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Adenosine receptor A2a

Receptor for adenosine (By similarity). The activity of this receptor is mediated by G proteins which activate adenylyl cyclase (By similarity).

AlphaFold DB , UniProt , Accession P29274, Species HUMAN (Homo sapiens, Human), Gene ADORA2A, Length 412 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
1M42Very low77.8Confident212 Ų21291.3 Ų91.3100%1.04453%0.528SS*.  0-22.10-71.7-176.3-147.300116.6I3M1-I3 VanDerWaalsContact C-N 3.35Å; M1-I3 PolarHBondContact O-N 3.38Å
2P58.4Low79.4Confident111 Ų11188.6 Ų88.672%0.72151%0.514SS*.Hα-helixtrans-69.8-28.1-17526.3-31.9000114.1G5 S6P2-G5 PolarHBondContact O-N 2.69Å; P2-S6 PolarHBondContact O-N 3.29Å
3I59.7Low80.8Confident137 Ų13781.8 Ų81.870%0.70347%0.474SS*.Hα-helixtrans-65.1-43.8-176.3-56.5171.5000111.7M1 G5 S6 S7M1-I3 VanDerWaalsContact C-N 3.35Å; M1-I3 PolarHBondContact O-N 3.38Å; I3-G5 PolarHBondContact O-N 3.25Å; I3-S6 PolarHBondContact O-N 3.19Å; I3-S7 PolarHBondContact O-N 3.22Å; I3-S7 VanDerWaalsContact O-N 3.14Å; I3-S7 PolarHBondContact O-OG 2.82Å
4M63Low82.1Confident149 Ų14982.5 Ų82.573%0.73448%0.475SS*.Hα-helixtrans-65.1-39.4-178.3-68.9176.270.300112.4S6 S7 V8M4-S6 VanDerWaalsContact C-N 3.34Å; M4-S6 PolarHBondContact O-N 3.02Å; M4-S7 PolarHBondContact O-N 2.91Å; M4-V8 WeakPolarHBondContact O-CG2 3.29Å; M4-V8 PolarHBondContact O-N 3.07Å
5G75.5Confident83.1Confident42 Ų4280.5 Ų80.543%0.43347%0.472SS..Hα-helixtrans-64-39.2177.400000112.5P2 I3 Y9P2-G5 PolarHBondContact O-N 2.69Å; I3-G5 PolarHBondContact O-N 3.25Å; G5-Y9 PolarHBondContact O-N 3.39Å; G5-Y9 VanDerWaalsContact O-N 3.11Å
6S83.9Confident84.1Confident39 Ų3976.4 Ų76.427%0.27345%0.447SS..Hα-helixtrans-65.8-44.7177.2-176.10000112.1P2 I3 M4 V8 Y9 I10P2-S6 PolarHBondContact O-N 3.29Å; I3-S6 PolarHBondContact O-N 3.19Å; M4-S6 VanDerWaalsContact C-N 3.34Å; M4-S6 PolarHBondContact O-N 3.02Å; S6-V8 VanDerWaalsContact C-N 3.33Å; S6-V8 PolarHBondContact O-N 3.49Å; S6-Y9 PolarHBondContact O-N 3.42Å; S6-I10 VanDerWaalsContact O-CG1 3.23Å; S6-I10 WeakPolarHBondContact O-CG1 3.46Å; S6-I10 PolarHBondContact O-N 3.21Å
7S91.9Very high84.9Confident63 Ų6372.3 Ų72.344%0.44142%0.424SS..Hα-helixtrans-62.8-37.2178.9-560000113I3 M4 T11I3-S7 PolarHBondContact O-N 3.22Å; I3-S7 VanDerWaalsContact O-N 3.14Å; I3-S7 PolarHBondContact O-OG 2.82Å; M4-S7 PolarHBondContact O-N 2.91Å; S7-T11 WeakPolarHBondContact O-CB 3.41Å; S7-T11 PolarHBondContact O-N 3.39Å; S7-T11 PolarHBondContact O-OG1 3.22Å
8V94.3Very high85.7Confident96 Ų9672.9 Ų72.958%0.58243%0.429SS*.Hα-helixtrans-66.6-48.7175.7174.10000110.6M4 S6 I10 T11 V12M4-V8 WeakPolarHBondContact O-CG2 3.29Å; M4-V8 PolarHBondContact O-N 3.07Å; S6-V8 VanDerWaalsContact C-N 3.33Å; S6-V8 PolarHBondContact O-N 3.49Å; V8-I10 PolarHBondContact O-N 2.87Å; V8-T11 PolarHBondContact O-N 3.37Å; V8-V12 HydrophobicContact CG1-CG2 4.47Å; V8-V12 WeakPolarHBondContact O-CG2 3.32Å; V8-V12 PolarHBondContact O-N 3.46Å
9Y94.8Very high86.4Confident13 Ų1373.7 Ų73.75%0.05143%0.431CS..Hα-helixtrans-55.3-51.3176.8167-108.2000111.8G5 S6 T11 V12 E13 Y271 I274 V275G5-Y9 PolarHBondContact O-N 3.39Å; G5-Y9 VanDerWaalsContact O-N 3.11Å; S6-Y9 PolarHBondContact O-N 3.42Å; Y9-T11 VanDerWaalsContact C-N 3.32Å; Y9-T11 PolarHBondContact O-N 3.5Å; Y9-V12 PolarHBondContact O-N 2.8Å; Y9-E13 HydrophobicContact CD2-CG 3.93Å; Y9-E13 HydrophobicContact CE1-CG 4.25Å; Y9-E13 HydrophobicContact CE2-CG 3.52Å; Y9-E13 WeakPolarHBondContact CE2-OE1 3.49Å; Y9-E13 HydrophobicContact CG-CG 4.46Å; Y9-E13 WeakPolarHBondContact O-CB 3.34Å; Y9-E13 WeakPolarHBondContact O-CG 3.39Å; Y9-E13 PolarHBondContact O-N 2.94Å; Y9-Y271 HydrophobicContact CD1-CD1 4.24Å; Y9-Y271 HydrophobicContact CD1-CE1 4.23Å; Y9-Y271 AromaticContact CD2-CD1 3.79Å; Y9-Y271 HydrophobicContact CD2-CD1 3.79Å; Y9-Y271 AromaticContact CD2-CG 3.88Å; Y9-Y271 HydrophobicContact CD2-CG 3.88Å; Y9-Y271 HydrophobicContact CE1-CD1 4.17Å; Y9-Y271 HydrophobicContact CE1-CE1 4.12Å; Y9-Y271 AromaticContact CE2-CD1 3.7Å; Y9-Y271 HydrophobicContact CE2-CD1 3.7Å; Y9-Y271 HydrophobicContact CE2-CE1 4.45Å; Y9-Y271 HydrophobicContact CE2-CG 4.21Å; Y9-Y271 HydrophobicContact CG-CD1 4.05Å; Y9-Y271 HydrophobicContact CG-CE1 4.44Å; Y9-Y271 HydrophobicContact CG-CG 4.14Å; Y9-Y271 AromaticContact CZ-CD1 3.9Å; Y9-I274 HydrophobicContact CE2-CG2 4.39Å; Y9-V275 HydrophobicContact CD2-CG2 3.88Å; Y9-V275 HydrophobicContact CE2-CG2 3.96Å
10I95.7Very high87Confident47 Ų4770.1 Ų70.124%0.24141%0.409CS..Hα-helixtrans-59.7-43.5179.5-66.2168.5000111.1S6 V8 V12 E13 L14 I64S6-I10 VanDerWaalsContact O-CG1 3.23Å; S6-I10 WeakPolarHBondContact O-CG1 3.46Å; S6-I10 PolarHBondContact O-N 3.21Å; V8-I10 PolarHBondContact O-N 2.87Å; I10-V12 PolarHBondContact O-N 3.11Å; I10-E13 PolarHBondContact O-N 3Å; I10-L14 HydrophobicContact CG2-CD1 3.93Å; I10-L14 HydrophobicContact CG2-CG 4.33Å; I10-L14 WeakPolarHBondContact O-CB 3.46Å; I10-L14 VanDerWaalsContact O-CG 3.3Å; I10-L14 WeakPolarHBondContact O-CG 3.27Å; I10-L14 PolarHBondContact O-N 3.46Å; I10-I64 HydrophobicContact CD1-CG2 4.34Å; I10-I64 HydrophobicContact CG1-CG2 3.99Å; I10-I64 HydrophobicContact CG2-CD1 4.37Å; I10-I64 HydrophobicContact CG2-CG2 4.4Å
11T96.7Very high87.5Confident95 Ų9569.1 Ų69.158%0.58340%0.402SS*.Hα-helixtrans-62.8-43.4-179.8-57.50000111.6S7 V8 Y9 A15S7-T11 WeakPolarHBondContact O-CB 3.41Å; S7-T11 PolarHBondContact O-N 3.39Å; S7-T11 PolarHBondContact O-OG1 3.22Å; V8-T11 PolarHBondContact O-N 3.37Å; Y9-T11 VanDerWaalsContact C-N 3.32Å; Y9-T11 PolarHBondContact O-N 3.5Å; T11-A15 PolarHBondContact O-N 2.87Å; T11-A15 VanDerWaalsContact O-N 3.13Å
12V97.3Very high90.2Very high59 Ų5964.5 Ų64.536%0.35838%0.381SS..Hα-helixtrans-65.7-45.8177.9171.80000110.8V8 Y9 I10 L14 A15 I16 V275V8-V12 HydrophobicContact CG1-CG2 4.47Å; V8-V12 WeakPolarHBondContact O-CG2 3.32Å; V8-V12 PolarHBondContact O-N 3.46Å; Y9-V12 PolarHBondContact O-N 2.8Å; I10-V12 PolarHBondContact O-N 3.11Å; V12-L14 PolarHBondContact O-N 3.31Å; V12-A15 PolarHBondContact O-N 2.99Å; V12-I16 HydrophobicContact CG1-CD1 3.94Å; V12-I16 WeakPolarHBondContact O-CG1 3.37Å; V12-I16 PolarHBondContact O-N 3.06Å; V12-V275 HydrophobicContact CG1-CG1 3.68Å; V12-V275 HydrophobicContact CG1-CG2 4.21Å
13E97.8Very high92Very high0 Ų060 Ų600%035%0.354CS..Hα-helixtrans-58.6-46.7176.8-77.7-6716800112.2Y9 I10 A15 I16 A17 I60 I64 V275 H278Y9-E13 HydrophobicContact CD2-CG 3.93Å; Y9-E13 HydrophobicContact CE1-CG 4.25Å; Y9-E13 HydrophobicContact CE2-CG 3.52Å; Y9-E13 WeakPolarHBondContact CE2-OE1 3.49Å; Y9-E13 HydrophobicContact CG-CG 4.46Å; Y9-E13 WeakPolarHBondContact O-CB 3.34Å; Y9-E13 WeakPolarHBondContact O-CG 3.39Å; Y9-E13 PolarHBondContact O-N 2.94Å; I10-E13 PolarHBondContact O-N 3Å; E13-A15 VanDerWaalsContact C-N 3.33Å; E13-A15 PolarHBondContact O-N 2.88Å; E13-I16 PolarHBondContact O-N 3.26Å; E13-A17 PolarHBondContact O-N 3.01Å; E13-I60 HydrophobicContact CB-CG2 3.85Å; E13-I60 WeakPolarHBondContact OE2-CG2 3.34Å; E13-I64 HydrophobicContact CB-CD1 3.94Å; E13-I64 HydrophobicContact CB-CG1 4.07Å; E13-I64 HydrophobicContact CG-CG1 4.46Å; E13-V275 HydrophobicContact CG-CG2 4.35Å; E13-V275 WeakPolarHBondContact OE1-CG2 3.4Å; E13-H278 IonicContact OE1-CE1 3.96Å; E13-H278 IonicContact OE1-ND1 3.82Å; E13-H278 PolarHBondContact OE1-ND1 3.31Å; E13-H278 IonicContact OE2-CE1 3.42Å; E13-H278 IonicContact OE2-CG 2.91Å; E13-H278 IonicContact OE2-ND1 3.72Å; E13-H278 PolarHBondContact OE2-ND1 3.3Å
14L98Very high93.9Very high92 Ų9253.5 Ų53.548%0.48232%0.321SS..Hα-helixtrans-62.4-38.3177-71.4174.8000112.4I10 V12 A17 V18 I64I10-L14 HydrophobicContact CG2-CD1 3.93Å; I10-L14 HydrophobicContact CG2-CG 4.33Å; I10-L14 WeakPolarHBondContact O-CB 3.46Å; I10-L14 VanDerWaalsContact O-CG 3.3Å; I10-L14 WeakPolarHBondContact O-CG 3.27Å; I10-L14 PolarHBondContact O-N 3.46Å; V12-L14 PolarHBondContact O-N 3.31Å; L14-A17 PolarHBondContact O-N 3.2Å; L14-V18 WeakPolarHBondContact O-CG2 3.36Å; L14-V18 PolarHBondContact O-N 3.17Å; L14-V18 VanDerWaalsContact O-N 3.09Å; L14-I64 HydrophobicContact CD2-CD1 4Å; L14-I64 HydrophobicContact CG-CD1 4.13Å
15A98.2Very high95.6Very high53 Ų5349.5 Ų49.544%0.43831%0.305SS..Hα-helixtrans-64-42.7174.900000111.7T11 V12 E13 V18 L19T11-A15 PolarHBondContact O-N 2.87Å; T11-A15 VanDerWaalsContact O-N 3.13Å; V12-A15 PolarHBondContact O-N 2.99Å; E13-A15 VanDerWaalsContact C-N 3.33Å; E13-A15 PolarHBondContact O-N 2.88Å; A15-V18 PolarHBondContact O-N 3.43Å; A15-L19 WeakPolarHBondContact O-CG 3.49Å; A15-L19 PolarHBondContact O-N 3.09Å; A15-L19 VanDerWaalsContact O-N 3.09Å
16I98.4Very high96.6Very high14 Ų1449 Ų497%0.07229%0.292CS..Hα-helixtrans-62-44.8175.3-69.5169.6000110.6V12 E13 V18 L19 A20 I60 V275 H278 T279 V282V12-I16 HydrophobicContact CG1-CD1 3.94Å; V12-I16 WeakPolarHBondContact O-CG1 3.37Å; V12-I16 PolarHBondContact O-N 3.06Å; E13-I16 PolarHBondContact O-N 3.26Å; I16-V18 PolarHBondContact O-N 3.28Å; I16-L19 PolarHBondContact O-N 3.39Å; I16-A20 VanDerWaalsContact O-CB 3.31Å; I16-A20 WeakPolarHBondContact O-CB 3.31Å; I16-A20 PolarHBondContact O-N 3.16Å; I16-I60 HydrophobicContact CB-CD1 4.32Å; I16-I60 HydrophobicContact CG2-CD1 3.79Å; I16-V275 HydrophobicContact CD1-CG1 3.69Å; I16-H278 HydrophobicContact CG2-CB 4.02Å; I16-T279 WeakPolarHBondContact CD1-OG1 3.4Å; I16-V282 HydrophobicContact CB-CG2 4.49Å; I16-V282 HydrophobicContact CG2-CG2 3.77Å
17A98.5Very high97.3Very high7 Ų747.2 Ų47.26%0.05828%0.279CS..Hα-helixtrans-57.1-48.217800000112.2E13 L14 L19 A20 I21 I60E13-A17 PolarHBondContact O-N 3.01Å; L14-A17 PolarHBondContact O-N 3.2Å; A17-L19 PolarHBondContact O-N 3.39Å; A17-A20 PolarHBondContact O-N 3.11Å; A17-I21 WeakPolarHBondContact O-CD1 3.44Å; A17-I21 VanDerWaalsContact O-CG1 3.23Å; A17-I21 WeakPolarHBondContact O-CG1 3.47Å; A17-I21 PolarHBondContact O-N 3.04Å; A17-I60 HydrophobicContact CB-CB 4.19Å; A17-I60 HydrophobicContact CB-CD1 3.78Å; A17-I60 HydrophobicContact CB-CG2 3.97Å
18V98.5Very high97.6Very high83 Ų8345.8 Ų45.850%0.50327%0.269SS..Hα-helixtrans-61.4-46.1178.2172.70000111L14 A15 I16 I21 L22L14-V18 WeakPolarHBondContact O-CG2 3.36Å; L14-V18 PolarHBondContact O-N 3.17Å; L14-V18 VanDerWaalsContact O-N 3.09Å; A15-V18 PolarHBondContact O-N 3.43Å; I16-V18 PolarHBondContact O-N 3.28Å; V18-I21 PolarHBondContact O-N 2.93Å; V18-L22 HydrophobicContact CG1-CD1 3.77Å; V18-L22 HydrophobicContact CG1-CG 4.28Å; V18-L22 WeakPolarHBondContact O-CB 3.42Å; V18-L22 VanDerWaalsContact O-CG 3.28Å; V18-L22 WeakPolarHBondContact O-CG 3.38Å; V18-L22 PolarHBondContact O-N 2.92Å
19L98.3Very high97.8Very high89 Ų8945.2 Ų45.247%0.46626%0.257SS..Hα-helixtrans-65-39.8179.4-69173.9000112.4A15 I16 A17 G23 V282A15-L19 WeakPolarHBondContact O-CG 3.49Å; A15-L19 PolarHBondContact O-N 3.09Å; A15-L19 VanDerWaalsContact O-N 3.09Å; I16-L19 PolarHBondContact O-N 3.39Å; A17-L19 PolarHBondContact O-N 3.39Å; L19-G23 PolarHBondContact O-N 2.99Å; L19-V282 HydrophobicContact CB-CG1 3.79Å; L19-V282 HydrophobicContact CB-CG2 3.94Å; L19-V282 HydrophobicContact CD1-CG1 4.33Å
20A98.4Very high97.9Very high0 Ų044.6 Ų44.60%025%0.254CS..Hα-helixtrans-63.5-46.2177.300000111I16 A17 N24 V282I16-A20 VanDerWaalsContact O-CB 3.31Å; I16-A20 WeakPolarHBondContact O-CB 3.31Å; I16-A20 PolarHBondContact O-N 3.16Å; A17-A20 PolarHBondContact O-N 3.11Å; A20-N24 WeakPolarHBondContact O-CB 3.25Å; A20-N24 PolarHBondContact O-N 2.96Å; A20-N24 VanDerWaalsContact O-N 3.1Å; A20-N24 PolarHBondContact O-ND2 3.47Å; A20-V282 HydrophobicContact CB-CG2 4.03Å
21I98.6Very high98Very high50 Ų5042.8 Ų42.826%0.25625%0.245SC..Hα-helixtrans-62.6-55.1177.8-65.3164.7000110.3A17 V18 G23 N24 V25 V57A17-I21 WeakPolarHBondContact O-CD1 3.44Å; A17-I21 VanDerWaalsContact O-CG1 3.23Å; A17-I21 WeakPolarHBondContact O-CG1 3.47Å; A17-I21 PolarHBondContact O-N 3.04Å; V18-I21 PolarHBondContact O-N 2.93Å; I21-G23 PolarHBondContact O-N 3Å; I21-N24 PolarHBondContact O-N 3.4Å; I21-V25 HydrophobicContact CG2-CG2 4.2Å; I21-V25 VanDerWaalsContact O-CB 3.29Å; I21-V25 WeakPolarHBondContact O-CB 3.21Å; I21-V25 WeakPolarHBondContact O-CG2 3.46Å; I21-V25 PolarHBondContact O-N 3.5Å; I21-V57 HydrophobicContact CD1-CG2 3.78Å; I21-V57 HydrophobicContact CG1-CG2 3.94Å
22L97.8Very high98.1Very high116 Ų11647 Ų4761%0.60725%0.251SS*.Hα-helixtrans-61.5-45.2-175.4-68.6178.9000112V18 L26V18-L22 HydrophobicContact CG1-CD1 3.77Å; V18-L22 HydrophobicContact CG1-CG 4.28Å; V18-L22 WeakPolarHBondContact O-CB 3.42Å; V18-L22 VanDerWaalsContact O-CG 3.28Å; V18-L22 WeakPolarHBondContact O-CG 3.38Å; V18-L22 PolarHBondContact O-N 2.92Å; L22-L26 WeakPolarHBondContact O-CB 3.36Å; L22-L26 PolarHBondContact O-N 3.49Å; L22-L26 VanDerWaalsContact O-N 3.12Å
23G97.8Very high98Very high15 Ų1548.1 Ų48.116%0.15525%0.254CS..Hα-helixtrans-64.9-44.9-178.500000112.6L19 I21 L26 V27 P285L19-G23 PolarHBondContact O-N 2.99Å; I21-G23 PolarHBondContact O-N 3Å; G23-L26 WeakPolarHBondContact O-CB 3.47Å; G23-L26 PolarHBondContact O-N 3.5Å; G23-V27 WeakPolarHBondContact O-CG2 3.5Å; G23-V27 PolarHBondContact O-N 3.32Å; G23-V27 VanDerWaalsContact O-N 3.13Å; G23-P285 WeakPolarHBondContact O-CG 3.16Å
24N98.5Very high97.9Very high1 Ų149.6 Ų49.61%0.00526%0.262CS..Hα-helixtrans-80.7-29-176.7-70.1-68.5000113A20 I21 L26 V27 C28 A49 D52 I53 S281A20-N24 WeakPolarHBondContact O-CB 3.25Å; A20-N24 PolarHBondContact O-N 2.96Å; A20-N24 VanDerWaalsContact O-N 3.1Å; A20-N24 PolarHBondContact O-ND2 3.47Å; I21-N24 PolarHBondContact O-N 3.4Å; N24-L26 VanDerWaalsContact C-N 3.26Å; N24-L26 PolarHBondContact O-N 2.74Å; N24-V27 WeakPolarHBondContact O-CB 3.42Å; N24-V27 PolarHBondContact O-N 3.3Å; N24-C28 PolarHBondContact O-N 3.03Å; N24-C28 PolarHBondContact O-SG 3.31Å; N24-C28 VanDerWaalsContact O-SG 3.42Å; N24-A49 HydrophobicContact CB-CB 4.02Å; N24-D52 HydrophobicContact CB-CB 4.33Å; N24-D52 VanDerWaalsContact ND2-CB 3.33Å; N24-D52 WeakPolarHBondContact ND2-CB 3.32Å; N24-I53 HydrophobicContact CB-CD1 4.14Å; N24-I53 HydrophobicContact CB-CG1 3.58Å; N24-S281 PolarHBondContact ND2-O 2.78Å
25V98.3Very high97.8Very high65 Ų6549.3 Ų49.339%0.39427%0.268SS..Hα-helixtrans-59.4-41.4165.9168.40000110.1I21 V27 C28 W29 I53I21-V25 HydrophobicContact CG2-CG2 4.2Å; I21-V25 VanDerWaalsContact O-CB 3.29Å; I21-V25 WeakPolarHBondContact O-CB 3.21Å; I21-V25 WeakPolarHBondContact O-CG2 3.46Å; I21-V25 PolarHBondContact O-N 3.5Å; V25-V27 VanDerWaalsContact C-N 3.34Å; V25-V27 PolarHBondContact O-N 2.92Å; V25-C28 PolarHBondContact O-N 3.43Å; V25-W29 VanDerWaalsContact O-CB 3.3Å; V25-W29 WeakPolarHBondContact O-CB 3.21Å; V25-W29 PolarHBondContact O-N 2.86Å; V25-I53 HydrophobicContact CG2-CD1 3.86Å; V25-I53 HydrophobicContact CG2-CG1 4.25Å
