M543 HydrophobicContact CG2-CE 3.71Å; I539-M543 HydrophobicContact CG2-SD 4.2Å; I539-M543 VanDerWaalsContact O-CG 3.32Å; I539-M543 WeakPolarHBondContact O-CG 3.15Å; I539-M543 PolarHBondContact O-N 2.83Å
540A92.7Very high90.1Very high47 Ų4789.6 Ų89.639%0.38846%0.462SS..Hα-helixtrans-62-41.6177.700000112.5E536 R537 M543 L544E536-A540 WeakPolarHBondContact O-CB 3.32Å; E536-A540 PolarHBondContact O-N 3.13Å; R537-A540 PolarHBondContact O-N 3Å; A540-M543 PolarHBondContact O-N 2.82Å; A540-L544 WeakPolarHBondContact O-CG 3.35Å; A540-L544 PolarHBondContact O-N 2.69Å
541R92.7Very high89Confident133 Ų13390.6 Ų90.650%0.50247%0.472SS..Hα-helixtrans-59.8-48.6174.5-170.7-163.2-56.1-107.7-0.2111.3R537 E538 I539 M543 L544 E545R537-R541 WeakPolarHBondContact O-CB 3.35Å; R537-R541 PolarHBondContact O-N 3.28Å; E538-R541 PolarHBondContact O-N 3.25Å; E538-R541 IonicContact OE1-CZ 3.69Å; E538-R541 IonicContact OE1-NE 3.23Å; E538-R541 PolarHBondContact OE1-NE 2.83Å; E538-R541 IonicContact OE1-NH2 2.82Å; E538-R541 PolarHBondContact OE1-NH2 3.16Å; E538-R541 IonicContact OE2-CZ 3.52Å; E538-R541 IonicContact OE2-NE 3.81Å; E538-R541 PolarHBondContact OE2-NE 3.2Å; E538-R541 IonicContact OE2-NH2 2.63Å; I539-R541 PolarHBondContact O-N 3.19Å; R541-M543 VanDerWaalsContact C-N 3.3Å; R541-M543 PolarHBondContact O-N 2.96Å; R541-L544 WeakPolarHBondContact O-CB 3.35Å; R541-L544 PolarHBondContact O-N 3.47Å; R541-L544 VanDerWaalsContact O-N 3.1Å; R541-E545 WeakPolarHBondContact O-CG 2.98Å; R541-E545 PolarHBondContact O-N 3.32Å
542T91.2Very high87.4Confident68 Ų6890.6 Ų90.642%0.41749%0.492SS..Hα-helixtrans-60.6-40.7177.8-53.40000111.1E538 I539 L544 E545 L546E538-T542 WeakPolarHBondContact O-CB 2.91Å; E538-T542 PolarHBondContact O-N 3.41Å; E538-T542 PolarHBondContact O-OG1 3.33Å; I539-T542 PolarHBondContact O-N 3.17Å; T542-L544 VanDerWaalsContact C-N 3.33Å; T542-L544 PolarHBondContact O-N 3.36Å; T542-E545 PolarHBondContact O-N 2.87Å; T542-L546 HydrophobicContact CG2-CD1 4.32Å; T542-L546 VanDerWaalsContact O-CG 3.29Å; T542-L546 WeakPolarHBondContact O-CG 3.17Å; T542-L546 PolarHBondContact O-N 2.9Å
543M92.3Very high85.8Confident120 Ų12092.8 Ų92.859%0.59152%0.52SS*.Hα-helixtrans-62.2-39.2175.4-73177.7175.200112.3I539 A540 R541 L547I539-M543 HydrophobicContact CG2-CE 3.71Å; I539-M543 HydrophobicContact CG2-SD 4.2Å; I539-M543 VanDerWaalsContact O-CG 3.32Å; I539-M543 WeakPolarHBondContact O-CG 3.15Å; I539-M543 PolarHBondContact O-N 2.83Å; A540-M543 PolarHBondContact O-N 2.82Å; R541-M543 VanDerWaalsContact C-N 3.3Å; R541-M543 PolarHBondContact O-N 2.96Å; M543-L547 WeakPolarHBondContact O-CG 3.5Å; M543-L547 PolarHBondContact O-N 3.36Å
544L92.2Very high83.9Confident111 Ų11197 Ų9758%0.58154%0.536SS*.Hα-helixtrans-66.9-44.4175.5-72166.9000112A540 R541 T542 L546 L547 E548A540-L544 WeakPolarHBondContact O-CG 3.35Å; A540-L544 PolarHBondContact O-N 2.69Å; R541-L544 WeakPolarHBondContact O-CB 3.35Å; R541-L544 PolarHBondContact O-N 3.47Å; R541-L544 VanDerWaalsContact O-N 3.1Å; T542-L544 VanDerWaalsContact C-N 3.33Å; T542-L544 PolarHBondContact O-N 3.36Å; L544-L546 VanDerWaalsContact C-N 3.3Å; L544-L546 PolarHBondContact O-N 2.97Å; L544-L547 WeakPolarHBondContact O-CB 3.49Å; L544-L547 PolarHBondContact O-N 3.35Å; L544-E548 PolarHBondContact O-N 3.32Å