26L97.7Very high97.7Very high33 Ų3352.4 Ų52.417%0.17328%0.277CS..Hα-helixtrans-63.7-37.8176.3-174.265.9000112.3L22 G23 N24 W29 A30 F299 I302 I303L22-L26 WeakPolarHBondContact O-CB 3.36Å; L22-L26 PolarHBondContact O-N 3.49Å; L22-L26 VanDerWaalsContact O-N 3.12Å; G23-L26 WeakPolarHBondContact O-CB 3.47Å; G23-L26 PolarHBondContact O-N 3.5Å; N24-L26 VanDerWaalsContact C-N 3.26Å; N24-L26 PolarHBondContact O-N 2.74Å; L26-W29 PolarHBondContact O-N 2.97Å; L26-A30 WeakPolarHBondContact O-CB 3.24Å; L26-A30 PolarHBondContact O-N 3.47Å; L26-F299 HydrophobicContact CD1-CD1 4.14Å; L26-F299 HydrophobicContact CD2-CB 4.19Å; L26-F299 HydrophobicContact CD2-CD1 3.86Å; L26-F299 HydrophobicContact CD2-CD2 4.18Å; L26-F299 HydrophobicContact CD2-CE1 4.23Å; L26-F299 HydrophobicContact CD2-CG 3.84Å; L26-F299 HydrophobicContact CG-CD1 3.59Å; L26-F299 HydrophobicContact CG-CE1 3.75Å; L26-F299 HydrophobicContact CG-CG 4.11Å; L26-F299 HydrophobicContact CG-CZ 4.39Å; L26-F299 WeakPolarHBondContact O-CE1 2.97Å; L26-I302 HydrophobicContact CD1-CB 4.05Å; L26-I302 HydrophobicContact CD1-CD1 3.95Å; L26-I302 HydrophobicContact CD1-CG2 3.65Å; L26-I303 HydrophobicContact CD2-CD1 4.39Å
27V98.2Very high97.5Very high0 Ų052 Ų520%028%0.275CS..Hα-helixtrans-59.6-53.4173.2172.80000110.6G23 N24 V25 W29 A30 V31 V45 A49 P285 Y288 F295 F299G23-V27 WeakPolarHBondContact O-CG2 3.5Å; G23-V27 PolarHBondContact O-N 3.32Å; G23-V27 VanDerWaalsContact O-N 3.13Å; N24-V27 WeakPolarHBondContact O-CB 3.42Å; N24-V27 PolarHBondContact O-N 3.3Å; V25-V27 VanDerWaalsContact C-N 3.34Å; V25-V27 PolarHBondContact O-N 2.92Å; V27-W29 VanDerWaalsContact C-N 3.32Å; V27-W29 PolarHBondContact O-N 3.02Å; V27-A30 PolarHBondContact O-N 3.36Å; V27-V31 PolarHBondContact O-N 3.36Å; V27-V31 VanDerWaalsContact O-N 3.14Å; V27-V45 HydrophobicContact CG1-CG1 3.83Å; V27-A49 HydrophobicContact CB-CB 4.23Å; V27-A49 HydrophobicContact CG1-CB 3.99Å; V27-P285 HydrophobicContact CG2-CB 4.06Å; V27-P285 HydrophobicContact CG2-CG 3.9Å; V27-Y288 HydrophobicContact CG1-CD2 4.44Å; V27-Y288 HydrophobicContact CG1-CE2 4.36Å; V27-Y288 HydrophobicContact CG2-CD2 3.84Å; V27-Y288 HydrophobicContact CG2-CE2 4.23Å; V27-F295 HydrophobicContact CG1-CE1 4.15Å; V27-F299 HydrophobicContact CG2-CZ 3.95Å
28C98.3Very high97.4Very high34 Ų3456.1 Ų56.123%0.2329%0.293CS..Hα-helixtrans-58.5-44.4178.2-67.20000111.6N24 V25 A30 V31 W32N24-C28 PolarHBondContact O-N 3.03Å; N24-C28 PolarHBondContact O-SG 3.31Å; N24-C28 VanDerWaalsContact O-SG 3.42Å; V25-C28 PolarHBondContact O-N 3.43Å; C28-A30 PolarHBondContact O-N 2.92Å; C28-V31 PolarHBondContact O-N 2.96Å; C28-W32 WeakPolarHBondContact O-CB 3.21Å; C28-W32 PolarHBondContact O-N 3.32Å
29W97.7Very high97.2Very high84 Ų8455.1 Ų55.132%0.31829%0.285SS..Hα-helixtrans-63.9-39.8179.7-165.34.8000112.2V25 L26 V27 W32 L33 I302 H306V25-W29 VanDerWaalsContact O-CB 3.3Å; V25-W29 WeakPolarHBondContact O-CB 3.21Å; V25-W29 PolarHBondContact O-N 2.86Å; L26-W29 PolarHBondContact O-N 2.97Å; V27-W29 VanDerWaalsContact C-N 3.32Å; V27-W29 PolarHBondContact O-N 3.02Å; W29-W32 AromaticContact CD1-CE3 3.95Å; W29-W32 PolarHBondContact O-N 3.26Å; W29-L33 HydrophobicContact CG-CD1 4.36Å; W29-L33 VanDerWaalsContact NE1-CD1 3.33Å; W29-L33 WeakPolarHBondContact O-CB 3.4Å; W29-L33 WeakPolarHBondContact O-CG 3.48Å; W29-L33 PolarHBondContact O-N 3.39Å; W29-I302 HydrophobicContact CB-CD1 4.35Å; W29-I302 HydrophobicContact CD2-CD1 4.4Å; W29-I302 HydrophobicContact CD2-CG2 4Å; W29-I302 HydrophobicContact CE3-CG2 3.65Å; W29-I302 HydrophobicContact CG-CD1 4.16Å; W29-I302 HydrophobicContact CH2-CG2 4.1Å; W29-I302 HydrophobicContact CZ2-CG2 4.42Å; W29-I302 HydrophobicContact CZ3-CG2 3.71Å; W29-H306 HydrophobicContact CH2-CB 3.75Å; W29-H306 AromaticContact CH2-CD2 4Å; W29-H306 AromaticContact CH2-CG 3.63Å; W29-H306 AromaticContact CH2-ND1 3.94Å; W29-H306 HydrophobicContact CZ2-CB 4.42Å; W29-H306 AromaticContact CZ2-CD2 3.89Å; W29-H306 AromaticContact CZ2-CE1 3.87Å; W29-H306 AromaticContact CZ2-CG 3.8Å; W29-H306 AromaticContact CZ2-ND1 3.78Å; W29-H306 AromaticContact CZ2-NE2 3.96Å
30A97.8Very high97.1Very high0 Ų051.7 Ų51.70%027%0.268CS..Hα-helixtrans-64.2-43.2176.700000112.8L26 V27 C28 W32 L33 N34 L37 F295 T298 F299 I302L26-A30 WeakPolarHBondContact O-CB 3.24Å; L26-A30 PolarHBondContact O-N 3.47Å; V27-A30 PolarHBondContact O-N 3.36Å; C28-A30 PolarHBondContact O-N 2.92Å; A30-W32 VanDerWaalsContact C-N 3.32Å; A30-L33 PolarHBondContact O-N 3.48Å; A30-N34 WeakPolarHBondContact O-CB 3.27Å; A30-N34 PolarHBondContact O-N 2.92Å; A30-L37 HydrophobicContact CB-CD1 4.11Å; A30-F295 HydrophobicContact CB-CD1 4.1Å; A30-F295 HydrophobicContact CB-CE1 4.25Å; A30-T298 HydrophobicContact CB-CG2 3.71Å; A30-F299 HydrophobicContact CB-CD1 3.75Å; A30-F299 HydrophobicContact CB-CE1 3.49Å; A30-F299 VanDerWaalsContact CB-CE1 3.49Å; A30-I302 HydrophobicContact CB-CD1 4.09Å
31V97.8Very high97Very high9 Ų952.1 Ų52.16%0.05527%0.27CS..Hα-helixtrans-65.7-38.1176.3178.30000110.8V27 C28 L37 Q38 N42 V46 F295V27-V31 PolarHBondContact O-N 3.36Å; V27-V31 VanDerWaalsContact O-N 3.14Å; C28-V31 PolarHBondContact O-N 2.96Å; V31-L37 HydrophobicContact CG2-CB 4.33Å; V31-Q38 WeakPolarHBondContact O-CG 3.27Å; V31-Q38 PolarHBondContact O-NE2 3.46Å; V31-N42 HydrophobicContact CG1-CB 4.35Å; V31-N42 HydrophobicContact CG2-CB 4.31Å; V31-V46 HydrophobicContact CB-CG2 3.85Å; V31-V46 HydrophobicContact CG1-CG2 3.83Å; V31-V46 HydrophobicContact CG2-CG2 3.89Å; V31-F295 HydrophobicContact CG2-CE1 3.81Å; V31-F295 HydrophobicContact CG2-CZ 3.72Å
32W97.4Very high96.9Very high184 Ų18450.3 Ų50.370%0.69726%0.261SS*.Hα-helixtrans-64.8-42.9176.8-175.874.1000112.6C28 W29 A30 Q38C28-W32 WeakPolarHBondContact O-CB 3.21Å; C28-W32 PolarHBondContact O-N 3.32Å; W29-W32 AromaticContact CD1-CE3 3.95Å; W29-W32 PolarHBondContact O-N 3.26Å; A30-W32 VanDerWaalsContact C-N 3.32Å; W32-Q38 PolarHBondContact O-NE2 2.99Å
33L96.3Very high96.9Very high81 Ų8148.2 Ų48.242%0.42425%0.245SC..Hα-helixtrans-78.6-35.3-176.9-74.9178.1000114.9W29 A30 I302W29-L33 HydrophobicContact CG-CD1 4.36Å; W29-L33 VanDerWaalsContact NE1-CD1 3.33Å; W29-L33 WeakPolarHBondContact O-CB 3.4Å; W29-L33 WeakPolarHBondContact O-CG 3.48Å; W29-L33 PolarHBondContact O-N 3.39Å; A30-L33 PolarHBondContact O-N 3.48Å; L33-I302 HydrophobicContact CD1-CD1 3.95Å; L33-I302 HydrophobicContact CD1-CG1 3.71Å
34N96.1Very high96.9Very high31 Ų3148 Ų4817%0.16624%0.24CC..  trans-104.6109.5-171-171.5-9000111.1A30 N36 L37 T298A30-N34 WeakPolarHBondContact O-CB 3.27Å; A30-N34 PolarHBondContact O-N 2.92Å; N34-N36 PolarHBondContact O-N 3.27Å; N34-N36 VanDerWaalsContact O-N 3.13Å; N34-N36 VanDerWaalsContact OD1-CB 3.29Å; N34-N36 WeakPolarHBondContact OD1-CB 3.47Å; N34-N36 PolarHBondContact OD1-N 2.91Å; N34-N36 PolarHBondContact OD1-ND2 2.93Å; N34-L37 HydrophobicContact CB-CB 4.36Å; N34-L37 HydrophobicContact CB-CD1 4.05Å; N34-L37 HydrophobicContact CB-CG 4.13Å; N34-L37 WeakPolarHBondContact O-CA 3.3Å; N34-L37 WeakPolarHBondContact O-CB 3.47Å; N34-L37 PolarHBondContact O-N 3.18Å; N34-T298 HydrophobicContact CB-CG2 3.98Å; N34-T298 PolarHBondContact ND2-OG1 2.97Å
35S95.7Very high96.8Very high86 Ų8648 Ų4860%0.60124%0.24SC*.G310 helixtrans-57.6-27.217756.80000113.5L37 Q38S35-L37 PolarHBondContact O-N 3.48Å; S35-Q38 PolarHBondContact O-N 3.46Å; S35-Q38 VanDerWaalsContact O-N 3.11Å
36N95Very high96.8Very high119 Ų11947 Ų4764%0.63623%0.234SC*.G310 helixtrans-67.8-21.1174.7-57.7-65.2000112.9N34N34-N36 PolarHBondContact O-N 3.27Å; N34-N36 VanDerWaalsContact O-N 3.13Å; N34-N36 VanDerWaalsContact OD1-CB 3.29Å; N34-N36 WeakPolarHBondContact OD1-CB 3.47Å; N34-N36 PolarHBondContact OD1-N 2.91Å; N34-N36 PolarHBondContact OD1-ND2 2.93Å
37L95.7Very high96.9Very high4 Ų445.8 Ų45.82%0.02123%0.228CC..G310 helixtrans-92-6.3174.8-65.5177.8000112.3A30 V31 N34 S35 N39 N42 E294 F295A30-L37 HydrophobicContact CB-CD1 4.11Å; V31-L37 HydrophobicContact CG2-CB 4.33Å; N34-L37 HydrophobicContact CB-CB 4.36Å; N34-L37 HydrophobicContact CB-CD1 4.05Å; N34-L37 HydrophobicContact CB-CG 4.13Å; N34-L37 WeakPolarHBondContact O-CA 3.3Å; N34-L37 WeakPolarHBondContact O-CB 3.47Å; N34-L37 PolarHBondContact O-N 3.18Å; S35-L37 PolarHBondContact O-N 3.48Å; L37-N39 PolarHBondContact O-N 2.94Å; L37-N42 WeakPolarHBondContact CA-ND2 3.42Å; L37-N42 WeakPolarHBondContact O-CB 3.29Å; L37-N42 PolarHBondContact O-ND2 2.87Å; L37-E294 HydrophobicContact CD2-CB 3.67Å; L37-E294 HydrophobicContact CG-CB 4.39Å; L37-F295 HydrophobicContact CD1-CD1 3.9Å; L37-F295 HydrophobicContact CD1-CD2 4.49Å; L37-F295 HydrophobicContact CD1-CE1 3.95Å; L37-F295 HydrophobicContact CD1-CG 4.18Å; L37-F295 HydrophobicContact CD1-CZ 4.28Å; L37-F295 HydrophobicContact CD2-CD2 3.82Å; L37-F295 HydrophobicContact CD2-CE2 3.8Å; L37-F295 HydrophobicContact CD2-CG 4.26Å; L37-F295 HydrophobicContact CD2-CZ 4.22Å
38Q95.9Very high96.9Very high94 Ų9445.9 Ų45.944%0.43923%0.229SC..  trans-85.461.5-178.7-65.2177.9-3.400111.7V31 W32 S35V31-Q38 WeakPolarHBondContact O-CG 3.27Å; V31-Q38 PolarHBondContact O-NE2 3.46Å; W32-Q38 PolarHBondContact O-NE2 2.99Å; S35-Q38 PolarHBondContact O-N 3.46Å; S35-Q38 VanDerWaalsContact O-N 3.11Å
39N94.7Very high96.9Very high62 Ų6244.3 Ų44.333%0.33222%0.219SC..SBendtrans-113.9167.3174.862.957.5000111.2L37 T41 N42 Y43L37-N39 PolarHBondContact O-N 2.94Å; N39-T41 PolarHBondContact O-N 3.42Å; N39-T41 WeakPolarHBondContact OD1-CB 3.32Å; N39-T41 PolarHBondContact OD1-N 2.9Å; N39-N42 PolarHBondContact ND2-ND2 2.89Å; N39-N42 PolarHBondContact O-N 2.8Å; N39-N42 VanDerWaalsContact O-N 3.09Å; N39-N42 PolarHBondContact OD1-N 2.99Å; N39-N42 PolarHBondContact OD1-ND2 3.08Å; N39-Y43 PolarHBondContact O-N 3.06Å
40V95.8Very high96.9Very high18 Ų1842.3 Ų42.311%0.10922%0.22CC..Hα-helixtrans-60.4-42-173.6176.40000112.8N42 Y43 F44 V116 A121V40-N42 PolarHBondContact O-N 2.66Å; V40-Y43 WeakPolarHBondContact O-CB 3.44Å; V40-Y43 PolarHBondContact O-N 3.46Å; V40-F44 HydrophobicContact CG1-CE2 3.9Å; V40-F44 WeakPolarHBondContact O-CD2 3.39Å; V40-V116 HydrophobicContact CB-CG1 3.87Å; V40-V116 HydrophobicContact CG1-CG1 3.35Å; V40-V116 HydrophobicContact CG2-CG1 4.17Å; V40-A121 HydrophobicContact CG1-CB 3.52Å
41T95.3Very high96.9Very high8 Ų842.3 Ų42.35%0.04922%0.22CC..Hα-helixtrans-54.5-43.7175.7-43.60000111.3N39 Y43 F44 V45 I98 D101 R102 L235N39-T41 PolarHBondContact O-N 3.42Å; N39-T41 WeakPolarHBondContact OD1-CB 3.32Å; N39-T41 PolarHBondContact OD1-N 2.9Å; T41-Y43 VanDerWaalsContact C-N 3.27Å; T41-Y43 PolarHBondContact O-N 3.45Å; T41-F44 PolarHBondContact O-N 2.9Å; T41-F44 VanDerWaalsContact O-N 3.16Å; T41-V45 PolarHBondContact O-N 3.26Å; T41-V45 VanDerWaalsContact O-N 3.12Å; T41-I98 HydrophobicContact CG2-CG2 4.46Å; T41-D101 WeakPolarHBondContact CB-OD2 3.44Å; T41-D101 WeakPolarHBondContact CG2-OD2 3.33Å; T41-D101 PolarHBondContact OG1-OD2 3.22Å; T41-R102 VanDerWaalsContact OG1-CZ 3.24Å; T41-R102 PolarHBondContact OG1-NE 3.13Å; T41-R102 PolarHBondContact OG1-NH2 3.48Å; T41-L235 HydrophobicContact CG2-CD1 4.31Å
42N96.9Very high97Very high13 Ų1342 Ų427%0.0722%0.218CC..Hα-helixtrans-73.5-16.4-177.9-72.7-21.5000113.3V31 L37 N39 V40 V45 V46V31-N42 HydrophobicContact CG1-CB 4.35Å; V31-N42 HydrophobicContact CG2-CB 4.31Å; L37-N42 WeakPolarHBondContact CA-ND2 3.42Å; L37-N42 WeakPolarHBondContact O-CB 3.29Å; L37-N42 PolarHBondContact O-ND2 2.87Å; N39-N42 PolarHBondContact ND2-ND2 2.89Å; N39-N42 PolarHBondContact O-N 2.8Å; N39-N42 VanDerWaalsContact O-N 3.09Å; N39-N42 PolarHBondContact OD1-N 2.99Å; N39-N42 PolarHBondContact OD1-ND2 3.08Å; V40-N42 PolarHBondContact O-N 2.66Å; N42-V45 PolarHBondContact O-N 3.13Å; N42-V46 VanDerWaalsContact O-CG2 3.28Å; N42-V46 WeakPolarHBondContact O-CG2 3.4Å; N42-V46 PolarHBondContact O-N 3.11Å
43Y98Very high97Very high71 Ų7134.9 Ų34.928%0.27819%0.193SC..Hα-helixtrans-66.3-39.9168.1-66.1-8000111.3N39 V40 T41 V46 S47 A121N39-Y43 PolarHBondContact O-N 3.06Å; V40-Y43 WeakPolarHBondContact O-CB 3.44Å; V40-Y43 PolarHBondContact O-N 3.46Å; T41-Y43 VanDerWaalsContact C-N 3.27Å; T41-Y43 PolarHBondContact O-N 3.45Å; Y43-V46 PolarHBondContact O-N 3.47Å; Y43-S47 PolarHBondContact O-N 2.9Å; Y43-A121 HydrophobicContact CD2-CB 4.21Å
44F97.8Very high97.1Very high10 Ų1032 Ų324%0.04418%0.181CC..Hα-helixtrans-70.3-35.1173.1-59-65.9000112.1V40 T41 V46 S47 L48 A97 I98 A121 I124 I125V40-F44 HydrophobicContact CG1-CE2 3.9Å; V40-F44 WeakPolarHBondContact O-CD2 3.39Å; T41-F44 PolarHBondContact O-N 2.9Å; T41-F44 VanDerWaalsContact O-N 3.16Å; F44-V46 VanDerWaalsContact C-N 3.33Å; F44-V46 PolarHBondContact O-N 3.01Å; F44-S47 WeakPolarHBondContact O-CB 3.47Å; F44-S47 PolarHBondContact O-N 2.87Å; F44-L48 PolarHBondContact O-N 2.98Å; F44-A97 HydrophobicContact CD1-CB 3.58Å; F44-A97 HydrophobicContact CD2-CB 4.32Å; F44-A97 HydrophobicContact CE1-CB 3.61Å; F44-A97 HydrophobicContact CE2-CB 4.34Å; F44-A97 HydrophobicContact CG-CB 3.96Å; F44-A97 HydrophobicContact CZ-CB 4Å; F44-I98 HydrophobicContact CB-CD1 4.12Å; F44-I98 HydrophobicContact CB-CG1 3.55Å; F44-I98 HydrophobicContact CG-CG1 4.45Å; F44-A121 HydrophobicContact CE2-CB 4.24Å; F44-A121 HydrophobicContact CZ-CB 3.9Å; F44-I124 HydrophobicContact CE1-CB 4.26Å; F44-I124 HydrophobicContact CE1-CG2 3.91Å; F44-I124 HydrophobicContact CZ-CG2 4.35Å; F44-I125 HydrophobicContact CD1-CD1 4Å; F44-I125 HydrophobicContact CD1-CG1 3.64Å; F44-I125 HydrophobicContact CE1-CD1 4.26Å; F44-I125 HydrophobicContact CE1-CG1 3.74Å
45V97.4Very high97.2Very high1 Ų130.9 Ų30.91%0.00618%0.175CC..Hα-helixtrans-61.7-40.6172173.10000111.4V27 T41 N42 L48 A49 I98 Y288 F295V27-V45 HydrophobicContact CG1-CG1 3.83Å; T41-V45 PolarHBondContact O-N 3.26Å; T41-V45 VanDerWaalsContact O-N 3.12Å; N42-V45 PolarHBondContact O-N 3.13Å; V45-L48 PolarHBondContact O-N 3.48Å; V45-A49 WeakPolarHBondContact O-CB 3.44Å; V45-A49 PolarHBondContact O-N 3.3Å; V45-I98 HydrophobicContact CG2-CD1 4.04Å; V45-Y288 HydrophobicContact CG1-CE1 4.32Å; V45-Y288 HydrophobicContact CG1-CE2 3.79Å; V45-F295 HydrophobicContact CG1-CZ 4.38Å
46V98.3Very high97.3Very high44 Ų4427 Ų2727%0.26715%0.149SC..Hα-helixtrans-66.6-39.3174.6169.80000111.2V31 N42 Y43 F44 A49 A50V31-V46 HydrophobicContact CB-CG2 3.85Å; V31-V46 HydrophobicContact CG1-CG2 3.83Å; V31-V46 HydrophobicContact CG2-CG2 3.89Å; N42-V46 VanDerWaalsContact O-CG2 3.28Å; N42-V46 WeakPolarHBondContact O-CG2 3.4Å; N42-V46 PolarHBondContact O-N 3.11Å; Y43-V46 PolarHBondContact O-N 3.47Å; F44-V46 VanDerWaalsContact C-N 3.33Å; F44-V46 PolarHBondContact O-N 3.01Å; V46-A49 PolarHBondContact O-N 3.43Å; V46-A50 WeakPolarHBondContact O-CB 3.5Å; V46-A50 PolarHBondContact O-N 3.22Å
47S98.4Very high97.5Very high8 Ų825 Ų256%0.05614%0.141CC..Hα-helixtrans-60.3-44.3173.6-174.70000112Y43 F44 A50 A51 S94 W129Y43-S47 PolarHBondContact O-N 2.9Å; F44-S47 WeakPolarHBondContact O-CB 3.47Å; F44-S47 PolarHBondContact O-N 2.87Å; S47-A50 PolarHBondContact O-N 3.06Å; S47-A51 PolarHBondContact O-N 3.03Å; S47-A51 VanDerWaalsContact O-N 3.12Å; S47-S94 PolarHBondContact OG-OG 2.8Å; S47-W129 PolarHBondContact OG-NE1 3.4Å; S47-W129 VanDerWaalsContact OG-NE1 3.12Å
48L98Very high97.6Very high2 Ų227.9 Ų27.91%0.0116%0.156CC..Hα-helixtrans-61.4-47.7174.6-179.864000111.4F44 V45 A50 A51 D52 L95F44-L48 PolarHBondContact O-N 2.98Å; V45-L48 PolarHBondContact O-N 3.48Å; L48-A50 VanDerWaalsContact C-N 3.27Å; L48-A50 PolarHBondContact O-N 3.49Å; L48-A51 WeakPolarHBondContact O-CB 3.46Å; L48-A51 PolarHBondContact O-N 3.32Å; L48-A51 VanDerWaalsContact O-N 3.1Å; L48-D52 PolarHBondContact O-N 2.96Å; L48-L95 HydrophobicContact CD1-CG 4.46Å; L48-L95 HydrophobicContact CD2-CD2 3.79Å; L48-L95 HydrophobicContact CD2-CG 4.43Å
49A98.5Very high97.7Very high2 Ų223.5 Ų23.52%0.01714%0.136CC..Hα-helixtrans-60.2-36.1176.800000112.2N24 V27 V45 V46 D52 I53N24-A49 HydrophobicContact CB-CB 4.02Å; V27-A49 HydrophobicContact CB-CB 4.23Å; V27-A49 HydrophobicContact CG1-CB 3.99Å; V45-A49 WeakPolarHBondContact O-CB 3.44Å; V45-A49 PolarHBondContact O-N 3.3Å; V46-A49 PolarHBondContact O-N 3.43Å; A49-D52 PolarHBondContact O-N 2.91Å; A49-I53 VanDerWaalsContact O-CG1 3.22Å; A49-I53 WeakPolarHBondContact O-CG1 3.36Å; A49-I53 PolarHBondContact O-N 3.24Å
50A98.6Very high97.8Very high42 Ų4220.5 Ų20.535%0.34712%0.12SC..Hα-helixtrans-65.4-39.7174.700000112.4V46 S47 L48 I53 A54 W129V46-A50 WeakPolarHBondContact O-CB 3.5Å; V46-A50 PolarHBondContact O-N 3.22Å; S47-A50 PolarHBondContact O-N 3.06Å; L48-A50 VanDerWaalsContact C-N 3.27Å; L48-A50 PolarHBondContact O-N 3.49Å; A50-I53 PolarHBondContact O-N 3.27Å; A50-A54 PolarHBondContact O-N 3.21Å; A50-W129 HydrophobicContact CB-CZ2 4.48Å
51A98.4Very high97.9Very high0 Ų021.9 Ų21.90%013%0.129CC..Hα-helixtrans-63.2-44.7172.600000111.3S47 L48 I53 A54 V55 W129S47-A51 PolarHBondContact O-N 3.03Å; S47-A51 VanDerWaalsContact O-N 3.12Å; L48-A51 WeakPolarHBondContact O-CB 3.46Å; L48-A51 PolarHBondContact O-N 3.32Å; L48-A51 VanDerWaalsContact O-N 3.1Å; A51-I53 PolarHBondContact O-N 3.42Å; A51-A54 CarbonylContact O-C 3.58Å; A51-A54 WeakPolarHBondContact O-CB 3.29Å; A51-A54 PolarHBondContact O-N 2.8Å; A51-A54 VanDerWaalsContact O-N 3.13Å; A51-V55 WeakPolarHBondContact O-CG2 3.28Å; A51-V55 PolarHBondContact O-N 3.02Å; A51-W129 HydrophobicContact CB-CH2 4.06Å; A51-W129 HydrophobicContact CB-CZ2 4.23Å
52D98.3Very high98Very high1 Ų123.9 Ų23.91%0.00514%0.137CC..Hα-helixtrans-65.7-34.3177.9-72-33.9000113.3N24 L48 A49 V55 G56 S281 N284N24-D52 HydrophobicContact CB-CB 4.33Å; N24-D52 VanDerWaalsContact ND2-CB 3.33Å; N24-D52 WeakPolarHBondContact ND2-CB 3.32Å; L48-D52 PolarHBondContact O-N 2.96Å; A49-D52 PolarHBondContact O-N 2.91Å; D52-V55 WeakPolarHBondContact O-CB 3.31Å; D52-V55 PolarHBondContact O-N 2.81Å; D52-G56 PolarHBondContact O-N 3.42Å; D52-S281 VanDerWaalsContact OD1-CA 3.3Å; D52-S281 WeakPolarHBondContact OD1-CA 3.46Å; D52-S281 VanDerWaalsContact OD1-CB 3.23Å; D52-S281 WeakPolarHBondContact OD1-CB 3.39Å; D52-S281 PolarHBondContact OD1-OG 3.38Å; D52-N284 PolarHBondContact OD2-ND2 2.98Å
53I98.7Very high98Very high36 Ų3624.3 Ų24.319%0.18514%0.142CC..Hα-helixtrans-63.5-46.4170.3-69163.7000109.7N24 V25 A49 A50 A51 V55 G56 V57N24-I53 HydrophobicContact CB-CD1 4.14Å; N24-I53 HydrophobicContact CB-CG1 3.58Å; V25-I53 HydrophobicContact CG2-CD1 3.86Å; V25-I53 HydrophobicContact CG2-CG1 4.25Å; A49-I53 VanDerWaalsContact O-CG1 3.22Å; A49-I53 WeakPolarHBondContact O-CG1 3.36Å; A49-I53 PolarHBondContact O-N 3.24Å; A50-I53 PolarHBondContact O-N 3.27Å; A51-I53 PolarHBondContact O-N 3.42Å; I53-V55 PolarHBondContact O-N 3.26Å; I53-G56 PolarHBondContact O-N 3.46Å; I53-G56 VanDerWaalsContact O-N 3.12Å; I53-V57 HydrophobicContact CG2-CG2 4.02Å; I53-V57 WeakPolarHBondContact O-CG2 3.33Å; I53-V57 PolarHBondContact O-N 2.9Å
54A98.4Very high97.9Very high20 Ų2022.1 Ų22.117%0.16514%0.135CC..Hα-helixtrans-63.3-2817800000112.3A50 A51 L58 A59 L87A50-A54 PolarHBondContact O-N 3.21Å; A51-A54 CarbonylContact O-C 3.58Å; A51-A54 WeakPolarHBondContact O-CB 3.29Å; A51-A54 PolarHBondContact O-N 2.8Å; A51-A54 VanDerWaalsContact O-N 3.13Å; A54-L58 WeakPolarHBondContact O-CA 3.4Å; A54-L58 WeakPolarHBondContact O-CB 3.4Å; A54-L58 PolarHBondContact O-N 3.34Å; A54-A59 PolarHBondContact O-N 2.93Å; A54-L87 VanDerWaalsContact C-CD1 3.45Å; A54-L87 HydrophobicContact CB-CD1 3.74Å; A54-L87 HydrophobicContact CB-CD2 3.67Å; A54-L87 HydrophobicContact CB-CG 4.38Å
55V98.4Very high97.8Very high7 Ų724.2 Ų24.24%0.04215%0.149CC..Iπ-helixtrans-61.8-50171.5169.90000110.1A51 D52 I53 A59 I60 L87A51-V55 WeakPolarHBondContact O-CG2 3.28Å; A51-V55 PolarHBondContact O-N 3.02Å; D52-V55 WeakPolarHBondContact O-CB 3.31Å; D52-V55 PolarHBondContact O-N 2.81Å; I53-V55 PolarHBondContact O-N 3.26Å; V55-A59 HydrophobicContact CB-CB 4.42Å; V55-A59 HydrophobicContact CG1-CB 4.35Å; V55-A59 PolarHBondContact O-N 3.35Å; V55-A59 VanDerWaalsContact O-N 3.11Å; V55-I60 HydrophobicContact CG1-CD1 4.14Å; V55-I60 HydrophobicContact CG1-CG1 4.07Å; V55-I60 PolarHBondContact O-N 2.84Å; V55-L87 HydrophobicContact CB-CD1 4.37Å; V55-L87 HydrophobicContact CG2-CB 4.08Å; V55-L87 HydrophobicContact CG2-CD1 3.69Å
56G97.8Very high97.6Very high4 Ų424.9 Ų24.94%0.04115%0.152CC..Iπ-helixtrans-67.1-37.7178.400000114.2D52 I53D52-G56 PolarHBondContact O-N 3.42Å; I53-G56 PolarHBondContact O-N 3.46Å; I53-G56 VanDerWaalsContact O-N 3.12Å
57V98.5Very high97.4Very high78 Ų7824 Ų2447%0.47315%0.148SC..Iπ-helixtrans-79.6-35-176.8176.90000112.8I21 I53I21-V57 HydrophobicContact CD1-CG2 3.78Å; I21-V57 HydrophobicContact CG1-CG2 3.94Å; I53-V57 HydrophobicContact CG2-CG2 4.02Å; I53-V57 WeakPolarHBondContact O-CG2 3.33Å; I53-V57 PolarHBondContact O-N 2.9Å
58L97.8Very high97.1Very high64 Ų6427.3 Ų27.334%0.33517%0.168SC..Iπ-helixtrans-123.8-55.5-170.7-60.4174.5000112.6A54 I60 P61 F62 F83A54-L58 WeakPolarHBondContact O-CA 3.4Å; A54-L58 WeakPolarHBondContact O-CB 3.4Å; A54-L58 PolarHBondContact O-N 3.34Å; L58-I60 PolarHBondContact O-N 3.07Å; L58-P61 WeakPolarHBondContact O-CD 3.43Å; L58-F62 HydrophobicContact CB-CE2 4.35Å; L58-F62 VanDerWaalsContact O-CB 3.3Å; L58-F62 WeakPolarHBondContact O-CB 3.39Å; L58-F62 WeakPolarHBondContact O-CD1 3.42Å; L58-F62 WeakPolarHBondContact O-CG 3.49Å; L58-F62 PolarHBondContact O-N 3.14Å; L58-F83 HydrophobicContact CB-CD1 4.12Å; L58-F83 HydrophobicContact CB-CE1 3.64Å; L58-F83 HydrophobicContact CD1-CE1 3.48Å; L58-F83 VanDerWaalsContact CD1-CE1 3.48Å; L58-F83 HydrophobicContact CD1-CZ 3.54Å; L58-F83 HydrophobicContact CG-CE1 4.21Å
59A97.5Very high96.8Very high2 Ų227.3 Ų27.32%0.01717%0.169CC..Iπ-helixtrans-66.2-41.3-17000000113.5A54 V55 F62 A63 V84 L87A54-A59 PolarHBondContact O-N 2.93Å; V55-A59 HydrophobicContact CB-CB 4.42Å; V55-A59 HydrophobicContact CG1-CB 4.35Å; V55-A59 PolarHBondContact O-N 3.35Å; V55-A59 VanDerWaalsContact O-N 3.11Å; A59-F62 WeakPolarHBondContact O-CB 3.47Å; A59-F62 PolarHBondContact O-N 3.42Å; A59-A63 WeakPolarHBondContact O-CB 3.26Å; A59-A63 PolarHBondContact O-N 3.38Å; A59-V84 HydrophobicContact CB-CB 4.1Å; A59-V84 HydrophobicContact CB-CG2 4.02Å; A59-L87 HydrophobicContact CB-CD1 3.94Å
60I97.7Very high96.5Very high0 Ų030.4 Ų30.40%018%0.182CC..Hα-helixtrans-66-49.4177.4-70.3174.4000111.3E13 I16 A17 V55 L58 F62 A63 I64 H278E13-I60 HydrophobicContact CB-CG2 3.85Å; E13-I60 WeakPolarHBondContact OE2-CG2 3.34Å; I16-I60 HydrophobicContact CB-CD1 4.32Å; I16-I60 HydrophobicContact CG2-CD1 3.79Å; A17-I60 HydrophobicContact CB-CB 4.19Å; A17-I60 HydrophobicContact CB-CD1 3.78Å; A17-I60 HydrophobicContact CB-CG2 3.97Å; V55-I60 HydrophobicContact CG1-CD1 4.14Å; V55-I60 HydrophobicContact CG1-CG1 4.07Å; V55-I60 PolarHBondContact O-N 2.84Å; L58-I60 PolarHBondContact O-N 3.07Å; I60-F62 PolarHBondContact O-N 3.09Å; I60-A63 PolarHBondContact O-N 3.1Å; I60-A63 VanDerWaalsContact O-N 3.16Å; I60-I64 HydrophobicContact CG2-CD1 3.94Å; I60-I64 HydrophobicContact CG2-CG1 4.5Å; I60-I64 WeakPolarHBondContact O-CG1 3.44Å; I60-I64 PolarHBondContact O-N 3.24Å; I60-H278 HydrophobicContact CD1-CB 4.14Å; I60-H278 HydrophobicContact CG1-CB 4.28Å
61P97.6Very high96.3Very high47 Ų4730.3 Ų30.331%0.30518%0.178SC..Hα-helixtrans-54.2-39.8170.8-30.737.1000113.6L58 T65L58-P61 WeakPolarHBondContact O-CD 3.43Å; P61-T65 WeakPolarHBondContact O-CB 3.47Å; P61-T65 PolarHBondContact O-N 3.46Å; P61-T65 PolarHBondContact O-OG1 3.31Å
62F97.5Very high96.2Very high50 Ų5030.9 Ų30.922%0.21918%0.183CC..Hα-helixtrans-65.8-42.5175.6-73.3-3.4000112.8L58 A59 I60 T65 I66 F79 I80 F83L58-F62 HydrophobicContact CB-CE2 4.35Å; L58-F62 VanDerWaalsContact O-CB 3.3Å; L58-F62 WeakPolarHBondContact O-CB 3.39Å; L58-F62 WeakPolarHBondContact O-CD1 3.42Å; L58-F62 WeakPolarHBondContact O-CG 3.49Å; L58-F62 PolarHBondContact O-N 3.14Å; A59-F62 WeakPolarHBondContact O-CB 3.47Å; A59-F62 PolarHBondContact O-N 3.42Å; I60-F62 PolarHBondContact O-N 3.09Å; F62-T65 PolarHBondContact O-N 3.41Å; F62-I66 WeakPolarHBondContact O-CG1 3.39Å; F62-I66 PolarHBondContact O-N 2.94Å; F62-F79 HydrophobicContact CE2-CE1 4.42Å; F62-I80 HydrophobicContact CB-CG2 3.48Å; F62-I80 VanDerWaalsContact CB-CG2 3.48Å; F62-I80 HydrophobicContact CD1-CG2 4.03Å; F62-I80 HydrophobicContact CD2-CG2 4.11Å; F62-I80 HydrophobicContact CG-CB 4.5Å; F62-I80 HydrophobicContact CG-CG2 3.62Å; F62-F83 HydrophobicContact CD2-CB 4.02Å; F62-F83 HydrophobicContact CD2-CD1 4.09Å; F62-F83 HydrophobicContact CD2-CG 4.28Å; F62-F83 HydrophobicContact CE2-CB 4.11Å; F62-F83 AromaticContact CE2-CD1 3.97Å; F62-F83 HydrophobicContact CE2-CD1 3.97Å; F62-F83 HydrophobicContact CE2-CG 4.04Å
63A96.2Very high96Very high21 Ų2133.7 Ų33.717%0.17421%0.206CC..Hα-helixtrans-64.2-41.417600000112A59 I60 T65 S67A59-A63 WeakPolarHBondContact O-CB 3.26Å; A59-A63 PolarHBondContact O-N 3.38Å; I60-A63 PolarHBondContact O-N 3.1Å; I60-A63 VanDerWaalsContact O-N 3.16Å; A63-T65 VanDerWaalsContact C-N 3.34Å; A63-S67 WeakPolarHBondContact O-CB 3.5Å; A63-S67 PolarHBondContact O-N 3.11Å
64I96.1Very high95.8Very high25 Ų2532.7 Ų32.713%0.12820%0.202CC..Hα-helixtrans-60-47.3172.2-68.5165000109.8I10 E13 L14 I60 I66 S67I10-I64 HydrophobicContact CD1-CG2 4.34Å; I10-I64 HydrophobicContact CG1-CG2 3.99Å; I10-I64 HydrophobicContact CG2-CD1 4.37Å; I10-I64 HydrophobicContact CG2-CG2 4.4Å; E13-I64 HydrophobicContact CB-CD1 3.94Å; E13-I64 HydrophobicContact CB-CG1 4.07Å; E13-I64 HydrophobicContact CG-CG1 4.46Å; L14-I64 HydrophobicContact CD2-CD1 4Å; L14-I64 HydrophobicContact CG-CD1 4.13Å; I60-I64 HydrophobicContact CG2-CD1 3.94Å; I60-I64 HydrophobicContact CG2-CG1 4.5Å; I60-I64 WeakPolarHBondContact O-CG1 3.44Å; I60-I64 PolarHBondContact O-N 3.24Å; I64-I66 PolarHBondContact O-N 2.97Å; I64-S67 WeakPolarHBondContact O-CB 3.43Å; I64-S67 PolarHBondContact O-N 3.22Å; I64-S67 PolarHBondContact O-OG 3.35Å
65T95.2Very high95.6Very high54 Ų5437 Ų3733%0.33122%0.218SC..Hα-helixtrans-61.9-47.1-178.9-54.50000111.5P61 F62 A63 S67 T68 F70P61-T65 WeakPolarHBondContact O-CB 3.47Å; P61-T65 PolarHBondContact O-N 3.46Å; P61-T65 PolarHBondContact O-OG1 3.31Å; F62-T65 PolarHBondContact O-N 3.41Å; A63-T65 VanDerWaalsContact C-N 3.34Å; T65-S67 VanDerWaalsContact C-N 3.28Å; T65-S67 PolarHBondContact O-N 3.05Å; T65-T68 WeakPolarHBondContact O-CB 3.41Å; T65-T68 PolarHBondContact O-N 3.21Å; T65-T68 PolarHBondContact O-OG1 3.46Å; T65-F70 HydrophobicContact CG2-CD1 3.82Å; T65-F70 HydrophobicContact CG2-CE1 3.5Å; T65-F70 VanDerWaalsContact CG2-CE1 3.5Å; T65-F70 HydrophobicContact CG2-CZ 3.95Å
66I94.5Very high95.5Very high15 Ų1538.4 Ų38.48%0.07724%0.235CC..Hα-helixtrans-61.7-35176.5-71.3172.3000111.8F62 I64 T68 G69 I80 A81 C166 F168F62-I66 WeakPolarHBondContact O-CG1 3.39Å; F62-I66 PolarHBondContact O-N 2.94Å; I64-I66 PolarHBondContact O-N 2.97Å; I66-T68 PolarHBondContact O-N 2.75Å; I66-G69 PolarHBondContact O-N 3.5Å; I66-I80 HydrophobicContact CD1-CB 4.18Å; I66-I80 HydrophobicContact CD1-CG2 3.57Å; I66-I80 HydrophobicContact CG1-CG2 3.71Å; I66-A81 HydrophobicContact CD1-CB 3.74Å; I66-C166 VanDerWaalsContact O-O 3.08Å; I66-F168 HydrophobicContact CG2-CB 4.29Å
67S92.8Very high95.5Very high25 Ų2538.2 Ų38.218%0.17523%0.233CC..Hα-helixtrans-62.4-17.5-18078.40000114.1A63 I64 T65A63-S67 WeakPolarHBondContact O-CB 3.5Å; A63-S67 PolarHBondContact O-N 3.11Å; I64-S67 WeakPolarHBondContact O-CB 3.43Å; I64-S67 PolarHBondContact O-N 3.22Å; I64-S67 PolarHBondContact O-OG 3.35Å; T65-S67 VanDerWaalsContact C-N 3.28Å; T65-S67 PolarHBondContact O-N 3.05Å
68T92Very high95.4Very high79 Ų7934.5 Ų34.549%0.48521%0.21SC..THydrogen-bonded Turntrans-80.7-19176.370.90000113.5T65 I66 F70T65-T68 WeakPolarHBondContact O-CB 3.41Å; T65-T68 PolarHBondContact O-N 3.21Å; T65-T68 PolarHBondContact O-OG1 3.46Å; I66-T68 PolarHBondContact O-N 2.75Å; T68-F70 VanDerWaalsContact C-N 3.25Å; T68-F70 PolarHBondContact O-N 3.13Å; T68-F70 PolarHBondContact OG1-N 3.14Å
69G91.6Very high95.4Very high2 Ų235 Ų352%0.02121%0.21CC..THydrogen-bonded Turntrans67.219.2-174.800000114.8I66 Q157 C166I66-G69 PolarHBondContact O-N 3.5Å; G69-Q157 VanDerWaalsContact O-CD 3.26Å; G69-Q157 PolarHBondContact O-NE2 3Å; G69-Q157 PolarHBondContact O-OE1 3.47Å; G69-C166 WeakPolarHBondContact CA-O 3.37Å; G69-C166 PolarHBondContact O-N 3.34Å
70F93.2Very high95.3Very high67 Ų6736.5 Ų36.529%0.29422%0.217SC..  trans-49.7151.8-17677.5-70.8000114T65 T68 A72 I80 C166T65-F70 HydrophobicContact CG2-CD1 3.82Å; T65-F70 HydrophobicContact CG2-CE1 3.5Å; T65-F70 VanDerWaalsContact CG2-CE1 3.5Å; T65-F70 HydrophobicContact CG2-CZ 3.95Å; T68-F70 VanDerWaalsContact C-N 3.25Å; T68-F70 PolarHBondContact O-N 3.13Å; T68-F70 PolarHBondContact OG1-N 3.14Å; F70-A72 HydrophobicContact CD2-CB 4.16Å; F70-A72 HydrophobicContact CE2-CB 3.55Å; F70-A72 HydrophobicContact CZ-CB 3.85Å; F70-A72 PolarHBondContact O-N 3.34Å; F70-I80 HydrophobicContact CZ-CD1 4.05Å; F70-C166 HydrophobicContact CD1-CB 3.88Å; F70-C166 HydrophobicContact CE1-CB 3.63Å; F70-C166 HydrophobicContact CZ-CB 4.17Å; F70-C166 WeakPolarHBondContact O-CB 3.46Å; F70-C166 PolarHBondContact O-N 2.93Å
71C95.1Very high95.3Very high39 Ų3936.6 Ų36.626%0.26422%0.218SC..EExtended strand (participates in β ladder)trans-72.6122.3178.3-61.60000111.1C159C71-C159 VanDerWaalsContact CA-SG 3.57Å; C71-C159 HydrophobicContact CB-CB 3.75Å; C71-C159 WeakPolarHBondContact CB-SG 3.49Å; C71-C159 WeakPolarHBondContact SG-CA 3.4Å; C71-C159 WeakPolarHBondContact SG-CB 3.47Å; C71-C159 CovalentContact SG-SG 2.05Å; C71-C159 PolarHBondContact SG-SG 2.96Å
72A95Very high95.3Very high12 Ų1234.3 Ų34.310%0.09920%0.203CC..EExtended strand (participates in β ladder)trans-143.2159-179.700000111.5F70 C77 Q163 V164 C166F70-A72 HydrophobicContact CD2-CB 4.16Å; F70-A72 HydrophobicContact CE2-CB 3.55Å; F70-A72 HydrophobicContact CZ-CB 3.85Å; F70-A72 PolarHBondContact O-N 3.34Å; A72-C77 HydrophobicContact CB-CB 4.29Å; A72-Q163 WeakPolarHBondContact O-CA 3.38Å; A72-V164 PolarHBondContact N-O 3.44Å; A72-V164 VanDerWaalsContact N-O 3.07Å; A72-V164 PolarHBondContact O-N 3.31Å; A72-C166 HydrophobicContact CB-CB 4.17Å
73A94.8Very high95.3Very high60 Ų6033 Ų3350%0.49620%0.197SC..EExtended strand (participates in β ladder)trans-62.2137.6164.900000109.7H75 G76 C77A73-H75 PolarHBondContact O-N 3.46Å; A73-G76 WeakPolarHBondContact O-CA 3.2Å; A73-G76 PolarHBondContact O-N 3.26Å; A73-C77 PolarHBondContact O-N 2.96Å
74C94.3Very high95.2Very high16 Ų1633.3 Ų33.311%0.10820%0.197CC..Hα-helixtrans-57.1-44-170.1-168.50000113.5G76 C77 L78 C146 V164C74-G76 VanDerWaalsContact C-N 3.32Å; C74-G76 PolarHBondContact O-N 3.4Å; C74-C77 WeakPolarHBondContact O-CB 3.43Å; C74-C77 PolarHBondContact O-N 3.45Å; C74-L78 WeakPolarHBondContact O-CB 3.21Å; C74-L78 PolarHBondContact O-N 2.96Å; C74-C146 HydrophobicContact CB-CB 3.73Å; C74-C146 WeakPolarHBondContact CB-SG 3.3Å; C74-C146 WeakPolarHBondContact SG-CA 3.39Å; C74-C146 WeakPolarHBondContact SG-CB 3.45Å; C74-C146 CovalentContact SG-SG 2.03Å; C74-C146 PolarHBondContact SG-SG 2.93Å; C74-V164 HydrophobicContact CB-CG1 4.24Å; C74-V164 HydrophobicContact CB-CG2 4Å