545E91.5Very high81.9Confident105 Ų105101.9 Ų101.949%0.49157%0.567SS.*Hα-helixtrans-60.2-39.2176.4-71.3172.9-171.100112R541 T542 L547 E548 T549R541-E545 WeakPolarHBondContact O-CG 2.98Å; R541-E545 PolarHBondContact O-N 3.32Å; T542-E545 PolarHBondContact O-N 2.87Å; E545-L547 VanDerWaalsContact C-N 3.25Å; E545-L547 PolarHBondContact O-N 2.73Å; E545-E548 PolarHBondContact O-N 2.69Å; E545-E548 VanDerWaalsContact O-N 3.16Å; E545-T549 PolarHBondContact O-N 3.14Å; E545-T549 PolarHBondContact O-OG1 3.11Å
546L89.5Confident80.3Confident118 Ų118106.9 Ų106.962%0.61859%0.593SS**Hα-helixtrans-66.1-25.7175.7-71.8172.8000113.2T542 L544T542-L546 HydrophobicContact CG2-CD1 4.32Å; T542-L546 VanDerWaalsContact O-CG 3.29Å; T542-L546 WeakPolarHBondContact O-CG 3.17Å; T542-L546 PolarHBondContact O-N 2.9Å; L544-L546 VanDerWaalsContact C-N 3.3Å; L544-L546 PolarHBondContact O-N 2.97Å
547L87.3Confident78.6Confident142 Ų142109.2 Ų109.274%0.74361%0.613SS**Hα-helixtrans-76.1-24.7174.2-68.8169.9000112.6M543 L544 E545 T549M543-L547 WeakPolarHBondContact O-CG 3.5Å; M543-L547 PolarHBondContact O-N 3.36Å; L544-L547 WeakPolarHBondContact O-CB 3.49Å; L544-L547 PolarHBondContact O-N 3.35Å; E545-L547 VanDerWaalsContact C-N 3.25Å; E545-L547 PolarHBondContact O-N 2.73Å; L547-T549 VanDerWaalsContact C-N 3.29Å
548E86.5Confident76.4Confident166 Ų166109.8 Ų109.878%0.77666%0.658SS**Hα-helixtrans-77.4-17.9175.4-63.9-176.3169.700112.5L544 E545L544-E548 PolarHBondContact O-N 3.32Å; E545-E548 PolarHBondContact O-N 2.69Å; E545-E548 VanDerWaalsContact O-N 3.16Å
549T78Confident75.6Confident88 Ų88112 Ų11254%0.5468%0.675SS.*SBendtrans-87.1119.5176.5-29.30000108.6E545 L547E545-T549 PolarHBondContact O-N 3.14Å; E545-T549 PolarHBondContact O-OG1 3.11Å; L547-T549 VanDerWaalsContact C-N 3.29Å
550P70.7Confident74.9Confident92 Ų92112.7 Ų112.760%0.59768%0.684SS**PPolyproline II helixtrans-58.5139-179.321.3-30.7000110.3A552P550-A552 PolarHBondContact O-N 3.27Å
551P73.1Confident73.9Confident94 Ų94116.4 Ų116.461%0.6170%0.701SS**PPolyproline II helixtrans-57.5133.3-179.422.2-30.9000109.6G553 E554P551-G553 VanDerWaalsContact C-N 3.34Å; P551-G553 PolarHBondContact O-N 3.33Å; P551-E554 PolarHBondContact O-N 3.37Å
552A62.4Low72.8Confident117 Ų117115.4 Ų115.497%0.96771%0.712SS**THydrogen-bonded Turntrans-57.294.4178.800000110P550P550-A552 PolarHBondContact O-N 3.27Å
553G63.2Low71.6Confident72 Ų72118.4 Ų118.474%0.74273%0.731SS**THydrogen-bonded Turntrans158-25.7-17100000114.6P551 V555P551-G553 VanDerWaalsContact C-N 3.34Å; P551-G553 PolarHBondContact O-N 3.33Å; G553-V555 VanDerWaalsContact C-N 3.31Å; G553-V555 PolarHBondContact O-N 3.37Å; G553-V555 VanDerWaalsContact O-N 3.11Å
554E54.9Low70.3Confident147 Ų147118.3 Ų118.369%0.68774%0.74SS**  trans-86.672.4171-75.8-173.7161.400110.8P551 V556P551-E554 PolarHBondContact O-N 3.37Å; E554-V556 PolarHBondContact O-N 3.2Å
555V51Low68.7Low122 Ų122118.8 Ų118.874%0.73975%0.751SS**  trans-67.3108.7153.6179.10000105.7G553 T557G553-V555 VanDerWaalsContact C-N 3.31Å; G553-V555 PolarHBondContact O-N 3.37Å; G553-V555 VanDerWaalsContact O-N 3.11Å; V555-T557 PolarHBondContact O-N 2.81Å
556V54.1Low66.9Low125 Ų125119.8 Ų119.876%0.75877%0.771SS**  trans-53.899.2171179.10000108.4E554E554-V556 PolarHBondContact O-N 3.2Å
557T53.1Low65Low140 Ų140120 Ų12086%0.85978%0.784SS**  trans-90.691.6157.352.50000106.9V555V555-T557 PolarHBondContact O-N 2.81Å
558G46.3Very low63Low135 Ų135118 Ų118100%1.39279%0.788SS**  trans-167.6017700000110.3

Retrieved 558 of 558 residues in 551.3 ms (Link to these results)

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