75H95.1Very high95.3Very high109 Ų10932.5 Ų32.551%0.50519%0.193SC..Hα-helixtrans-66.6-32177.9-68.790.8000113.3A73 L78 F79A73-H75 PolarHBondContact O-N 3.46Å; H75-L78 PolarHBondContact O-N 3.33Å; H75-F79 PolarHBondContact O-N 3.44Å
76G95.9Very high95.4Very high37 Ų3730 Ų3038%0.38118%0.177SC..Hα-helixtrans-67.5-45.2173.300000111.4A73 C74 L78 F79 I80A73-G76 WeakPolarHBondContact O-CA 3.2Å; A73-G76 PolarHBondContact O-N 3.26Å; C74-G76 VanDerWaalsContact C-N 3.32Å; C74-G76 PolarHBondContact O-N 3.4Å; G76-L78 VanDerWaalsContact C-N 3.32Å; G76-L78 PolarHBondContact O-N 2.86Å; G76-F79 PolarHBondContact O-N 3Å; G76-I80 WeakPolarHBondContact O-CG1 3.36Å; G76-I80 PolarHBondContact O-N 2.95Å
77C96.7Very high95.6Very high0 Ų029.4 Ų29.40%017%0.174CC..Hα-helixtrans-58.9-44.3172.5-177.60000111.9A72 A73 C74 F79 I80 A81 C166 V171A72-C77 HydrophobicContact CB-CB 4.29Å; A73-C77 PolarHBondContact O-N 2.96Å; C74-C77 WeakPolarHBondContact O-CB 3.43Å; C74-C77 PolarHBondContact O-N 3.45Å; C77-F79 PolarHBondContact O-N 2.96Å; C77-I80 PolarHBondContact O-N 3.42Å; C77-A81 WeakPolarHBondContact O-CB 3.2Å; C77-A81 PolarHBondContact O-N 3.39Å; C77-C166 WeakPolarHBondContact CA-SG 3.37Å; C77-C166 HydrophobicContact CB-CB 3.75Å; C77-C166 WeakPolarHBondContact CB-SG 3.24Å; C77-C166 WeakPolarHBondContact SG-CA 3.22Å; C77-C166 WeakPolarHBondContact SG-CB 3.49Å; C77-C166 CovalentContact SG-SG 2.03Å; C77-C166 PolarHBondContact SG-SG 3.33Å; C77-V171 HydrophobicContact CB-CG1 4.26Å
78L96.6Very high95.8Very high0 Ų028.5 Ų28.50%017%0.168CC..Hα-helixtrans-61.8-41.1-179.4-170.467.2000112.1C74 H75 G76 A81 C82 P139 M140 N144 V171 V172C74-L78 WeakPolarHBondContact O-CB 3.21Å; C74-L78 PolarHBondContact O-N 2.96Å; H75-L78 PolarHBondContact O-N 3.33Å; G76-L78 VanDerWaalsContact C-N 3.32Å; G76-L78 PolarHBondContact O-N 2.86Å; L78-A81 PolarHBondContact O-N 3.48Å; L78-C82 VanDerWaalsContact O-CB 3.22Å; L78-C82 WeakPolarHBondContact O-CB 3.42Å; L78-C82 PolarHBondContact O-N 3.23Å; L78-C82 PolarHBondContact O-SG 3.19Å; L78-P139 HydrophobicContact CD1-CB 3.91Å; L78-P139 HydrophobicContact CD2-CB 4.17Å; L78-P139 HydrophobicContact CG-CB 4.25Å; L78-M140 HydrophobicContact CD2-CG 4.05Å; L78-M140 HydrophobicContact CG-CG 4.25Å; L78-N144 HydrophobicContact CD1-CB 4.08Å; L78-N144 HydrophobicContact CD2-CB 3.56Å; L78-N144 HydrophobicContact CG-CB 4.49Å; L78-V171 HydrophobicContact CD1-CB 4.13Å; L78-V171 HydrophobicContact CD1-CG2 4.17Å; L78-V171 WeakPolarHBondContact CD1-O 3.43Å; L78-V172 HydrophobicContact CD1-CG2 3.96Å
79F97.4Very high96.1Very high75 Ų7524.9 Ų24.933%0.32915%0.145SC..Hα-helixtrans-60-48.9174.4176.2-96.3000111.6F62 H75 G76 C77 A81 C82 F83 L137 M140F62-F79 HydrophobicContact CE2-CE1 4.42Å; H75-F79 PolarHBondContact O-N 3.44Å; G76-F79 PolarHBondContact O-N 3Å; C77-F79 PolarHBondContact O-N 2.96Å; F79-A81 VanDerWaalsContact C-N 3.29Å; F79-A81 PolarHBondContact O-N 2.91Å; F79-C82 PolarHBondContact O-N 2.92Å; F79-F83 HydrophobicContact CE2-CD2 4.42Å; F79-F83 AromaticContact CZ-CD2 3.99Å; F79-F83 HydrophobicContact CZ-CD2 3.99Å; F79-F83 HydrophobicContact CZ-CE2 4.5Å; F79-F83 WeakPolarHBondContact O-CB 3.35Å; F79-F83 PolarHBondContact O-N 3.28Å; F79-L137 HydrophobicContact CD2-CD2 4.34Å; F79-L137 HydrophobicContact CE2-CD1 4.45Å; F79-M140 HydrophobicContact CB-CE 4.02Å; F79-M140 HydrophobicContact CB-SD 3.99Å; F79-M140 HydrophobicContact CD2-CE 4.26Å; F79-M140 HydrophobicContact CD2-SD 3.78Å; F79-M140 HydrophobicContact CG-SD 4.4Å
80I96.8Very high96.4Very high34 Ų3424.8 Ų24.817%0.17414%0.144CC..Hα-helixtrans-59.7-43178.4-62.5172.1000110F62 I66 F70 G76 C77F62-I80 HydrophobicContact CB-CG2 3.48Å; F62-I80 VanDerWaalsContact CB-CG2 3.48Å; F62-I80 HydrophobicContact CD1-CG2 4.03Å; F62-I80 HydrophobicContact CD2-CG2 4.11Å; F62-I80 HydrophobicContact CG-CB 4.5Å; F62-I80 HydrophobicContact CG-CG2 3.62Å; I66-I80 HydrophobicContact CD1-CB 4.18Å; I66-I80 HydrophobicContact CD1-CG2 3.57Å; I66-I80 HydrophobicContact CG1-CG2 3.71Å; F70-I80 HydrophobicContact CZ-CD1 4.05Å; G76-I80 WeakPolarHBondContact O-CG1 3.36Å; G76-I80 PolarHBondContact O-N 2.95Å; C77-I80 PolarHBondContact O-N 3.42Å
81A96.9Very high96.6Very high1 Ų121.8 Ų21.81%0.00813%0.132CC..Hα-helixtrans-67.6-39.418000000112.6I66 C77 L78 F79 F168 V171 V172I66-A81 HydrophobicContact CD1-CB 3.74Å; C77-A81 WeakPolarHBondContact O-CB 3.2Å; C77-A81 PolarHBondContact O-N 3.39Å; L78-A81 PolarHBondContact O-N 3.48Å; F79-A81 VanDerWaalsContact C-N 3.29Å; F79-A81 PolarHBondContact O-N 2.91Å; A81-F168 HydrophobicContact CB-CD2 3.86Å; A81-F168 HydrophobicContact CB-CE2 4.31Å; A81-F168 WeakPolarHBondContact O-CE2 3.09Å; A81-V171 HydrophobicContact CB-CG2 4.11Å; A81-V172 HydrophobicContact CB-CG2 3.91Å
82C97.6Very high96.7Very high0 Ų020 Ų200%012%0.12CC..Hα-helixtrans-84.5-20.2-175.4-66.70000113.6L78 F79 V84 L85 V86 G136 L137L78-C82 VanDerWaalsContact O-CB 3.22Å; L78-C82 WeakPolarHBondContact O-CB 3.42Å; L78-C82 PolarHBondContact O-N 3.23Å; L78-C82 PolarHBondContact O-SG 3.19Å; F79-C82 PolarHBondContact O-N 2.92Å; C82-V84 VanDerWaalsContact C-N 3.27Å; C82-V84 PolarHBondContact O-N 2.88Å; C82-L85 WeakPolarHBondContact O-CA 3.36Å; C82-L85 WeakPolarHBondContact O-CB 3.41Å; C82-L85 PolarHBondContact O-N 3.19Å; C82-V86 PolarHBondContact O-N 3.14Å; C82-G136 WeakPolarHBondContact CB-O 3.23Å; C82-L137 HydrophobicContact CB-CD2 3.86Å
83F97.2Very high96.8Very high21 Ų2121 Ų219%0.09212%0.122CC..Hα-helixtrans-59.9-35.7-174.7-169.2-100.5000113.1L58 F62 F79 L85 V86 L87 F133L58-F83 HydrophobicContact CB-CD1 4.12Å; L58-F83 HydrophobicContact CB-CE1 3.64Å; L58-F83 HydrophobicContact CD1-CE1 3.48Å; L58-F83 VanDerWaalsContact CD1-CE1 3.48Å; L58-F83 HydrophobicContact CD1-CZ 3.54Å; L58-F83 HydrophobicContact CG-CE1 4.21Å; F62-F83 HydrophobicContact CD2-CB 4.02Å; F62-F83 HydrophobicContact CD2-CD1 4.09Å; F62-F83 HydrophobicContact CD2-CG 4.28Å; F62-F83 HydrophobicContact CE2-CB 4.11Å; F62-F83 AromaticContact CE2-CD1 3.97Å; F62-F83 HydrophobicContact CE2-CD1 3.97Å; F62-F83 HydrophobicContact CE2-CG 4.04Å; F79-F83 HydrophobicContact CE2-CD2 4.42Å; F79-F83 AromaticContact CZ-CD2 3.99Å; F79-F83 HydrophobicContact CZ-CD2 3.99Å; F79-F83 HydrophobicContact CZ-CE2 4.5Å; F79-F83 WeakPolarHBondContact O-CB 3.35Å; F79-F83 PolarHBondContact O-N 3.28Å; F83-L85 PolarHBondContact O-N 3.43Å; F83-V86 WeakPolarHBondContact O-CB 3.01Å; F83-V86 PolarHBondContact O-N 3.42Å; F83-V86 VanDerWaalsContact O-N 3.17Å; F83-L87 HydrophobicContact CD1-CD1 4.3Å; F83-L87 HydrophobicContact CD1-CG 4.43Å; F83-L87 HydrophobicContact CE1-CD1 3.93Å; F83-L87 HydrophobicContact CE1-CD2 4.2Å; F83-L87 HydrophobicContact CE1-CG 4.1Å; F83-L87 HydrophobicContact CZ-CD2 4.36Å; F83-L87 PolarHBondContact O-N 3.44Å; F83-F133 HydrophobicContact CE2-CE1 4.36Å
84V95.4Very high97Very high29 Ų2918.3 Ų18.318%0.17610%0.1CC..Hα-helixtrans-62.1-31.9174.368.50000112.2A59 C82 V86 L87 T88 W246A59-V84 HydrophobicContact CB-CB 4.1Å; A59-V84 HydrophobicContact CB-CG2 4.02Å; C82-V84 VanDerWaalsContact C-N 3.27Å; C82-V84 PolarHBondContact O-N 2.88Å; V84-V86 VanDerWaalsContact C-N 3.33Å; V84-V86 PolarHBondContact O-N 2.88Å; V84-L87 PolarHBondContact O-N 3.33Å; V84-T88 WeakPolarHBondContact O-CB 3.27Å; V84-T88 PolarHBondContact O-N 3.33Å; V84-T88 PolarHBondContact O-OG1 2.97Å; V84-W246 HydrophobicContact CG2-CH2 4.31Å
85L97.2Very high97.1Very high8 Ų817.8 Ų17.84%0.04210%0.096CC..Hα-helixtrans-67.3-35.5177.5-51.5-179.3000111.3C82 F83 T88 Q89 Y176 M177C82-L85 WeakPolarHBondContact O-CA 3.36Å; C82-L85 WeakPolarHBondContact O-CB 3.41Å; C82-L85 PolarHBondContact O-N 3.19Å; F83-L85 PolarHBondContact O-N 3.43Å; L85-T88 PolarHBondContact O-N 3.19Å; L85-Q89 WeakPolarHBondContact O-CB 3.3Å; L85-Q89 PolarHBondContact O-N 3.48Å; L85-Y176 HydrophobicContact CD1-CE1 3.71Å; L85-M177 HydrophobicContact CD1-SD 4.01Å; L85-M177 HydrophobicContact CD2-CE 4.04Å; L85-M177 HydrophobicContact CD2-SD 4.31Å
86V98.3Very high97.2Very high0 Ų014 Ų140%08%0.079CC..Hα-helixtrans-60.7-48.1173.7178.50000110.6C82 F83 V84 Q89 S90 S132 F133 L137C82-V86 PolarHBondContact O-N 3.14Å; F83-V86 WeakPolarHBondContact O-CB 3.01Å; F83-V86 PolarHBondContact O-N 3.42Å; F83-V86 VanDerWaalsContact O-N 3.17Å; V84-V86 VanDerWaalsContact C-N 3.33Å; V84-V86 PolarHBondContact O-N 2.88Å; V86-Q89 PolarHBondContact O-N 3.13Å; V86-S90 PolarHBondContact O-N 3.39Å; V86-S132 WeakPolarHBondContact O-CB 3.43Å; V86-F133 HydrophobicContact CG1-CD1 3.78Å; V86-F133 HydrophobicContact CG1-CD2 4.07Å; V86-F133 HydrophobicContact CG1-CE1 3.88Å; V86-F133 HydrophobicContact CG1-CE2 4.15Å; V86-F133 HydrophobicContact CG1-CG 3.88Å; V86-F133 HydrophobicContact CG1-CZ 4.06Å; V86-F133 HydrophobicContact CG2-CD1 4.16Å; V86-L137 HydrophobicContact CG2-CD2 3.93Å; V86-L137 HydrophobicContact CG2-CG 3.86Å
87L97.7Very high97.3Very high3 Ų312.9 Ų12.92%0.0167%0.066CC..Hα-helixtrans-67.5-38.3-178.8-58.3-174.8000112.3A54 V55 A59 F83 V84 Q89 S90 S91 W129A54-L87 VanDerWaalsContact C-CD1 3.45Å; A54-L87 HydrophobicContact CB-CD1 3.74Å; A54-L87 HydrophobicContact CB-CD2 3.67Å; A54-L87 HydrophobicContact CB-CG 4.38Å; V55-L87 HydrophobicContact CB-CD1 4.37Å; V55-L87 HydrophobicContact CG2-CB 4.08Å; V55-L87 HydrophobicContact CG2-CD1 3.69Å; A59-L87 HydrophobicContact CB-CD1 3.94Å; F83-L87 HydrophobicContact CD1-CD1 4.3Å; F83-L87 HydrophobicContact CD1-CG 4.43Å; F83-L87 HydrophobicContact CE1-CD1 3.93Å; F83-L87 HydrophobicContact CE1-CD2 4.2Å; F83-L87 HydrophobicContact CE1-CG 4.1Å; F83-L87 HydrophobicContact CZ-CD2 4.36Å; F83-L87 PolarHBondContact O-N 3.44Å; V84-L87 PolarHBondContact O-N 3.33Å; L87-Q89 VanDerWaalsContact C-N 3.34Å; L87-S90 PolarHBondContact O-N 2.97Å; L87-S91 WeakPolarHBondContact O-CB 3.48Å; L87-S91 PolarHBondContact O-N 3.35Å; L87-S91 PolarHBondContact O-OG 2.91Å; L87-W129 HydrophobicContact CD2-CH2 4.28Å; L87-W129 HydrophobicContact CD2-CZ3 4.16Å
88T96.6Very high97.3Very high6 Ų613 Ų134%0.0377%0.066CC..Hα-helixtrans-61.6-45.4174.9-520000110.5V84 L85 S90 S91 I92 F242 W246V84-T88 WeakPolarHBondContact O-CB 3.27Å; V84-T88 PolarHBondContact O-N 3.33Å; V84-T88 PolarHBondContact O-OG1 2.97Å; L85-T88 PolarHBondContact O-N 3.19Å; T88-S90 PolarHBondContact O-N 3.3Å; T88-S91 WeakPolarHBondContact O-CB 3.37Å; T88-S91 PolarHBondContact O-N 2.85Å; T88-I92 HydrophobicContact CG2-CD1 4.22Å; T88-I92 WeakPolarHBondContact O-CG1 3.38Å; T88-I92 PolarHBondContact O-N 3.09Å; T88-F242 HydrophobicContact CG2-CZ 4.03Å; T88-W246 HydrophobicContact CG2-CD2 3.99Å; T88-W246 HydrophobicContact CG2-CE3 4Å; T88-W246 HydrophobicContact CG2-CH2 3.77Å; T88-W246 HydrophobicContact CG2-CZ2 3.72Å; T88-W246 HydrophobicContact CG2-CZ3 3.89Å; T88-W246 WeakPolarHBondContact OG1-CH2 3.42Å; T88-W246 VanDerWaalsContact OG1-CZ2 3.27Å; T88-W246 WeakPolarHBondContact OG1-CZ2 3.27Å
89Q97.9Very high97.3Very high3 Ų313 Ų131%0.0147%0.066CC..Hα-helixtrans-65.3-40.9178.5-168.559.447.100112.4L85 V86 L87 S91 I92 F93 I135L85-Q89 WeakPolarHBondContact O-CB 3.3Å; L85-Q89 PolarHBondContact O-N 3.48Å; V86-Q89 PolarHBondContact O-N 3.13Å; L87-Q89 VanDerWaalsContact C-N 3.34Å; Q89-S91 VanDerWaalsContact C-N 3.26Å; Q89-S91 PolarHBondContact O-N 3.4Å; Q89-I92 PolarHBondContact O-N 3.12Å; Q89-F93 HydrophobicContact CG-CD2 3.91Å; Q89-F93 HydrophobicContact CG-CE2 3.44Å; Q89-F93 VanDerWaalsContact CG-CE2 3.44Å; Q89-F93 HydrophobicContact CG-CZ 4Å; Q89-F93 WeakPolarHBondContact O-CD2 3.38Å; Q89-F93 PolarHBondContact O-N 3.46Å; Q89-I135 HydrophobicContact CG-CB 4.22Å; Q89-I135 HydrophobicContact CG-CD1 4.01Å; Q89-I135 HydrophobicContact CG-CG2 4.11Å
90S98.1Very high97.3Very high0 Ų013 Ų130%07%0.07CC..Hα-helixtrans-60.7-39175.1-177.50000111.5V86 L87 T88 S94 W129 S132V86-S90 PolarHBondContact O-N 3.39Å; L87-S90 PolarHBondContact O-N 2.97Å; T88-S90 PolarHBondContact O-N 3.3Å; S90-S94 WeakPolarHBondContact O-CB 3.37Å; S90-S94 PolarHBondContact O-N 3.44Å; S90-S94 PolarHBondContact O-OG 2.94Å; S90-W129 WeakPolarHBondContact OG-CZ2 3.32Å; S90-S132 WeakPolarHBondContact CA-OG 3.45Å; S90-S132 PolarHBondContact N-OG 3.49Å
91S97.4Very high97.2Very high5 Ų511.7 Ų11.74%0.0356%0.063CC..Hα-helixtrans-64.9-46.5175.4-57.50000111.6L87 T88 Q89 F93 S94 L95L87-S91 WeakPolarHBondContact O-CB 3.48Å; L87-S91 PolarHBondContact O-N 3.35Å; L87-S91 PolarHBondContact O-OG 2.91Å; T88-S91 WeakPolarHBondContact O-CB 3.37Å; T88-S91 PolarHBondContact O-N 2.85Å; Q89-S91 VanDerWaalsContact C-N 3.26Å; Q89-S91 PolarHBondContact O-N 3.4Å; S91-F93 PolarHBondContact O-N 3.09Å; S91-S94 PolarHBondContact O-N 3.49Å; S91-L95 VanDerWaalsContact O-CG 3.31Å; S91-L95 WeakPolarHBondContact O-CG 3.25Å; S91-L95 PolarHBondContact O-N 2.97Å
92I97.4Very high97.1Very high0 Ų012.7 Ų12.70%07%0.066CC..Hα-helixtrans-58.2-47.8176.8-70.5164.5000111.1T88 Q89 S94 L95 L96 V186 P189 F242T88-I92 HydrophobicContact CG2-CD1 4.22Å; T88-I92 WeakPolarHBondContact O-CG1 3.38Å; T88-I92 PolarHBondContact O-N 3.09Å; Q89-I92 PolarHBondContact O-N 3.12Å; I92-S94 VanDerWaalsContact C-N 3.35Å; I92-S94 PolarHBondContact O-N 3.41Å; I92-L95 PolarHBondContact O-N 3.24Å; I92-L96 WeakPolarHBondContact O-CB 3.48Å; I92-L96 PolarHBondContact O-N 2.62Å; I92-V186 HydrophobicContact CD1-CB 4.17Å; I92-V186 HydrophobicContact CD1-CG1 4.34Å; I92-V186 HydrophobicContact CD1-CG2 3.62Å; I92-P189 HydrophobicContact CG2-CB 3.41Å; I92-P189 VanDerWaalsContact CG2-CB 3.41Å; I92-P189 HydrophobicContact CG2-CG 3.91Å; I92-F242 HydrophobicContact CD1-CE1 4.17Å; I92-F242 HydrophobicContact CD1-CZ 3.89Å; I92-F242 HydrophobicContact CG1-CE1 3.68Å; I92-F242 HydrophobicContact CG1-CE2 4.25Å; I92-F242 HydrophobicContact CG1-CZ 3.38Å
93F97.9Very high97Very high34 Ų3416.4 Ų16.415%0.1498%0.081CC..Hα-helixtrans-65.2-38.9178.8-70.7-41.9000112.5Q89 S91 L96 A97 C128 L131 S132 I135Q89-F93 HydrophobicContact CG-CD2 3.91Å; Q89-F93 HydrophobicContact CG-CE2 3.44Å; Q89-F93 VanDerWaalsContact CG-CE2 3.44Å; Q89-F93 HydrophobicContact CG-CZ 4Å; Q89-F93 WeakPolarHBondContact O-CD2 3.38Å; Q89-F93 PolarHBondContact O-N 3.46Å; S91-F93 PolarHBondContact O-N 3.09Å; F93-L96 PolarHBondContact O-N 3.01Å; F93-A97 WeakPolarHBondContact O-CB 3.17Å; F93-A97 PolarHBondContact O-N 3.24Å; F93-C128 HydrophobicContact CB-CB 3.74Å; F93-C128 HydrophobicContact CD2-CB 4.12Å; F93-C128 WeakPolarHBondContact CD2-O 3.35Å; F93-C128 HydrophobicContact CG-CB 4.2Å; F93-L131 HydrophobicContact CE2-CB 3.71Å; F93-L131 HydrophobicContact CZ-CB 4.13Å; F93-S132 WeakPolarHBondContact CD2-OG 3.33Å; F93-I135 HydrophobicContact CE2-CD1 4.1Å; F93-I135 HydrophobicContact CZ-CD1 3.72Å
94S97.7Very high96.9Very high4 Ų416.9 Ų16.93%0.0288%0.084CC..Hα-helixtrans-63.3-43.5175.6-600000111.3S47 S90 S91 I92 A97 I98S47-S94 PolarHBondContact OG-OG 2.8Å; S90-S94 WeakPolarHBondContact O-CB 3.37Å; S90-S94 PolarHBondContact O-N 3.44Å; S90-S94 PolarHBondContact O-OG 2.94Å; S91-S94 PolarHBondContact O-N 3.49Å; I92-S94 VanDerWaalsContact C-N 3.35Å; I92-S94 PolarHBondContact O-N 3.41Å; S94-A97 PolarHBondContact O-N 3.38Å; S94-I98 WeakPolarHBondContact O-CD1 3.5Å; S94-I98 VanDerWaalsContact O-CG1 3.22Å; S94-I98 WeakPolarHBondContact O-CG1 3.42Å; S94-I98 PolarHBondContact O-N 3.16Å
95L96.9Very high96.8Very high4 Ų416.1 Ų16.12%0.0218%0.081CC..Hα-helixtrans-64.8-41176.3-69.3174000112.6L48 S91 I92 I98 A99 M193 I238 V239 F242L48-L95 HydrophobicContact CD1-CG 4.46Å; L48-L95 HydrophobicContact CD2-CD2 3.79Å; L48-L95 HydrophobicContact CD2-CG 4.43Å; S91-L95 VanDerWaalsContact O-CG 3.31Å; S91-L95 WeakPolarHBondContact O-CG 3.25Å; S91-L95 PolarHBondContact O-N 2.97Å; I92-L95 PolarHBondContact O-N 3.24Å; L95-I98 PolarHBondContact O-N 3.5Å; L95-A99 PolarHBondContact O-N 3Å; L95-M193 VanDerWaalsContact C-SD 3.51Å; L95-M193 HydrophobicContact CB-CE 4.33Å; L95-M193 HydrophobicContact CB-SD 3.54Å; L95-M193 VanDerWaalsContact CB-SD 3.54Å; L95-I238 HydrophobicContact CD2-CG2 3.62Å; L95-V239 HydrophobicContact CB-CG2 4.21Å; L95-V239 HydrophobicContact CD1-CG2 4.48Å; L95-V239 HydrophobicContact CD2-CG2 4.16Å; L95-F242 HydrophobicContact CD1-CB 3.87Å; L95-F242 HydrophobicContact CD1-CD1 4.4Å; L95-F242 HydrophobicContact CD1-CD2 3.74Å; L95-F242 HydrophobicContact CD1-CE2 4.45Å; L95-F242 HydrophobicContact CD1-CG 3.73Å
96L97.8Very high96.5Very high31 Ų3116 Ų1616%0.1628%0.08CC..Hα-helixtrans-64.3-43.9176.1179.561.6000111.2I92 F93 I98 A99 I100 L192 M193I92-L96 WeakPolarHBondContact O-CB 3.48Å; I92-L96 PolarHBondContact O-N 2.62Å; F93-L96 PolarHBondContact O-N 3.01Å; L96-I98 VanDerWaalsContact C-N 3.33Å; L96-I98 PolarHBondContact O-N 2.98Å; L96-A99 PolarHBondContact O-N 3.13Å; L96-I100 HydrophobicContact CD1-CD1 4.13Å; L96-I100 HydrophobicContact CD1-CG1 4.39Å; L96-I100 HydrophobicContact CG-CD1 4Å; L96-I100 WeakPolarHBondContact O-CG1 3.45Å; L96-I100 PolarHBondContact O-N 3.16Å; L96-L192 HydrophobicContact CD1-CB 4.27Å; L96-M193 HydrophobicContact CB-CG 4.17Å; L96-M193 HydrophobicContact CB-SD 4.27Å; L96-M193 HydrophobicContact CD1-CG 3.71Å; L96-M193 PolarHBondContact N-SD 3.49Å
97A97.8Very high96.2Very high13 Ų1321.6 Ų21.611%0.10710%0.101CC..Hα-helixtrans-61.2-41.9175.800000111.7F44 F93 S94 A99 I100 D101F44-A97 HydrophobicContact CD1-CB 3.58Å; F44-A97 HydrophobicContact CD2-CB 4.32Å; F44-A97 HydrophobicContact CE1-CB 3.61Å; F44-A97 HydrophobicContact CE2-CB 4.34Å; F44-A97 HydrophobicContact CG-CB 3.96Å; F44-A97 HydrophobicContact CZ-CB 4Å; F93-A97 WeakPolarHBondContact O-CB 3.17Å; F93-A97 PolarHBondContact O-N 3.24Å; S94-A97 PolarHBondContact O-N 3.38Å; A97-A99 PolarHBondContact O-N 3.35Å; A97-I100 PolarHBondContact O-N 3.36Å; A97-D101 VanDerWaalsContact O-CB 3.23Å; A97-D101 WeakPolarHBondContact O-CB 3.49Å; A97-D101 PolarHBondContact O-N 3.09Å
98I96.7Very high95.9Very high1 Ų125.5 Ų25.51%0.00512%0.121CC..Hα-helixtrans-60-45173.3-70.3165.5000111.1T41 F44 V45 S94 L95 L96 D101 R102 L235T41-I98 HydrophobicContact CG2-CG2 4.46Å; F44-I98 HydrophobicContact CB-CD1 4.12Å; F44-I98 HydrophobicContact CB-CG1 3.55Å; F44-I98 HydrophobicContact CG-CG1 4.45Å; V45-I98 HydrophobicContact CG2-CD1 4.04Å; S94-I98 WeakPolarHBondContact O-CD1 3.5Å; S94-I98 VanDerWaalsContact O-CG1 3.22Å; S94-I98 WeakPolarHBondContact O-CG1 3.42Å; S94-I98 PolarHBondContact O-N 3.16Å; L95-I98 PolarHBondContact O-N 3.5Å; L96-I98 VanDerWaalsContact C-N 3.33Å; L96-I98 PolarHBondContact O-N 2.98Å; I98-D101 PolarHBondContact O-N 3.37Å; I98-R102 VanDerWaalsContact O-CG 3.32Å; I98-R102 WeakPolarHBondContact O-CG 3.08Å; I98-R102 PolarHBondContact O-N 2.82Å; I98-L235 HydrophobicContact CG2-CB 4.06Å; I98-L235 HydrophobicContact CG2-CD1 3.64Å; I98-L235 HydrophobicContact CG2-CD2 3.97Å; I98-L235 HydrophobicContact CG2-CG 4.07Å
99A96.6Very high95.6Very high0 Ų028.9 Ų28.90%014%0.143CC..Hα-helixtrans-62.3-45.1179.200000111.7L95 L96 A97 R102 Y103 M193 V196 Y197L95-A99 PolarHBondContact O-N 3Å; L96-A99 PolarHBondContact O-N 3.13Å; A97-A99 PolarHBondContact O-N 3.35Å; A99-R102 PolarHBondContact O-N 3.12Å; A99-Y103 WeakPolarHBondContact O-CB 3.46Å; A99-Y103 PolarHBondContact O-N 3.44Å; A99-M193 HydrophobicContact CB-CG 4.18Å; A99-V196 HydrophobicContact CB-CB 4.45Å; A99-V196 HydrophobicContact CB-CG1 4Å; A99-V196 WeakPolarHBondContact O-CG1 3.33Å; A99-Y197 HydrophobicContact CB-CD2 4.35Å; A99-Y197 HydrophobicContact CB-CE2 3.69Å
100I96.5Very high95.3Very high77 Ų7736.9 Ų36.940%0.39519%0.185SC..Hα-helixtrans-64.2-44.8177.1-67.1168.8000110.8L96 A97 R102 Y103 I104L96-I100 HydrophobicContact CD1-CD1 4.13Å; L96-I100 HydrophobicContact CD1-CG1 4.39Å; L96-I100 HydrophobicContact CG-CD1 4Å; L96-I100 WeakPolarHBondContact O-CG1 3.45Å; L96-I100 PolarHBondContact O-N 3.16Å; A97-I100 PolarHBondContact O-N 3.36Å; I100-R102 PolarHBondContact O-N 3.26Å; I100-Y103 WeakPolarHBondContact O-CB 3.48Å; I100-Y103 PolarHBondContact O-N 2.97Å; I100-Y103 VanDerWaalsContact O-N 3.13Å; I100-I104 HydrophobicContact CG2-CD1 3.83Å; I100-I104 HydrophobicContact CG2-CG1 4.35Å; I100-I104 WeakPolarHBondContact O-CG1 3.38Å; I100-I104 PolarHBondContact O-N 2.95Å
101D95.7Very high95.2Very high5 Ų546.2 Ų46.23%0.02722%0.22CC..Hα-helixtrans-55-50.8176.417180.1000111.6T41 A97 I98 Y103 I104 A105 Y112 V116T41-D101 WeakPolarHBondContact CB-OD2 3.44Å; T41-D101 WeakPolarHBondContact CG2-OD2 3.33Å; T41-D101 PolarHBondContact OG1-OD2 3.22Å; A97-D101 VanDerWaalsContact O-CB 3.23Å; A97-D101 WeakPolarHBondContact O-CB 3.49Å; A97-D101 PolarHBondContact O-N 3.09Å; I98-D101 PolarHBondContact O-N 3.37Å; D101-Y103 VanDerWaalsContact C-N 3.3Å; D101-Y103 PolarHBondContact O-N 3.41Å; D101-I104 PolarHBondContact O-N 3.12Å; D101-A105 WeakPolarHBondContact O-CB 3.28Å; D101-A105 PolarHBondContact O-N 3.44Å; D101-Y112 WeakPolarHBondContact OD1-CE2 3.44Å; D101-Y112 PolarHBondContact OD1-OH 3.03Å; D101-V116 WeakPolarHBondContact OD1-CG1 3.32Å
102R94.4Very high95.1Very high22 Ų2247.4 Ų47.48%0.08322%0.224CC..Hα-helixtrans-63.4-35.7176.7-65.2-60.183-161.4-5.2112.5T41 I98 A99 I100 A105 I106 Y112 I200 E228 L235T41-R102 VanDerWaalsContact OG1-CZ 3.24Å; T41-R102 PolarHBondContact OG1-NE 3.13Å; T41-R102 PolarHBondContact OG1-NH2 3.48Å; I98-R102 VanDerWaalsContact O-CG 3.32Å; I98-R102 WeakPolarHBondContact O-CG 3.08Å; I98-R102 PolarHBondContact O-N 2.82Å; A99-R102 PolarHBondContact O-N 3.12Å; I100-R102 PolarHBondContact O-N 3.26Å; R102-A105 PolarHBondContact O-N 2.81Å; R102-I106 WeakPolarHBondContact O-CG1 3.18Å; R102-I106 PolarHBondContact O-N 3.1Å; R102-I106 VanDerWaalsContact O-N 3.09Å; R102-Y112 PolarHBondContact NH2-OH 3.09Å; R102-I200 HydrophobicContact CB-CD1 3.98Å; R102-E228 IonicContact NH1-OE2 3.77Å; R102-E228 PolarHBondContact NH1-OE2 2.72Å; R102-L235 HydrophobicContact CG-CD1 3.52Å
103Y95.2Very high94.9Very high78 Ų7853.8 Ų53.831%0.30626%0.258SS..Hα-helixtrans-63.4-47.1175.5177.3-100.8000112.1A99 I100 D101 I106 R107 V196 R199 I200A99-Y103 WeakPolarHBondContact O-CB 3.46Å; A99-Y103 PolarHBondContact O-N 3.44Å; I100-Y103 WeakPolarHBondContact O-CB 3.48Å; I100-Y103 PolarHBondContact O-N 2.97Å; I100-Y103 VanDerWaalsContact O-N 3.13Å; D101-Y103 VanDerWaalsContact C-N 3.3Å; D101-Y103 PolarHBondContact O-N 3.41Å; Y103-I106 PolarHBondContact O-N 3.36Å; Y103-R107 HydrophobicContact CD1-CG 4.49Å; Y103-R107 HydrophobicContact CD2-CG 3.83Å; Y103-R107 HydrophobicContact CE1-CG 4.22Å; Y103-R107 HydrophobicContact CE2-CG 3.5Å; Y103-R107 HydrophobicContact CG-CG 4.32Å; Y103-R107 VanDerWaalsContact O-CB 3.27Å; Y103-R107 WeakPolarHBondContact O-CB 3.29Å; Y103-R107 VanDerWaalsContact O-CG 3.3Å; Y103-R107 WeakPolarHBondContact O-CG 3.33Å; Y103-R107 PolarHBondContact O-N 3.42Å; Y103-V196 HydrophobicContact CD2-CG1 4.37Å; Y103-V196 HydrophobicContact CG-CG1 4.19Å; Y103-R199 HydrophobicContact CD2-CB 4.34Å; Y103-R199 HydrophobicContact CE2-CB 3.84Å; Y103-I200 HydrophobicContact CD2-CG1 3.94Å; Y103-I200 HydrophobicContact CG-CG1 4.48Å
104I95.1Very high94.7Very high31 Ų3154.9 Ų54.916%0.15928%0.279CS..Hα-helixtrans-62.9-45.1177.7-61.5166.8000110I100 D101 I106 R107 I108 Y112 L115 V116I100-I104 HydrophobicContact CG2-CD1 3.83Å; I100-I104 HydrophobicContact CG2-CG1 4.35Å; I100-I104 WeakPolarHBondContact O-CG1 3.38Å; I100-I104 PolarHBondContact O-N 2.95Å; D101-I104 PolarHBondContact O-N 3.12Å; I104-I106 VanDerWaalsContact C-N 3.32Å; I104-I106 PolarHBondContact O-N 3.43Å; I104-R107 PolarHBondContact O-N 3.02Å; I104-I108 CarbonylContact O-C 3.56Å; I104-I108 PolarHBondContact O-N 2.91Å; I104-Y112 HydrophobicContact CB-CD2 4.34Å; I104-Y112 HydrophobicContact CG2-CD2 3.95Å; I104-L115 HydrophobicContact CD1-CD2 4.33Å; I104-L115 HydrophobicContact CG2-CD2 3.95Å; I104-V116 HydrophobicContact CB-CG2 4.45Å; I104-V116 HydrophobicContact CD1-CG2 4.02Å; I104-V116 HydrophobicContact CG2-CG2 4.02Å
105A93.2Very high94.6Very high13 Ų1358.8 Ų58.811%0.10730%0.299CS..Hα-helixtrans-57.6-41.9179.400000112.7D101 R102 P109 Y112D101-A105 WeakPolarHBondContact O-CB 3.28Å; D101-A105 PolarHBondContact O-N 3.44Å; R102-A105 PolarHBondContact O-N 2.81Å; A105-P109 WeakPolarHBondContact O-CA 3.43Å; A105-Y112 HydrophobicContact CB-CD2 3.74Å; A105-Y112 HydrophobicContact CB-CE2 3.73Å; A105-Y112 HydrophobicContact CB-CG 4.28Å
106I91.1Very high94.6Very high5 Ų559.7 Ų59.73%0.02631%0.305CS..Hα-helixtrans-82.4-35.3-177.1-68.3169.7000112.2R102 Y103 I104 I200 Q207 E228 A232R102-I106 WeakPolarHBondContact O-CG1 3.18Å; R102-I106 PolarHBondContact O-N 3.1Å; R102-I106 VanDerWaalsContact O-N 3.09Å; Y103-I106 PolarHBondContact O-N 3.36Å; I104-I106 VanDerWaalsContact C-N 3.32Å; I104-I106 PolarHBondContact O-N 3.43Å; I106-I200 HydrophobicContact CD1-CG2 3.42Å; I106-I200 VanDerWaalsContact CD1-CG2 3.42Å; I106-Q207 PolarHBondContact O-NE2 3.33Å; I106-E228 HydrophobicContact CD1-CB 4.45Å; I106-E228 HydrophobicContact CG1-CB 4.21Å; I106-A232 HydrophobicContact CD1-CB 4.05Å
107R91.9Very high94.6Very high119 Ų11960.3 Ų60.345%0.44931%0.31SS..Hα-helixtrans-83.9-36.2-176.2-69.9-65.8-59.8-152.9-2.6113.7Y103 I104 P109 A203Y103-R107 HydrophobicContact CD1-CG 4.49Å; Y103-R107 HydrophobicContact CD2-CG 3.83Å; Y103-R107 HydrophobicContact CE1-CG 4.22Å; Y103-R107 HydrophobicContact CE2-CG 3.5Å; Y103-R107 HydrophobicContact CG-CG 4.32Å; Y103-R107 VanDerWaalsContact O-CB 3.27Å; Y103-R107 WeakPolarHBondContact O-CB 3.29Å; Y103-R107 VanDerWaalsContact O-CG 3.3Å; Y103-R107 WeakPolarHBondContact O-CG 3.33Å; Y103-R107 PolarHBondContact O-N 3.42Å; I104-R107 PolarHBondContact O-N 3.02Å; R107-P109 VanDerWaalsContact C-CD 3.46Å; R107-A203 VanDerWaalsContact CD-CB 3.45Å
108I91.2Very high94.5Very high84 Ų8460.8 Ų60.843%0.43132%0.317SS..  trans-134.258.4-173.4-37.9177.1000110I104 L110 R111 Y112I104-I108 CarbonylContact O-C 3.56Å; I104-I108 PolarHBondContact O-N 2.91Å; I108-L110 PolarHBondContact O-N 2.9Å; I108-L110 VanDerWaalsContact O-N 3.14Å; I108-R111 HydrophobicContact CG2-CB 3.78Å; I108-R111 HydrophobicContact CG2-CG 4.01Å; I108-R111 PolarHBondContact O-N 3.34Å; I108-R111 VanDerWaalsContact O-N 3.12Å; I108-Y112 PolarHBondContact O-N 2.9Å; I108-Y112 VanDerWaalsContact O-N 3.09Å
109P90.4Very high94.5Very high77 Ų7766.4 Ų66.450%0.535%0.351SS..Hα-helixtrans-57.6-35-172.922.5-34.1000113A105 R107 R111 Y112A105-P109 WeakPolarHBondContact O-CA 3.43Å; R107-P109 VanDerWaalsContact C-CD 3.46Å; P109-R111 VanDerWaalsContact C-N 3.34Å; P109-R111 PolarHBondContact O-N 3.38Å; P109-Y112 PolarHBondContact O-N 3.26Å
110L92.4Very high94.6Very high171 Ų17172.9 Ų72.990%0.89538%0.375SS*.Hα-helixtrans-68-29.2-178.2-61.6178.9000113.7I108I108-L110 PolarHBondContact O-N 2.9Å; I108-L110 VanDerWaalsContact O-N 3.14Å
111R95.1Very high94.7Very high196 Ų19669.3 Ų69.374%0.7436%0.357SS*.Hα-helixtrans-102.7-7.9-179.8-61-175.1178.8-174.5-0.8112.9I108 P109 N113 G114 L115I108-R111 HydrophobicContact CG2-CB 3.78Å; I108-R111 HydrophobicContact CG2-CG 4.01Å; I108-R111 PolarHBondContact O-N 3.34Å; I108-R111 VanDerWaalsContact O-N 3.12Å; P109-R111 VanDerWaalsContact C-N 3.34Å; P109-R111 PolarHBondContact O-N 3.38Å; R111-N113 PolarHBondContact O-N 3.46Å; R111-G114 PolarHBondContact O-N 3.49Å; R111-G114 VanDerWaalsContact O-N 3.13Å; R111-L115 WeakPolarHBondContact O-CB 3.48Å; R111-L115 PolarHBondContact O-N 3.17Å
112Y95.4Very high94.8Very high30 Ų3075.5 Ų75.512%0.11838%0.384CS..Hα-helixtrans-53.6-50.4-175.6171.9-97.7000112.2D101 R102 I104 A105 I108 P109 G114 L115 V116D101-Y112 WeakPolarHBondContact OD1-CE2 3.44Å; D101-Y112 PolarHBondContact OD1-OH 3.03Å; R102-Y112 PolarHBondContact NH2-OH 3.09Å; I104-Y112 HydrophobicContact CB-CD2 4.34Å; I104-Y112 HydrophobicContact CG2-CD2 3.95Å; A105-Y112 HydrophobicContact CB-CD2 3.74Å; A105-Y112 HydrophobicContact CB-CE2 3.73Å; A105-Y112 HydrophobicContact CB-CG 4.28Å; I108-Y112 PolarHBondContact O-N 2.9Å; I108-Y112 VanDerWaalsContact O-N 3.09Å; P109-Y112 PolarHBondContact O-N 3.26Å; Y112-G114 VanDerWaalsContact C-N 3.25Å; Y112-G114 PolarHBondContact O-N 2.94Å; Y112-L115 PolarHBondContact O-N 3.02Å; Y112-L115 VanDerWaalsContact O-N 3.13Å; Y112-V116 HydrophobicContact CD2-CB 4.02Å; Y112-V116 HydrophobicContact CD2-CG2 3.83Å; Y112-V116 HydrophobicContact CE2-CB 3.75Å; Y112-V116 HydrophobicContact CE2-CG1 3.87Å; Y112-V116 HydrophobicContact CE2-CG2 3.81Å; Y112-V116 PolarHBondContact O-N 3.43Å
113N93.4Very high95Very high134 Ų13476 Ų7672%0.71740%0.396SS*.Hα-helixtrans-64.9-25.5-177.5-68.6-26.5000113.9R111R111-N113 PolarHBondContact O-N 3.46Å
114G94.6Very high95.1Very high57 Ų5776 Ų7659%0.58840%0.401SS*.Hα-helixtrans-86.5-27.8175.300000113.4R111 Y112 R120R111-G114 PolarHBondContact O-N 3.49Å; R111-G114 VanDerWaalsContact O-N 3.13Å; Y112-G114 VanDerWaalsContact C-N 3.25Å; Y112-G114 PolarHBondContact O-N 2.94Å; G114-R120 PolarHBondContact O-NH1 3.49Å
115L96Very high95.3Very high86 Ų8676 Ų7645%0.4540%0.401SS..Hα-helixtrans-86.3-45.7-179.1-172.463000112I104 R111 Y112 R120I104-L115 HydrophobicContact CD1-CD2 4.33Å; I104-L115 HydrophobicContact CG2-CD2 3.95Å; R111-L115 WeakPolarHBondContact O-CB 3.48Å; R111-L115 PolarHBondContact O-N 3.17Å; Y112-L115 PolarHBondContact O-N 3.02Å; Y112-L115 VanDerWaalsContact O-N 3.13Å; L115-R120 WeakPolarHBondContact O-CD 3.25Å; L115-R120 PolarHBondContact O-NH1 2.88Å
116V96.7Very high95.5Very high23 Ų2378.1 Ų78.114%0.13942%0.418CS..SBendtrans-104.591.8-171.2-177.80000108.9V40 D101 I104 Y112V40-V116 HydrophobicContact CB-CG1 3.87Å; V40-V116 HydrophobicContact CG1-CG1 3.35Å; V40-V116 HydrophobicContact CG2-CG1 4.17Å; D101-V116 WeakPolarHBondContact OD1-CG1 3.32Å; I104-V116 HydrophobicContact CB-CG2 4.45Å; I104-V116 HydrophobicContact CD1-CG2 4.02Å; I104-V116 HydrophobicContact CG2-CG2 4.02Å; Y112-V116 HydrophobicContact CD2-CB 4.02Å; Y112-V116 HydrophobicContact CD2-CG2 3.83Å; Y112-V116 HydrophobicContact CE2-CB 3.75Å; Y112-V116 HydrophobicContact CE2-CG1 3.87Å; Y112-V116 HydrophobicContact CE2-CG2 3.81Å; Y112-V116 PolarHBondContact O-N 3.43Å
117T97.4Very high95.9Very high45 Ų4582.8 Ų82.828%0.27644%0.442SS..  trans-109155.5-177.770.90000111.5T119 R120 A121T117-T119 VanDerWaalsContact C-N 3.29Å; T117-T119 PolarHBondContact O-N 3.42Å; T117-R120 PolarHBondContact O-N 3.32Å; T117-R120 WeakPolarHBondContact OG1-CG 3.28Å; T117-R120 PolarHBondContact OG1-N 3.4Å; T117-A121 WeakPolarHBondContact O-CB 3.49Å; T117-A121 PolarHBondContact O-N 3.25Å
118G96.1Very high96.2Very high23 Ų2378 Ų7824%0.23743%0.426CS..Hα-helixtrans-59-37.3179.500000113.7A121 K122G118-A121 PolarHBondContact O-N 2.88Å; G118-K122 WeakPolarHBondContact O-CG 3.25Å; G118-K122 PolarHBondContact O-N 3.43Å
119T97.1Very high96.5Very high119 Ų11976.8 Ų76.873%0.7342%0.416SS*.Hα-helixtrans-66.4-44.8177.8-50.20000111.6T117 A121 K122 G123T117-T119 VanDerWaalsContact C-N 3.29Å; T117-T119 PolarHBondContact O-N 3.42Å; T119-A121 VanDerWaalsContact C-N 3.33Å; T119-A121 PolarHBondContact O-N 3.42Å; T119-K122 PolarHBondContact O-N 3.31Å; T119-G123 PolarHBondContact O-N 3.3Å; T119-G123 VanDerWaalsContact O-N 3.11Å
120R97.8Very high96.9Very high135 Ų13578 Ų7851%0.50942%0.422SS..Hα-helixtrans-62.9-42175.8-71.1176.8179.4168.91.2111.2G114 L115 T117 K122 G123 I124G114-R120 PolarHBondContact O-NH1 3.49Å; L115-R120 WeakPolarHBondContact O-CD 3.25Å; L115-R120 PolarHBondContact O-NH1 2.88Å; T117-R120 PolarHBondContact O-N 3.32Å; T117-R120 WeakPolarHBondContact OG1-CG 3.28Å; T117-R120 PolarHBondContact OG1-N 3.4Å; R120-K122 PolarHBondContact O-N 2.92Å; R120-G123 PolarHBondContact O-N 3.5Å; R120-I124 WeakPolarHBondContact O-CG1 3.41Å; R120-I124 PolarHBondContact O-N 3.49Å
121A98Very high97.2Very high2 Ų273.6 Ų73.62%0.01740%0.399CS..Hα-helixtrans-60.8-43.7177.300000112.7V40 Y43 F44 T117 G118 T119 G123 I124 I125V40-A121 HydrophobicContact CG1-CB 3.52Å; Y43-A121 HydrophobicContact CD2-CB 4.21Å; F44-A121 HydrophobicContact CE2-CB 4.24Å; F44-A121 HydrophobicContact CZ-CB 3.9Å; T117-A121 WeakPolarHBondContact O-CB 3.49Å; T117-A121 PolarHBondContact O-N 3.25Å; G118-A121 PolarHBondContact O-N 2.88Å; T119-A121 VanDerWaalsContact C-N 3.33Å; T119-A121 PolarHBondContact O-N 3.42Å; A121-G123 VanDerWaalsContact C-N 3.34Å; A121-G123 PolarHBondContact O-N 3.31Å; A121-I124 PolarHBondContact O-N 2.88Å; A121-I125 VanDerWaalsContact O-CG1 3.28Å; A121-I125 WeakPolarHBondContact O-CG1 3.19Å; A121-I125 PolarHBondContact O-N 2.92Å
122K98Very high97.4Very high136 Ų13664.2 Ų64.259%0.59136%0.364SS*.Hα-helixtrans-60.3-42174.1-71.5174.2-178.9-177.20112.2G118 T119 R120 I125 A126G118-K122 WeakPolarHBondContact O-CG 3.25Å; G118-K122 PolarHBondContact O-N 3.43Å; T119-K122 PolarHBondContact O-N 3.31Å; R120-K122 PolarHBondContact O-N 2.92Å; K122-I125 PolarHBondContact O-N 3.29Å; K122-A126 PolarHBondContact O-N 3.12Å
123G98.3Very high97.5Very high33 Ų3366.8 Ų66.834%0.3438%0.376SS..Hα-helixtrans-61.7-45.8174.700000112.7T119 R120 A121 I125 A126 I127T119-G123 PolarHBondContact O-N 3.3Å; T119-G123 VanDerWaalsContact O-N 3.11Å; R120-G123 PolarHBondContact O-N 3.5Å; A121-G123 VanDerWaalsContact C-N 3.34Å; A121-G123 PolarHBondContact O-N 3.31Å; G123-I125 PolarHBondContact O-N 3.44Å; G123-A126 PolarHBondContact O-N 2.98Å; G123-I127 WeakPolarHBondContact O-CG1 3.28Å; G123-I127 PolarHBondContact O-N 3.23Å
124I98.2Very high97.7Very high77 Ų7763 Ų6340%0.39536%0.363SS..Hα-helixtrans-59.8-46.5175.8-67.2165.3000110.5F44 R120 A121 A126 I127 C128F44-I124 HydrophobicContact CE1-CB 4.26Å; F44-I124 HydrophobicContact CE1-CG2 3.91Å; F44-I124 HydrophobicContact CZ-CG2 4.35Å; R120-I124 WeakPolarHBondContact O-CG1 3.41Å; R120-I124 PolarHBondContact O-N 3.49Å; A121-I124 PolarHBondContact O-N 2.88Å; I124-A126 VanDerWaalsContact C-N 3.34Å; I124-A126 PolarHBondContact O-N 3.02Å; I124-I127 PolarHBondContact O-N 2.95Å; I124-C128 WeakPolarHBondContact O-CB 3.44Å; I124-C128 PolarHBondContact O-N 3.4Å; I124-C128 PolarHBondContact O-SG 3.47Å
125I98.7Very high97.9Very high31 Ų3161.6 Ų61.616%0.15934%0.342CS..Hα-helixtrans-56.7-48.6177.3-70.6164.5000110.6F44 A121 K122 G123 I127 C128 W129F44-I125 HydrophobicContact CD1-CD1 4Å; F44-I125 HydrophobicContact CD1-CG1 3.64Å; F44-I125 HydrophobicContact CE1-CD1 4.26Å; F44-I125 HydrophobicContact CE1-CG1 3.74Å; A121-I125 VanDerWaalsContact O-CG1 3.28Å; A121-I125 WeakPolarHBondContact O-CG1 3.19Å; A121-I125 PolarHBondContact O-N 2.92Å; K122-I125 PolarHBondContact O-N 3.29Å; G123-I125 PolarHBondContact O-N 3.44Å; I125-I127 PolarHBondContact O-N 2.73Å; I125-C128 WeakPolarHBondContact O-CB 3.33Å; I125-C128 PolarHBondContact O-N 3.46Å; I125-W129 VanDerWaalsContact O-CD1 3.25Å; I125-W129 PolarHBondContact O-N 3.17Å
126A98.6Very high97.9Very high57 Ų5757.5 Ų57.547%0.47132%0.32SS..Hα-helixtrans-59.3-45178.800000112.2K122 G123 I124 C128 W129 V130K122-A126 PolarHBondContact O-N 3.12Å; G123-A126 PolarHBondContact O-N 2.98Å; I124-A126 VanDerWaalsContact C-N 3.34Å; I124-A126 PolarHBondContact O-N 3.02Å; A126-C128 PolarHBondContact O-N 2.92Å; A126-W129 PolarHBondContact O-N 2.94Å; A126-V130 WeakPolarHBondContact O-CG2 3.47Å; A126-V130 PolarHBondContact O-N 2.85Å; A126-V130 VanDerWaalsContact O-N 3.07Å
127I98.5Very high98Very high103 Ų10357.9 Ų57.953%0.52832%0.322SS..Hα-helixtrans-60.9-45.3176-66.4165.1000110.6G123 I124 I125 W129 V130 L131G123-I127 WeakPolarHBondContact O-CG1 3.28Å; G123-I127 PolarHBondContact O-N 3.23Å; I124-I127 PolarHBondContact O-N 2.95Å; I125-I127 PolarHBondContact O-N 2.73Å; I127-W129 VanDerWaalsContact C-N 3.34Å; I127-W129 PolarHBondContact O-N 3.36Å; I127-V130 PolarHBondContact O-N 3.5Å; I127-L131 HydrophobicContact CG2-CD1 3.86Å; I127-L131 HydrophobicContact CG2-CG 4.25Å; I127-L131 WeakPolarHBondContact O-CB 3.33Å; I127-L131 WeakPolarHBondContact O-CG 3.39Å; I127-L131 PolarHBondContact O-N 3.45Å
128C98.4Very high98Very high18 Ų1857 Ų5712%0.12232%0.316CS..Hα-helixtrans-60.1-41.3178.4-69.50000112.3F93 I124 I125 A126 S132F93-C128 HydrophobicContact CB-CB 3.74Å; F93-C128 HydrophobicContact CD2-CB 4.12Å; F93-C128 WeakPolarHBondContact CD2-O 3.35Å; F93-C128 HydrophobicContact CG-CB 4.2Å; I124-C128 WeakPolarHBondContact O-CB 3.44Å; I124-C128 PolarHBondContact O-N 3.4Å; I124-C128 PolarHBondContact O-SG 3.47Å; I125-C128 WeakPolarHBondContact O-CB 3.33Å; I125-C128 PolarHBondContact O-N 3.46Å; A126-C128 PolarHBondContact O-N 2.92Å; C128-S132 WeakPolarHBondContact O-CB 3.42Å; C128-S132 PolarHBondContact O-N 3.26Å; C128-S132 PolarHBondContact O-OG 3Å
129W98.7Very high98.1Very high59 Ų5955.9 Ų55.922%0.22331%0.305CS..Hα-helixtrans-64.4-46.1175.3-83.897.5000112.1S47 A50 A51 L87 S90 I125 A126 I127 L131 S132 F133S47-W129 PolarHBondContact OG-NE1 3.4Å; S47-W129 VanDerWaalsContact OG-NE1 3.12Å; A50-W129 HydrophobicContact CB-CZ2 4.48Å; A51-W129 HydrophobicContact CB-CH2 4.06Å; A51-W129 HydrophobicContact CB-CZ2 4.23Å; L87-W129 HydrophobicContact CD2-CH2 4.28Å; L87-W129 HydrophobicContact CD2-CZ3 4.16Å; S90-W129 WeakPolarHBondContact OG-CZ2 3.32Å; I125-W129 VanDerWaalsContact O-CD1 3.25Å; I125-W129 PolarHBondContact O-N 3.17Å; A126-W129 PolarHBondContact O-N 2.94Å; I127-W129 VanDerWaalsContact C-N 3.34Å; I127-W129 PolarHBondContact O-N 3.36Å; W129-L131 PolarHBondContact O-N 3.4Å; W129-S132 WeakPolarHBondContact O-CB 3.09Å; W129-S132 PolarHBondContact O-N 3.46Å; W129-S132 VanDerWaalsContact O-N 3.1Å; W129-F133 HydrophobicContact CE3-CE2 4.1Å; W129-F133 VanDerWaalsContact O-CD2 3.3Å; W129-F133 WeakPolarHBondContact O-CD2 3.42Å; W129-F133 PolarHBondContact O-N 2.97Å
130V98.5Very high98Very high102 Ų10253.3 Ų53.362%0.61829%0.285SS*.Hα-helixtrans-59-46.8176.8172.50000111.2A126 I127 S132 F133 A134A126-V130 WeakPolarHBondContact O-CG2 3.47Å; A126-V130 PolarHBondContact O-N 2.85Å; A126-V130 VanDerWaalsContact O-N 3.07Å; I127-V130 PolarHBondContact O-N 3.5Å; V130-S132 VanDerWaalsContact C-N 3.26Å; V130-S132 PolarHBondContact O-N 3.24Å; V130-F133 PolarHBondContact O-N 3.25Å; V130-A134 PolarHBondContact O-N 3.48Å
131L98.2Very high97.9Very high79 Ų7954 Ų5441%0.41430%0.298SS..Hα-helixtrans-62.1-35.5175.8-69.9175.9000112.1F93 I127 W129 A134 I135F93-L131 HydrophobicContact CE2-CB 3.71Å; F93-L131 HydrophobicContact CZ-CB 4.13Å; I127-L131 HydrophobicContact CG2-CD1 3.86Å; I127-L131 HydrophobicContact CG2-CG 4.25Å; I127-L131 WeakPolarHBondContact O-CB 3.33Å; I127-L131 WeakPolarHBondContact O-CG 3.39Å; I127-L131 PolarHBondContact O-N 3.45Å; W129-L131 PolarHBondContact O-N 3.4Å; L131-A134 PolarHBondContact O-N 3.19Å; L131-I135 WeakPolarHBondContact O-CB 3.5Å; L131-I135 VanDerWaalsContact O-CG1 3.28Å; L131-I135 WeakPolarHBondContact O-CG1 3.22Å; L131-I135 PolarHBondContact O-N 3.01Å
132S98.5Very high97.8Very high0 Ų056.4 Ų56.40%032%0.324CS..Hα-helixtrans-64.6-41.7177.1-58.20000112.1V86 S90 F93 C128 W129 V130 G136V86-S132 WeakPolarHBondContact O-CB 3.43Å; S90-S132 WeakPolarHBondContact CA-OG 3.45Å; S90-S132 PolarHBondContact N-OG 3.49Å; F93-S132 WeakPolarHBondContact CD2-OG 3.33Å; C128-S132 WeakPolarHBondContact O-CB 3.42Å; C128-S132 PolarHBondContact O-N 3.26Å; C128-S132 PolarHBondContact O-OG 3Å; W129-S132 WeakPolarHBondContact O-CB 3.09Å; W129-S132 PolarHBondContact O-N 3.46Å; W129-S132 VanDerWaalsContact O-N 3.1Å; V130-S132 VanDerWaalsContact C-N 3.26Å; V130-S132 PolarHBondContact O-N 3.24Å; S132-G136 PolarHBondContact O-N 3.43Å
133F98.3Very high97.7Very high83 Ų8354.5 Ų54.536%0.36431%0.313SS..Hα-helixtrans-64.5-45.5173.4-83.6-77.2000111.6F83 V86 W129 V130 I135 L137F83-F133 HydrophobicContact CE2-CE1 4.36Å; V86-F133 HydrophobicContact CG1-CD1 3.78Å; V86-F133 HydrophobicContact CG1-CD2 4.07Å; V86-F133 HydrophobicContact CG1-CE1 3.88Å; V86-F133 HydrophobicContact CG1-CE2 4.15Å; V86-F133 HydrophobicContact CG1-CG 3.88Å; V86-F133 HydrophobicContact CG1-CZ 4.06Å; V86-F133 HydrophobicContact CG2-CD1 4.16Å; W129-F133 HydrophobicContact CE3-CE2 4.1Å; W129-F133 VanDerWaalsContact O-CD2 3.3Å; W129-F133 WeakPolarHBondContact O-CD2 3.42Å; W129-F133 PolarHBondContact O-N 2.97Å; V130-F133 PolarHBondContact O-N 3.25Å; F133-I135 PolarHBondContact O-N 3.13Å; F133-L137 HydrophobicContact CD1-CD1 3.93Å; F133-L137 VanDerWaalsContact O-CB 3.29Å; F133-L137 WeakPolarHBondContact O-CB 3.31Å; F133-L137 PolarHBondContact O-N 3.25Å
134A97.8Very high97.6Very high55 Ų5554.3 Ų54.346%0.45530%0.304SS..Hα-helixtrans-59.7-47.717900000111.9V130 L131 T138V130-A134 PolarHBondContact O-N 3.48Å; L131-A134 PolarHBondContact O-N 3.19Å; A134-T138 PolarHBondContact O-N 2.83Å; A134-T138 PolarHBondContact O-OG1 2.77Å
135I97.5Very high97.4Very high27 Ų2753 Ų5314%0.13830%0.298CS..Hα-helixtrans-68.2-50.4179.3-69.8167.4000111Q89 F93 L131 F133 T138 Y176 F180 C185Q89-I135 HydrophobicContact CG-CB 4.22Å; Q89-I135 HydrophobicContact CG-CD1 4.01Å; Q89-I135 HydrophobicContact CG-CG2 4.11Å; F93-I135 HydrophobicContact CE2-CD1 4.1Å; F93-I135 HydrophobicContact CZ-CD1 3.72Å; L131-I135 WeakPolarHBondContact O-CB 3.5Å; L131-I135 VanDerWaalsContact O-CG1 3.28Å; L131-I135 WeakPolarHBondContact O-CG1 3.22Å; L131-I135 PolarHBondContact O-N 3.01Å; F133-I135 PolarHBondContact O-N 3.13Å; I135-T138 WeakPolarHBondContact O-CB 3.35Å; I135-T138 PolarHBondContact O-N 3.19Å; I135-T138 PolarHBondContact O-OG1 3.07Å; I135-T138 VanDerWaalsContact O-OG1 3.13Å; I135-Y176 PolarHBondContact O-OH 2.92Å; I135-F180 HydrophobicContact CB-CE1 4.49Å; I135-F180 HydrophobicContact CG2-CE1 3.91Å; I135-C185 HydrophobicContact CG2-CB 4.14Å; I135-C185 VanDerWaalsContact CG2-SG 3.59Å
136G97.4Very high97.1Very high0 Ų052.7 Ų52.70%030%0.298CS..Hα-helixtrans-69.1-34.5-174.100000113.3C82 S132C82-G136 WeakPolarHBondContact CB-O 3.23Å; S132-G136 PolarHBondContact O-N 3.43Å
137L97.7Very high96.6Very high32 Ų3253.4 Ų53.417%0.16831%0.311CS..THydrogen-bonded Turntrans-97.110.4178.4-56.1-176.5000113.5F79 C82 V86 F133 P139 M140F79-L137 HydrophobicContact CD2-CD2 4.34Å; F79-L137 HydrophobicContact CE2-CD1 4.45Å; C82-L137 HydrophobicContact CB-CD2 3.86Å; V86-L137 HydrophobicContact CG2-CD2 3.93Å; V86-L137 HydrophobicContact CG2-CG 3.86Å; F133-L137 HydrophobicContact CD1-CD1 3.93Å; F133-L137 VanDerWaalsContact O-CB 3.29Å; F133-L137 WeakPolarHBondContact O-CB 3.31Å; F133-L137 PolarHBondContact O-N 3.25Å; L137-P139 VanDerWaalsContact O-N 3.17Å; L137-M140 HydrophobicContact CB-CG 4.42Å; L137-M140 HydrophobicContact CB-SD 4.28Å; L137-M140 HydrophobicContact CD1-SD 4.33Å; L137-M140 HydrophobicContact CD2-SD 3.97Å; L137-M140 HydrophobicContact CG-SD 4.42Å; L137-M140 VanDerWaalsContact O-CB 3.3Å; L137-M140 WeakPolarHBondContact O-CB 3.34Å; L137-M140 PolarHBondContact O-N 3.1Å
138T98.1Very high96Very high26 Ų2656.4 Ų56.416%0.1632%0.322CS..G310 helixtrans-49.2-38.2173.5-68.60000113.2A134 I135 M140 L141 W143 Y176 F180A134-T138 PolarHBondContact O-N 2.83Å; A134-T138 PolarHBondContact O-OG1 2.77Å; I135-T138 WeakPolarHBondContact O-CB 3.35Å; I135-T138 PolarHBondContact O-N 3.19Å; I135-T138 PolarHBondContact O-OG1 3.07Å; I135-T138 VanDerWaalsContact O-OG1 3.13Å; T138-M140 PolarHBondContact O-N 3.32Å; T138-L141 WeakPolarHBondContact O-CB 3.31Å; T138-L141 PolarHBondContact O-N 2.69Å; T138-W143 HydrophobicContact CG2-CE3 4.09Å; T138-Y176 HydrophobicContact CG2-CD2 4.35Å; T138-Y176 HydrophobicContact CG2-CE2 3.92Å; T138-F180 HydrophobicContact CG2-CE1 4.46Å
139P97.1Very high95Very high0 Ų058.3 Ų58.30%034%0.335CS..G310 helixtrans-58.8-30.3175.8-28.839.2000113.9L78 L137 L141 G142 W143 N144 Y176L78-P139 HydrophobicContact CD1-CB 3.91Å; L78-P139 HydrophobicContact CD2-CB 4.17Å; L78-P139 HydrophobicContact CG-CB 4.25Å; L137-P139 VanDerWaalsContact O-N 3.17Å; P139-L141 PolarHBondContact O-N 2.79Å; P139-G142 PolarHBondContact O-N 2.97Å; P139-W143 VanDerWaalsContact CA-O 3.28Å; P139-W143 WeakPolarHBondContact CA-O 3.23Å; P139-W143 WeakPolarHBondContact CB-O 3.37Å; P139-W143 PolarHBondContact O-N 2.91Å; P139-N144 WeakPolarHBondContact O-CB 3.3Å; P139-N144 PolarHBondContact O-ND2 3.39Å; P139-Y176 HydrophobicContact CG-CD1 3.78Å; P139-Y176 HydrophobicContact CG-CD2 4.14Å; P139-Y176 HydrophobicContact CG-CE1 3.48Å; P139-Y176 VanDerWaalsContact CG-CE1 3.48Å; P139-Y176 HydrophobicContact CG-CE2 3.85Å; P139-Y176 HydrophobicContact CG-CG 4.11Å
140M96.3Very high94.1Very high65 Ų6561.2 Ų61.232%0.3235%0.349SS..G310 helixtrans-69.7-16.1177.1-60-170.37000113.2L78 F79 L137 T138 G142L78-M140 HydrophobicContact CD2-CG 4.05Å; L78-M140 HydrophobicContact CG-CG 4.25Å; F79-M140 HydrophobicContact CB-CE 4.02Å; F79-M140 HydrophobicContact CB-SD 3.99Å; F79-M140 HydrophobicContact CD2-CE 4.26Å; F79-M140 HydrophobicContact CD2-SD 3.78Å; F79-M140 HydrophobicContact CG-SD 4.4Å; L137-M140 HydrophobicContact CB-CG 4.42Å; L137-M140 HydrophobicContact CB-SD 4.28Å; L137-M140 HydrophobicContact CD1-SD 4.33Å; L137-M140 HydrophobicContact CD2-SD 3.97Å; L137-M140 HydrophobicContact CG-SD 4.42Å; L137-M140 VanDerWaalsContact O-CB 3.3Å; L137-M140 WeakPolarHBondContact O-CB 3.34Å; L137-M140 PolarHBondContact O-N 3.1Å; T138-M140 PolarHBondContact O-N 3.32Å; M140-G142 PolarHBondContact O-N 3.4Å
141L95.7Very high93.1Very high148 Ų14862.5 Ų62.578%0.77535%0.348SS*.G310 helixtrans-84.23.8176.8-53.7179.1000113T138 P139T138-L141 WeakPolarHBondContact O-CB 3.31Å; T138-L141 PolarHBondContact O-N 2.69Å; P139-L141 PolarHBondContact O-N 2.79Å
142G95.2Very high92.1Very high54 Ų5461.6 Ų61.656%0.55736%0.358SS*.THydrogen-bonded Turntrans121.9-8.6175.600000114.9P139 M140 N144P139-G142 PolarHBondContact O-N 2.97Å; M140-G142 PolarHBondContact O-N 3.4Å; G142-N144 PolarHBondContact O-N 2.9Å
143W96.2Very high91.1Very high95 Ų9565.5 Ų65.536%0.3638%0.375SS..  trans-85.665.6174.8-164.3-7.6000111T138 P139 P173 N175 Y176 F180T138-W143 HydrophobicContact CG2-CE3 4.09Å; P139-W143 VanDerWaalsContact CA-O 3.28Å; P139-W143 WeakPolarHBondContact CA-O 3.23Å; P139-W143 WeakPolarHBondContact CB-O 3.37Å; P139-W143 PolarHBondContact O-N 2.91Å; W143-P173 WeakPolarHBondContact O-CD 3.24Å; W143-P173 WeakPolarHBondContact O-CG 3.28Å; W143-N175 PolarHBondContact NE1-OD1 2.96Å; W143-Y176 HydrophobicContact CD2-CD2 4.07Å; W143-Y176 AromaticContact CE3-CD2 3.87Å; W143-Y176 HydrophobicContact CE3-CD2 3.87Å; W143-Y176 HydrophobicContact CZ3-CD2 4.14Å; W143-F180 HydrophobicContact CH2-CB 3.98Å; W143-F180 HydrophobicContact CZ3-CB 4.07Å; W143-F180 HydrophobicContact CZ3-CD2 4.43Å; W143-F180 HydrophobicContact CZ3-CG 4.23Å
144N96.2Very high90.1Very high30 Ų3062.3 Ų62.316%0.1636%0.362CS..SBendtrans-140.5169.8-176.562.764.8000112.5L78 P139 G142 C146L78-N144 HydrophobicContact CD1-CB 4.08Å; L78-N144 HydrophobicContact CD2-CB 3.56Å; L78-N144 HydrophobicContact CG-CB 4.49Å; P139-N144 WeakPolarHBondContact O-CB 3.3Å; P139-N144 PolarHBondContact O-ND2 3.39Å; G142-N144 PolarHBondContact O-N 2.9Å; N144-C146 WeakPolarHBondContact OD1-CB 3.33Å; N144-C146 PolarHBondContact OD1-N 3.49Å
145N94.2Very high89.1Confident50 Ų5066.5 Ų66.527%0.26737%0.371SS..SBendtrans-92.110.2177.9-68.3-21.5000113.3G147 Q148 D170 V171N145-G147 PolarHBondContact O-N 3.24Å; N145-Q148 CarbonylContact O-C 3.55Å; N145-Q148 PolarHBondContact O-N 2.82Å; N145-Q148 VanDerWaalsContact O-N 3.13Å; N145-D170 WeakPolarHBondContact CB-O 3.44Å; N145-V171 PolarHBondContact N-O 3.33Å; N145-V171 VanDerWaalsContact N-O 3.13Å
146C92.3Very high88.3Confident24 Ų2469.9 Ų69.916%0.16240%0.398CS..THydrogen-bonded Turntrans-67.4-21.1-176.7-630000113.6C74 N144 Q148C74-C146 HydrophobicContact CB-CB 3.73Å; C74-C146 WeakPolarHBondContact CB-SG 3.3Å; C74-C146 WeakPolarHBondContact SG-CA 3.39Å; C74-C146 WeakPolarHBondContact SG-CB 3.45Å; C74-C146 CovalentContact SG-SG 2.03Å; C74-C146 PolarHBondContact SG-SG 2.93Å; N144-C146 WeakPolarHBondContact OD1-CB 3.33Å; N144-C146 PolarHBondContact OD1-N 3.49Å; C146-Q148 VanDerWaalsContact C-N 3.29Å
147G88.3Confident87.6Confident71 Ų7173.6 Ų73.673%0.73242%0.415SS*.THydrogen-bonded Turntrans-77.5-10.117500000114.6N145N145-G147 PolarHBondContact O-N 3.24Å
148Q85.2Confident87.1Confident166 Ų16675.1 Ų75.178%0.77644%0.439SS*.SBendtrans-133.262.4-179.5-65.4-179.1-23.600110.4N145 C146 K150N145-Q148 CarbonylContact O-C 3.55Å; N145-Q148 PolarHBondContact O-N 2.82Å; N145-Q148 VanDerWaalsContact O-N 3.13Å; C146-Q148 VanDerWaalsContact C-N 3.29Å; Q148-K150 PolarHBondContact O-N 3.32Å
149P78Confident86.7Confident59 Ų5974.6 Ų74.638%0.38344%0.436SS..  trans-63.5138.6-177.227.6-33.7000111E151 V164P149-E151 VanDerWaalsContact C-N 3.26Å; P149-E151 PolarHBondContact O-N 3.39Å; P149-V164 HydrophobicContact CB-CG1 4.08Å
150K79.9Confident86.3Confident120 Ų12076.5 Ų76.552%0.52246%0.455SS..  trans-76.475.1175.4-66.5-179.5-177.6170.10110.7Q148 G152 K153 N154 D170Q148-K150 PolarHBondContact O-N 3.32Å; K150-G152 VanDerWaalsContact C-N 3.29Å; K150-G152 PolarHBondContact O-N 2.93Å; K150-G152 VanDerWaalsContact O-N 3.17Å; K150-K153 HydrophobicContact CB-CB 4.31Å; K150-K153 PolarHBondContact O-N 3.45Å; K150-N154 PolarHBondContact O-N 3.3Å; K150-N154 VanDerWaalsContact O-N 3.11Å; K150-D170 WeakPolarHBondContact CE-OD1 3.38Å; K150-D170 IonicContact NZ-OD1 2.75Å; K150-D170 PolarHBondContact NZ-OD1 2.92Å
151E76.9Confident85.8Confident129 Ų12983.2 Ų83.260%0.60349%0.486SS*.Hα-helixtrans-49.6-44.1-174-69.2-178.1173.900113.5P149 K153 N154 H155P149-E151 VanDerWaalsContact C-N 3.26Å; P149-E151 PolarHBondContact O-N 3.39Å; E151-K153 VanDerWaalsContact C-N 3.29Å; E151-K153 PolarHBondContact O-N 2.98Å; E151-N154 PolarHBondContact O-N 3.34Å; E151-N154 VanDerWaalsContact O-N 3.16Å; E151-H155 PolarHBondContact O-CD2 3.39Å; E151-H155 PolarHBondContact O-N 3.09Å
152G76.4Confident85.3Confident60 Ų6079.4 Ų79.462%0.61948%0.483SS*.Hα-helixtrans-58.2-38.2179.400000113.9K150 S156K150-G152 VanDerWaalsContact C-N 3.29Å; K150-G152 PolarHBondContact O-N 2.93Å; K150-G152 VanDerWaalsContact O-N 3.17Å; G152-S156 PolarHBondContact O-N 3.3Å; G152-S156 VanDerWaalsContact O-N 3.16Å
153K78.5Confident85.1Confident81 Ų8180.6 Ų80.635%0.35247%0.474SS..Hα-helixtrans-75.2-40.9177.3-166.8177.2-179.5-176.90111.1K150 E151 H155 S156 Q157 D170K150-K153 HydrophobicContact CB-CB 4.31Å; K150-K153 PolarHBondContact O-N 3.45Å; E151-K153 VanDerWaalsContact C-N 3.29Å; E151-K153 PolarHBondContact O-N 2.98Å; K153-H155 VanDerWaalsContact C-N 3.33Å; K153-H155 PolarHBondContact O-N 2.86Å; K153-S156 WeakPolarHBondContact CA-OG 3.41Å; K153-S156 PolarHBondContact O-N 2.88Å; K153-S156 PolarHBondContact O-OG 2.88Å; K153-Q157 PolarHBondContact O-N 3.46Å; K153-Q157 VanDerWaalsContact O-N 3.14Å; K153-D170 IonicContact NZ-OD1 2.71Å; K153-D170 IonicContact NZ-OD2 3.68Å; K153-D170 PolarHBondContact NZ-OD2 3.48Å
154N77.5Confident85Confident17 Ų1776.8 Ų76.89%0.09146%0.461CS..Hα-helixtrans-60.7-42.5176.9-62.5-20.7000111.6K150 E151 Q157 G158 C159 V164 A165K150-N154 PolarHBondContact O-N 3.3Å; K150-N154 VanDerWaalsContact O-N 3.11Å; E151-N154 PolarHBondContact O-N 3.34Å; E151-N154 VanDerWaalsContact O-N 3.16Å; N154-Q157 PolarHBondContact O-N 3.33Å; N154-G158 PolarHBondContact O-N 3.37Å; N154-C159 HydrophobicContact CB-CB 4.49Å; N154-C159 PolarHBondContact O-N 3.43Å; N154-C159 VanDerWaalsContact O-N 3.1Å; N154-V164 WeakPolarHBondContact OD1-CA 3.46Å; N154-A165 PolarHBondContact OD1-N 3.36Å
155H77.5Confident84.8Confident142 Ų14275.4 Ų75.466%0.65745%0.454SS*.Hα-helixtrans-64.5-42.9174.3-76.5-59.2000112.3E151 K153 Q157 G158E151-H155 PolarHBondContact O-CD2 3.39Å; E151-H155 PolarHBondContact O-N 3.09Å; K153-H155 VanDerWaalsContact C-N 3.33Å; K153-H155 PolarHBondContact O-N 2.86Å; H155-Q157 PolarHBondContact O-N 3.12Å; H155-G158 PolarHBondContact O-N 3.04Å; H155-G158 VanDerWaalsContact O-N 3.08Å
156S80.1Confident84.8Confident98 Ų9873 Ų7369%0.68544%0.441SS*.Hα-helixtrans-61.9-25.9178.173.10000113.6G152 K153G152-S156 PolarHBondContact O-N 3.3Å; G152-S156 VanDerWaalsContact O-N 3.16Å; K153-S156 WeakPolarHBondContact CA-OG 3.41Å; K153-S156 PolarHBondContact O-N 2.88Å; K153-S156 PolarHBondContact O-OG 2.88Å
157Q81.4Confident84.9Confident78 Ų7874 Ų7436%0.36445%0.445SS..THydrogen-bonded Turntrans-95.2-0.8179.2-162.8155.24.100113.5G69 K153 N154 H155G69-Q157 VanDerWaalsContact O-CD 3.26Å; G69-Q157 PolarHBondContact O-NE2 3Å; G69-Q157 PolarHBondContact O-OE1 3.47Å; K153-Q157 PolarHBondContact O-N 3.46Å; K153-Q157 VanDerWaalsContact O-N 3.14Å; N154-Q157 PolarHBondContact O-N 3.33Å; H155-Q157 PolarHBondContact O-N 3.12Å
158G87.7Confident85.2Confident65 Ų6573.1 Ų73.167%0.6742%0.421SS*.THydrogen-bonded Turntrans71.525.8178.500000114.3N154 H155N154-G158 PolarHBondContact O-N 3.37Å; H155-G158 PolarHBondContact O-N 3.04Å; H155-G158 VanDerWaalsContact O-N 3.08Å
159C90.6Very high85.6Confident15 Ų1568.1 Ų68.110%0.10140%0.397CS..PPolyproline II helixtrans-72.3140.8177.6-60.40000111.4C71 N154 Q163C71-C159 VanDerWaalsContact CA-SG 3.57Å; C71-C159 HydrophobicContact CB-CB 3.75Å; C71-C159 WeakPolarHBondContact CB-SG 3.49Å; C71-C159 WeakPolarHBondContact SG-CA 3.4Å; C71-C159 WeakPolarHBondContact SG-CB 3.47Å; C71-C159 CovalentContact SG-SG 2.05Å; C71-C159 PolarHBondContact SG-SG 2.96Å; N154-C159 HydrophobicContact CB-CB 4.49Å; N154-C159 PolarHBondContact O-N 3.43Å; N154-C159 VanDerWaalsContact O-N 3.1Å; C159-Q163 HydrophobicContact CB-CB 4.02Å
160G88.6Confident86.3Confident39 Ų3966.6 Ų66.640%0.40239%0.386SS..PPolyproline II helixtrans-71.6173.6179.600000113.3G162 Q163G160-G162 PolarHBondContact O-N 3.49Å; G160-Q163 VanDerWaalsContact N-OE1 3.07Å; G160-Q163 WeakPolarHBondContact O-CB 3.23Å; G160-Q163 PolarHBondContact O-N 3.25Å
161E85.5Confident87.1Confident206 Ų20661 Ų6196%0.96336%0.362SS*.THydrogen-bonded Turntrans-57.4131.9175.3-165.9178.3173.200110.9Q163E161-Q163 VanDerWaalsContact C-N 3.27Å; E161-Q163 PolarHBondContact O-N 3.44Å
162G84.9Confident88Confident69 Ų6954.9 Ų54.971%0.71133%0.333SS*.THydrogen-bonded Turntrans76.92.3-175.900000115.6G160G160-G162 PolarHBondContact O-N 3.49Å
163Q91.9Very high89Confident78 Ų7852.3 Ų52.336%0.36431%0.306SS..EExtended strand (participates in β ladder)trans-104.2151.8175.3-61-174.9-40.400112.2A72 C159 G160 E161A72-Q163 WeakPolarHBondContact O-CA 3.38Å; C159-Q163 HydrophobicContact CB-CB 4.02Å; G160-Q163 VanDerWaalsContact N-OE1 3.07Å; G160-Q163 WeakPolarHBondContact O-CB 3.23Å; G160-Q163 PolarHBondContact O-N 3.25Å; E161-Q163 VanDerWaalsContact C-N 3.27Å; E161-Q163 PolarHBondContact O-N 3.44Å
164V92.6Very high89.8Confident16 Ų1649.8 Ų49.810%0.09730%0.295CS..EExtended strand (participates in β ladder)trans-125.1152.6175.4-57.30000110.3A72 C74 P149 N154 C166 V171A72-V164 PolarHBondContact N-O 3.44Å; A72-V164 VanDerWaalsContact N-O 3.07Å; A72-V164 PolarHBondContact O-N 3.31Å; C74-V164 HydrophobicContact CB-CG1 4.24Å; C74-V164 HydrophobicContact CB-CG2 4Å; P149-V164 HydrophobicContact CB-CG1 4.08Å; N154-V164 WeakPolarHBondContact OD1-CA 3.46Å; V164-C166 PolarHBondContact O-N 3.39Å; V164-V171 HydrophobicContact CG2-CG1 4.2Å
165A93.5Very high90.8Very high1 Ų152 Ų521%0.00831%0.307CS..EExtended strand (participates in β ladder)trans-62.9112.8165.200000109.1N154 L167N154-A165 PolarHBondContact OD1-N 3.36Å; A165-L167 PolarHBondContact O-N 2.91Å
166C94.6Very high91.7Very high0 Ų045.2 Ų45.20%028%0.276CS..  trans-78.689.6-170.7-177.50000112.2I66 G69 F70 A72 C77 V164I66-C166 VanDerWaalsContact O-O 3.08Å; G69-C166 WeakPolarHBondContact CA-O 3.37Å; G69-C166 PolarHBondContact O-N 3.34Å; F70-C166 HydrophobicContact CD1-CB 3.88Å; F70-C166 HydrophobicContact CE1-CB 3.63Å; F70-C166 HydrophobicContact CZ-CB 4.17Å; F70-C166 WeakPolarHBondContact O-CB 3.46Å; F70-C166 PolarHBondContact O-N 2.93Å; A72-C166 HydrophobicContact CB-CB 4.17Å; C77-C166 WeakPolarHBondContact CA-SG 3.37Å; C77-C166 HydrophobicContact CB-CB 3.75Å; C77-C166 WeakPolarHBondContact CB-SG 3.24Å; C77-C166 WeakPolarHBondContact SG-CA 3.22Å; C77-C166 WeakPolarHBondContact SG-CB 3.49Å; C77-C166 CovalentContact SG-SG 2.03Å; C77-C166 PolarHBondContact SG-SG 3.33Å; V164-C166 PolarHBondContact O-N 3.39Å
167L93.7Very high92.6Very high45 Ų4540.8 Ų40.824%0.23624%0.244CC..  trans-125.4139177.1-67.3168.8000110.2A165 E169 D170 V171A165-L167 PolarHBondContact O-N 2.91Å; L167-E169 PolarHBondContact O-N 3.37Å; L167-D170 HydrophobicContact CB-CB 4.17Å; L167-D170 WeakPolarHBondContact CD1-OD2 3.19Å; L167-D170 PolarHBondContact O-N 2.87Å; L167-V171 PolarHBondContact O-N 3.23Å
168F94.9Very high93.4Very high52 Ų5237.1 Ų37.123%0.22823%0.227CC..Hα-helixtrans-52.2-54.3-171.8-176.1-88.9000113.1I66 A81 D170 V171 V172 M174 M177I66-F168 HydrophobicContact CG2-CB 4.29Å; A81-F168 HydrophobicContact CB-CD2 3.86Å; A81-F168 HydrophobicContact CB-CE2 4.31Å; A81-F168 WeakPolarHBondContact O-CE2 3.09Å; F168-D170 PolarHBondContact O-N 3.41Å; F168-V171 PolarHBondContact O-N 2.91Å; F168-V172 HydrophobicContact CD1-CB 4.46Å; F168-V172 HydrophobicContact CD2-CG2 4.24Å; F168-V172 HydrophobicContact CE1-CB 4.14Å; F168-V172 HydrophobicContact CE1-CG1 4.34Å; F168-V172 HydrophobicContact CE1-CG2 4.47Å; F168-V172 HydrophobicContact CE2-CG2 4.01Å; F168-V172 HydrophobicContact CZ-CB 4.18Å; F168-V172 HydrophobicContact CZ-CG1 4.17Å; F168-V172 HydrophobicContact CZ-CG2 4.13Å; F168-V172 WeakPolarHBondContact O-CB 3.49Å; F168-V172 PolarHBondContact O-N 3.44Å; F168-M174 HydrophobicContact CE1-CE 4.25Å; F168-M177 HydrophobicContact CE1-CE 3.99Å; F168-M177 HydrophobicContact CE1-CG 4.1Å; F168-M177 HydrophobicContact CE1-SD 4.06Å; F168-M177 HydrophobicContact CZ-CE 3.68Å; F168-M177 HydrophobicContact CZ-CG 4.32Å; F168-M177 HydrophobicContact CZ-SD 3.67Å
169E93.9Very high93.9Very high60 Ų6039.7 Ų39.728%0.2822%0.217SC..Hα-helixtrans-70.3-18.4-178.3-63.6175.8-163.700113.5L167 M174 H264 M270L167-E169 PolarHBondContact O-N 3.37Å; E169-M174 HydrophobicContact CB-CE 4.41Å; E169-M174 HydrophobicContact CG-CE 4.02Å; E169-H264 IonicContact OE1-CE1 3.73Å; E169-H264 PolarHBondContact OE1-CE1 2.89Å; E169-H264 IonicContact OE1-NE2 2.82Å; E169-H264 PolarHBondContact OE1-NE2 2.97Å; E169-H264 IonicContact OE2-CE1 2.95Å; E169-H264 IonicContact OE2-NE2 2.97Å; E169-H264 PolarHBondContact OE2-NE2 3.01Å; E169-H264 VanDerWaalsContact OE2-NE2 3.16Å; E169-M270 WeakPolarHBondContact OE1-CE 3.47Å
170D92.8Very high94.2Very high27 Ų2741.9 Ų41.914%0.14423%0.225CC..Hα-helixtrans-80.9-27.4177.7-72.7-22.2000111.5N145 K150 K153 L167 F168N145-D170 WeakPolarHBondContact CB-O 3.44Å; K150-D170 WeakPolarHBondContact CE-OD1 3.38Å; K150-D170 IonicContact NZ-OD1 2.75Å; K150-D170 PolarHBondContact NZ-OD1 2.92Å; K153-D170 IonicContact NZ-OD1 2.71Å; K153-D170 IonicContact NZ-OD2 3.68Å; K153-D170 PolarHBondContact NZ-OD2 3.48Å; L167-D170 HydrophobicContact CB-CB 4.17Å; L167-D170 WeakPolarHBondContact CD1-OD2 3.19Å; L167-D170 PolarHBondContact O-N 2.87Å; F168-D170 PolarHBondContact O-N 3.41Å
171V94.8Very high94.7Very high3 Ų340.2 Ų40.22%0.01821%0.207CC..Hα-helixtrans-106.4-31.1179.6-62.40000114.2C77 L78 A81 N145 V164 L167 F168C77-V171 HydrophobicContact CB-CG1 4.26Å; L78-V171 HydrophobicContact CD1-CB 4.13Å; L78-V171 HydrophobicContact CD1-CG2 4.17Å; L78-V171 WeakPolarHBondContact CD1-O 3.43Å; A81-V171 HydrophobicContact CB-CG2 4.11Å; N145-V171 PolarHBondContact N-O 3.33Å; N145-V171 VanDerWaalsContact N-O 3.13Å; V164-V171 HydrophobicContact CG2-CG1 4.2Å; L167-V171 PolarHBondContact O-N 3.23Å; F168-V171 PolarHBondContact O-N 2.91Å
172V96.8Very high95.3Very high0 Ų031 Ų310%016%0.164CC..SBendtrans-98.3119.4-179.9-173.70000110.7L78 A81 F168 Y176 M177L78-V172 HydrophobicContact CD1-CG2 3.96Å; A81-V172 HydrophobicContact CB-CG2 3.91Å; F168-V172 HydrophobicContact CD1-CB 4.46Å; F168-V172 HydrophobicContact CD2-CG2 4.24Å; F168-V172 HydrophobicContact CE1-CB 4.14Å; F168-V172 HydrophobicContact CE1-CG1 4.34Å; F168-V172 HydrophobicContact CE1-CG2 4.47Å; F168-V172 HydrophobicContact CE2-CG2 4.01Å; F168-V172 HydrophobicContact CZ-CB 4.18Å; F168-V172 HydrophobicContact CZ-CG1 4.17Å; F168-V172 HydrophobicContact CZ-CG2 4.13Å; F168-V172 WeakPolarHBondContact O-CB 3.49Å; F168-V172 PolarHBondContact O-N 3.44Å; V172-Y176 HydrophobicContact CG1-CD1 3.84Å; V172-Y176 HydrophobicContact CG1-CE1 4.31Å; V172-M177 HydrophobicContact CG1-CG 3.73Å; V172-M177 HydrophobicContact CG1-SD 3.8Å
173P96.7Very high95.9Very high7 Ų731.4 Ų31.45%0.04515%0.147CC..  trans-64.9136.6180-22.834.1000113.1W143 N175 Y176 M177W143-P173 WeakPolarHBondContact O-CD 3.24Å; W143-P173 WeakPolarHBondContact O-CG 3.28Å; P173-N175 VanDerWaalsContact C-N 3.31Å; P173-N175 WeakPolarHBondContact CB-OD1 3.48Å; P173-N175 PolarHBondContact O-N 3.37Å; P173-Y176 WeakPolarHBondContact O-CB 3.27Å; P173-Y176 PolarHBondContact O-N 3.48Å; P173-M177 PolarHBondContact O-N 3.5Å; P173-M177 VanDerWaalsContact O-N 3.15Å
174M96Very high96.2Very high28 Ų2830 Ų3014%0.13815%0.148CC..Hα-helixtrans-67.6-29.1177.8-75.7-56.7101.600113.5F168 E169 Y176 M177 V178 N253 T256 F257F168-M174 HydrophobicContact CE1-CE 4.25Å; E169-M174 HydrophobicContact CB-CE 4.41Å; E169-M174 HydrophobicContact CG-CE 4.02Å; M174-Y176 VanDerWaalsContact C-N 3.33Å; M174-Y176 PolarHBondContact O-N 3.24Å; M174-M177 HydrophobicContact CE-CB 4.26Å; M174-M177 HydrophobicContact CE-CG 3.83Å; M174-M177 PolarHBondContact O-N 2.92Å; M174-M177 HydrophobicContact SD-CB 4.41Å; M174-V178 WeakPolarHBondContact O-CB 3.36Å; M174-V178 WeakPolarHBondContact O-CG2 3.39Å; M174-V178 PolarHBondContact O-N 3.4Å; M174-N253 HydrophobicContact SD-CB 4.47Å; M174-T256 HydrophobicContact CG-CG2 4.45Å; M174-F257 HydrophobicContact CB-CB 4.22Å; M174-F257 HydrophobicContact CB-CD2 3.69Å; M174-F257 HydrophobicContact CB-CG 4.32Å
175N97.2Very high96.5Very high62 Ų6229.9 Ų29.933%0.33215%0.148SC..Hα-helixtrans-64.3-37.7174.262.1-4.5000112.2W143 P173 Y179 F257W143-N175 PolarHBondContact NE1-OD1 2.96Å; P173-N175 VanDerWaalsContact C-N 3.31Å; P173-N175 WeakPolarHBondContact CB-OD1 3.48Å; P173-N175 PolarHBondContact O-N 3.37Å; N175-Y179 HydrophobicContact CB-CD2 4.12Å; N175-Y179 HydrophobicContact CB-CE2 4.41Å; N175-Y179 WeakPolarHBondContact O-CB 3.37Å; N175-Y179 PolarHBondContact O-N 3.49Å; N175-F257 HydrophobicContact CB-CE2 3.8Å; N175-F257 HydrophobicContact CB-CZ 3.97Å
176Y98Very high96.6Very high0 Ų029.9 Ų29.90%015%0.148CC..Iπ-helixtrans-63.3-48.2171.2166.9-94.6000110.6L85 I135 T138 P139 W143 V172 P173 M174 V178 F180 N181L85-Y176 HydrophobicContact CD1-CE1 3.71Å; I135-Y176 PolarHBondContact O-OH 2.92Å; T138-Y176 HydrophobicContact CG2-CD2 4.35Å; T138-Y176 HydrophobicContact CG2-CE2 3.92Å; P139-Y176 HydrophobicContact CG-CD1 3.78Å; P139-Y176 HydrophobicContact CG-CD2 4.14Å; P139-Y176 HydrophobicContact CG-CE1 3.48Å; P139-Y176 VanDerWaalsContact CG-CE1 3.48Å; P139-Y176 HydrophobicContact CG-CE2 3.85Å; P139-Y176 HydrophobicContact CG-CG 4.11Å; W143-Y176 HydrophobicContact CD2-CD2 4.07Å; W143-Y176 AromaticContact CE3-CD2 3.87Å; W143-Y176 HydrophobicContact CE3-CD2 3.87Å; W143-Y176 HydrophobicContact CZ3-CD2 4.14Å; V172-Y176 HydrophobicContact CG1-CD1 3.84Å; V172-Y176 HydrophobicContact CG1-CE1 4.31Å; P173-Y176 WeakPolarHBondContact O-CB 3.27Å; P173-Y176 PolarHBondContact O-N 3.48Å; M174-Y176 VanDerWaalsContact C-N 3.33Å; M174-Y176 PolarHBondContact O-N 3.24Å; Y176-V178 VanDerWaalsContact C-N 3.34Å; Y176-V178 PolarHBondContact O-N 2.93Å; Y176-F180 HydrophobicContact CD2-CB 4.16Å; Y176-F180 AromaticContact CD2-CD1 3.87Å; Y176-F180 HydrophobicContact CD2-CD1 3.87Å; Y176-F180 HydrophobicContact CD2-CG 4.35Å; Y176-F180 HydrophobicContact CE2-CB 4.48Å; Y176-F180 AromaticContact CE2-CD1 3.36Å; Y176-F180 HydrophobicContact CE2-CD1 3.36Å; Y176-F180 AromaticContact CE2-CE1 3.92Å; Y176-F180 HydrophobicContact CE2-CE1 3.92Å; Y176-F180 HydrophobicContact CE2-CG 4.27Å; Y176-F180 WeakPolarHBondContact O-CB 3.27Å; Y176-F180 PolarHBondContact O-N 3.02Å; Y176-N181 HydrophobicContact CE1-CB 4.33Å; Y176-N181 PolarHBondContact O-N 3.22Å
177M98.1Very high96.7Very high6 Ų632.5 Ų32.53%0.0316%0.161CC..Iπ-helixtrans-62.2-37.9-179-71.5-57.7-64.700113.4L85 F168 V172 P173 M174 N181 F182L85-M177 HydrophobicContact CD1-SD 4.01Å; L85-M177 HydrophobicContact CD2-CE 4.04Å; L85-M177 HydrophobicContact CD2-SD 4.31Å; F168-M177 HydrophobicContact CE1-CE 3.99Å; F168-M177 HydrophobicContact CE1-CG 4.1Å; F168-M177 HydrophobicContact CE1-SD 4.06Å; F168-M177 HydrophobicContact CZ-CE 3.68Å; F168-M177 HydrophobicContact CZ-CG 4.32Å; F168-M177 HydrophobicContact CZ-SD 3.67Å; V172-M177 HydrophobicContact CG1-CG 3.73Å; V172-M177 HydrophobicContact CG1-SD 3.8Å; P173-M177 PolarHBondContact O-N 3.5Å; P173-M177 VanDerWaalsContact O-N 3.15Å; M174-M177 HydrophobicContact CE-CB 4.26Å; M174-M177 HydrophobicContact CE-CG 3.83Å; M174-M177 PolarHBondContact O-N 2.92Å; M174-M177 HydrophobicContact SD-CB 4.41Å; M177-N181 WeakPolarHBondContact O-CB 3.37Å; M177-N181 HydrophobicContact SD-CB 4.47Å; M177-F182 WeakPolarHBondContact O-CB 3.41Å; M177-F182 PolarHBondContact O-N 3.3Å
178V98.3Very high96.9Very high1 Ų133.9 Ų33.91%0.00617%0.172CC..Iπ-helixtrans-85.8-56.9-177173.70000112M174 Y176 F182 F183 N253 F257 F258M174-V178 WeakPolarHBondContact O-CB 3.36Å; M174-V178 WeakPolarHBondContact O-CG2 3.39Å; M174-V178 PolarHBondContact O-N 3.4Å; Y176-V178 VanDerWaalsContact C-N 3.34Å; Y176-V178 PolarHBondContact O-N 2.93Å; V178-F182 WeakPolarHBondContact O-CB 3.23Å; V178-F183 HydrophobicContact CG1-CD2 4.45Å; V178-F183 HydrophobicContact CG1-CE2 3.95Å; V178-F183 HydrophobicContact CG1-CZ 4.17Å; V178-F183 PolarHBondContact O-N 3.46Å; V178-N253 HydrophobicContact CG2-CB 4.29Å; V178-F257 HydrophobicContact CB-CD1 4.2Å; V178-F257 HydrophobicContact CB-CG 4.47Å; V178-F257 HydrophobicContact CG1-CD1 4.13Å; V178-F257 HydrophobicContact CG2-CB 3.78Å; V178-F257 HydrophobicContact CG2-CD1 4.21Å; V178-F257 HydrophobicContact CG2-CG 4.08Å; V178-F258 HydrophobicContact CG1-CE2 3.59Å; V178-F258 HydrophobicContact CG1-CZ 3.71Å
179Y98.2Very high97Very high118 Ų11832 Ų3246%0.46317%0.165SC..Iπ-helixtrans-77.2-46.7-171.7-64-51.3000112.6N175 F183 A184 F257 F258N175-Y179 HydrophobicContact CB-CD2 4.12Å; N175-Y179 HydrophobicContact CB-CE2 4.41Å; N175-Y179 WeakPolarHBondContact O-CB 3.37Å; N175-Y179 PolarHBondContact O-N 3.49Å; Y179-F183 AromaticContact CD1-CD2 3.97Å; Y179-F183 HydrophobicContact CD1-CD2 3.97Å; Y179-F183 HydrophobicContact CD1-CE2 4.08Å; Y179-F183 HydrophobicContact CE1-CE2 4.37Å; Y179-A184 PolarHBondContact O-N 3.38Å; Y179-F257 HydrophobicContact CD2-CE1 4.37Å; Y179-F257 HydrophobicContact CD2-CZ 4.38Å; Y179-F257 HydrophobicContact CE1-CE1 4.3Å; Y179-F257 AromaticContact CE2-CE1 3.51Å; Y179-F257 HydrophobicContact CE2-CE1 3.51Å; Y179-F257 AromaticContact CE2-CZ 3.55Å; Y179-F257 HydrophobicContact CE2-CZ 3.55Å; Y179-F257 AromaticContact CZ-CE1 3.48Å; Y179-F257 VanDerWaalsContact CZ-CE1 3.48Å; Y179-F257 AromaticContact CZ-CZ 3.99Å; Y179-F257 WeakPolarHBondContact OH-CE1 3.22Å; Y179-F258 HydrophobicContact CE1-CE1 4.08Å; Y179-F258 AromaticContact CE1-CZ 3.87Å; Y179-F258 HydrophobicContact CE1-CZ 3.87Å
180F98.1Very high97.1Very high61 Ų6130 Ų3027%0.26816%0.156SC..Iπ-helixtrans-85.8-59.9-175.5-172.9-102.9000111I135 T138 W143 Y176 A184 C185I135-F180 HydrophobicContact CB-CE1 4.49Å; I135-F180 HydrophobicContact CG2-CE1 3.91Å; T138-F180 HydrophobicContact CG2-CE1 4.46Å; W143-F180 HydrophobicContact CH2-CB 3.98Å; W143-F180 HydrophobicContact CZ3-CB 4.07Å; W143-F180 HydrophobicContact CZ3-CD2 4.43Å; W143-F180 HydrophobicContact CZ3-CG 4.23Å; Y176-F180 HydrophobicContact CD2-CB 4.16Å; Y176-F180 AromaticContact CD2-CD1 3.87Å; Y176-F180 HydrophobicContact CD2-CD1 3.87Å; Y176-F180 HydrophobicContact CD2-CG 4.35Å; Y176-F180 HydrophobicContact CE2-CB 4.48Å; Y176-F180 AromaticContact CE2-CD1 3.36Å; Y176-F180 HydrophobicContact CE2-CD1 3.36Å; Y176-F180 AromaticContact CE2-CE1 3.92Å; Y176-F180 HydrophobicContact CE2-CE1 3.92Å; Y176-F180 HydrophobicContact CE2-CG 4.27Å; Y176-F180 WeakPolarHBondContact O-CB 3.27Å; Y176-F180 PolarHBondContact O-N 3.02Å; F180-A184 WeakPolarHBondContact O-CB 3.35Å; F180-A184 PolarHBondContact O-N 2.88Å; F180-C185 PolarHBondContact O-N 3.29Å; F180-C185 PolarHBondContact O-SG 3.03Å; F180-C185 VanDerWaalsContact O-SG 3.35Å
181N98.1Very high97.3Very high4 Ų433.5 Ų33.52%0.02117%0.174CC..Iπ-helixtrans-66.5-55.2-175.4-177.4-90.5000111.9Y176 M177 C185 V186 H250Y176-N181 HydrophobicContact CE1-CB 4.33Å; Y176-N181 PolarHBondContact O-N 3.22Å; M177-N181 WeakPolarHBondContact O-CB 3.37Å; M177-N181 HydrophobicContact SD-CB 4.47Å; N181-C185 CarbonylContact O-C 3.5Å; N181-C185 WeakPolarHBondContact O-CA 3.41Å; N181-C185 VanDerWaalsContact O-CB 3.3Å; N181-C185 WeakPolarHBondContact O-CB 3.27Å; N181-C185 PolarHBondContact O-N 3.46Å; N181-V186 VanDerWaalsContact O-CG2 3.29Å; N181-V186 WeakPolarHBondContact O-CG2 3.43Å; N181-V186 PolarHBondContact O-N 2.99Å; N181-H250 PolarHBondContact OD1-CE1 3Å; N181-H250 VanDerWaalsContact OD1-CE1 3.27Å
182F98.3Very high97.4Very high14 Ų1437.9 Ų37.96%0.06120%0.197CC..Iπ-helixtrans-73.7-63.5-176.7179.2-140.7000112.9M177 V178 V186 L187 L247 H250 C254M177-F182 WeakPolarHBondContact O-CB 3.41Å; M177-F182 PolarHBondContact O-N 3.3Å; V178-F182 WeakPolarHBondContact O-CB 3.23Å; F182-V186 HydrophobicContact CD2-CB 4.2Å; F182-V186 HydrophobicContact CD2-CG1 4.26Å; F182-V186 WeakPolarHBondContact O-CB 3.35Å; F182-V186 PolarHBondContact O-N 2.83Å; F182-L187 HydrophobicContact CE2-CB 4.31Å; F182-L187 WeakPolarHBondContact O-CB 3.4Å; F182-L187 PolarHBondContact O-N 3.13Å; F182-L247 HydrophobicContact CE2-CD2 3.8Å; F182-L247 HydrophobicContact CZ-CD2 4.04Å; F182-H250 HydrophobicContact CB-CB 4.32Å; F182-H250 HydrophobicContact CD1-CB 3.93Å; F182-H250 HydrophobicContact CD2-CB 3.45Å; F182-H250 VanDerWaalsContact CD2-CB 3.45Å; F182-H250 AromaticContact CD2-CD2 3.79Å; F182-H250 AromaticContact CD2-CG 3.39Å; F182-H250 AromaticContact CD2-ND1 3.77Å; F182-H250 HydrophobicContact CE1-CB 4.04Å; F182-H250 HydrophobicContact CE2-CB 3.59Å; F182-H250 AromaticContact CE2-CG 3.91Å; F182-H250 HydrophobicContact CG-CB 3.64Å; F182-H250 AromaticContact CG-CG 3.76Å; F182-H250 AromaticContact CG-ND1 3.82Å; F182-H250 HydrophobicContact CZ-CB 3.88Å; F182-C254 VanDerWaalsContact CD1-SG 3.57Å
183F98.1Very high97.4Very high77 Ų7737.9 Ų37.934%0.33820%0.197SC..Iπ-helixtrans-66.4-49.4-173.5-66.1-26.7000113.1V178 Y179 L187 V188 F258V178-F183 HydrophobicContact CG1-CD2 4.45Å; V178-F183 HydrophobicContact CG1-CE2 3.95Å; V178-F183 HydrophobicContact CG1-CZ 4.17Å; V178-F183 PolarHBondContact O-N 3.46Å; Y179-F183 AromaticContact CD1-CD2 3.97Å; Y179-F183 HydrophobicContact CD1-CD2 3.97Å; Y179-F183 HydrophobicContact CD1-CE2 4.08Å; Y179-F183 HydrophobicContact CE1-CE2 4.37Å; F183-L187 HydrophobicContact CD1-CD2 3.93Å; F183-V188 WeakPolarHBondContact O-CG2 3.35Å; F183-V188 PolarHBondContact O-N 3.24Å; F183-F258 HydrophobicContact CE2-CE2 4.36Å; F183-F258 HydrophobicContact CE2-CZ 4.1Å; F183-F258 HydrophobicContact CZ-CE2 4.12Å; F183-F258 HydrophobicContact CZ-CZ 4.31Å
184A97.9Very high97.4Very high49 Ų4942.1 Ų42.141%0.40522%0.219SC..Iπ-helixtrans-79.9-44.9-176.100000113Y179 F180Y179-A184 PolarHBondContact O-N 3.38Å; F180-A184 WeakPolarHBondContact O-CB 3.35Å; F180-A184 PolarHBondContact O-N 2.88Å
185C97.8Very high97.5Very high12 Ų1242.4 Ų42.48%0.08123%0.228CC..Iπ-helixtrans-95-21.5-169.8-60.70000115.1I135 F180 N181 P189I135-C185 HydrophobicContact CG2-CB 4.14Å; I135-C185 VanDerWaalsContact CG2-SG 3.59Å; F180-C185 PolarHBondContact O-N 3.29Å; F180-C185 PolarHBondContact O-SG 3.03Å; F180-C185 VanDerWaalsContact O-SG 3.35Å; N181-C185 CarbonylContact O-C 3.5Å; N181-C185 WeakPolarHBondContact O-CA 3.41Å; N181-C185 VanDerWaalsContact O-CB 3.3Å; N181-C185 WeakPolarHBondContact O-CB 3.27Å; N181-C185 PolarHBondContact O-N 3.46Å; C185-P189 VanDerWaalsContact O-CG 3.31Å; C185-P189 WeakPolarHBondContact O-CG 3.23Å
186V97Very high97.5Very high1 Ų140.8 Ų40.81%0.00622%0.221CC..Iπ-helixtrans-109.2-55.3179.7175.60000111.6I92 N181 F182 P189 L190I92-V186 HydrophobicContact CD1-CB 4.17Å; I92-V186 HydrophobicContact CD1-CG1 4.34Å; I92-V186 HydrophobicContact CD1-CG2 3.62Å; N181-V186 VanDerWaalsContact O-CG2 3.29Å; N181-V186 WeakPolarHBondContact O-CG2 3.43Å; N181-V186 PolarHBondContact O-N 2.99Å; F182-V186 HydrophobicContact CD2-CB 4.2Å; F182-V186 HydrophobicContact CD2-CG1 4.26Å; F182-V186 WeakPolarHBondContact O-CB 3.35Å; F182-V186 PolarHBondContact O-N 2.83Å; V186-P189 WeakPolarHBondContact O-CD 3.42Å; V186-L190 HydrophobicContact CG1-CD1 3.81Å; V186-L190 HydrophobicContact CG1-CG 4.42Å; V186-L190 WeakPolarHBondContact O-CB 3.49Å; V186-L190 VanDerWaalsContact O-CG 3.27Å; V186-L190 WeakPolarHBondContact O-CG 3.22Å; V186-L190 PolarHBondContact O-N 2.9Å
187L97.1Very high97.4Very high55 Ų5541.2 Ų41.229%0.28822%0.222SC..Iπ-helixtrans-67.9-44.9-172.5-174.763.3000112F182 F183 L190 L191F182-L187 HydrophobicContact CE2-CB 4.31Å; F182-L187 WeakPolarHBondContact O-CB 3.4Å; F182-L187 PolarHBondContact O-N 3.13Å; F183-L187 HydrophobicContact CD1-CD2 3.93Å; L187-L190 PolarHBondContact O-N 2.96Å; L187-L191 HydrophobicContact CD1-CD1 4.47Å; L187-L191 HydrophobicContact CD1-CG 4.37Å; L187-L191 HydrophobicContact CG-CD1 4.17Å; L187-L191 HydrophobicContact CG-CG 4.47Å; L187-L191 VanDerWaalsContact O-CG 3.3Å; L187-L191 WeakPolarHBondContact O-CG 3.46Å; L187-L191 PolarHBondContact O-N 3.44Å
188V97.5Very high97.3Very high75 Ų7545.5 Ų45.546%0.45525%0.245SC..Hα-helixtrans-59.7-51.9177.2167.10000111.6F183 L190 L191 L192F183-V188 WeakPolarHBondContact O-CG2 3.35Å; F183-V188 PolarHBondContact O-N 3.24Å; V188-L190 VanDerWaalsContact C-N 3.34Å; V188-L190 PolarHBondContact O-N 3.24Å; V188-L191 PolarHBondContact O-N 3.4Å; V188-L192 HydrophobicContact CG1-CD1 4.13Å; V188-L192 HydrophobicContact CG1-CG 4.46Å; V188-L192 WeakPolarHBondContact O-CG 3.47Å; V188-L192 PolarHBondContact O-N 2.91Å
189P96.6Very high97.2Very high12 Ų1253 Ų538%0.07827%0.273CS..Hα-helixtrans-59.9-37.3174.2-30.940.5000114.7I92 C185 V186 L192 M193I92-P189 HydrophobicContact CG2-CB 3.41Å; I92-P189 VanDerWaalsContact CG2-CB 3.41Å; I92-P189 HydrophobicContact CG2-CG 3.91Å; C185-P189 VanDerWaalsContact O-CG 3.31Å; C185-P189 WeakPolarHBondContact O-CG 3.23Å; V186-P189 WeakPolarHBondContact O-CD 3.42Å; P189-L192 PolarHBondContact O-N 3.34Å; P189-M193 WeakPolarHBondContact O-CG 3.37Å; P189-M193 PolarHBondContact O-N 2.9Å
190L96.4Very high97Very high18 Ų1847.4 Ų47.49%0.09425%0.251CS..Hα-helixtrans-60.6-45.6174.3-79.7176.9000111.9V186 L187 V188 M193 L194 V239 F242 A243V186-L190 HydrophobicContact CG1-CD1 3.81Å; V186-L190 HydrophobicContact CG1-CG 4.42Å; V186-L190 WeakPolarHBondContact O-CB 3.49Å; V186-L190 VanDerWaalsContact O-CG 3.27Å; V186-L190 WeakPolarHBondContact O-CG 3.22Å; V186-L190 PolarHBondContact O-N 2.9Å; L187-L190 PolarHBondContact O-N 2.96Å; V188-L190 VanDerWaalsContact C-N 3.34Å; V188-L190 PolarHBondContact O-N 3.24Å; L190-M193 HydrophobicContact CD2-CE 3.76Å; L190-M193 HydrophobicContact CG-CE 4.42Å; L190-M193 PolarHBondContact O-N 2.97Å; L190-L194 WeakPolarHBondContact O-CB 3.46Å; L190-L194 PolarHBondContact O-N 3.22Å; L190-V239 HydrophobicContact CD2-CG1 4.35Å; L190-F242 HydrophobicContact CD2-CD1 3.99Å; L190-F242 HydrophobicContact CD2-CE1 4.45Å; L190-A243 HydrophobicContact CD1-CB 4.26Å; L190-A243 HydrophobicContact CD2-CB 4.09Å
191L97Very high96.8Very high100 Ų10047.9 Ų47.952%0.52425%0.253SS..Hα-helixtrans-65.7-38.4176.7-68.3175.8000111.8L187 V188 L194 G195L187-L191 HydrophobicContact CD1-CD1 4.47Å; L187-L191 HydrophobicContact CD1-CG 4.37Å; L187-L191 HydrophobicContact CG-CD1 4.17Å; L187-L191 HydrophobicContact CG-CG 4.47Å; L187-L191 VanDerWaalsContact O-CG 3.3Å; L187-L191 WeakPolarHBondContact O-CG 3.46Å; L187-L191 PolarHBondContact O-N 3.44Å; V188-L191 PolarHBondContact O-N 3.4Å; L191-L194 PolarHBondContact O-N 3.26Å; L191-G195 PolarHBondContact O-N 2.93Å
192L97.3Very high96.7Very high96 Ų9651.8 Ų51.850%0.50327%0.274SS..Hα-helixtrans-61.9-48.3173.3-71.8174.8000111.3L96 V188 P189 L194 G195 V196L96-L192 HydrophobicContact CD1-CB 4.27Å; V188-L192 HydrophobicContact CG1-CD1 4.13Å; V188-L192 HydrophobicContact CG1-CG 4.46Å; V188-L192 WeakPolarHBondContact O-CG 3.47Å; V188-L192 PolarHBondContact O-N 2.91Å; P189-L192 PolarHBondContact O-N 3.34Å; L192-L194 VanDerWaalsContact C-N 3.33Å; L192-L194 PolarHBondContact O-N 3.05Å; L192-G195 PolarHBondContact O-N 3.29Å; L192-V196 VanDerWaalsContact O-CG2 3.27Å; L192-V196 WeakPolarHBondContact O-CG2 3.3Å; L192-V196 PolarHBondContact O-N 3.11Å
193M96.8Very high96.4Very high0 Ų051.3 Ų51.30%027%0.272CS..Hα-helixtrans-60-43.5176.2-74.1-173.1-74.500111.7L95 L96 A99 P189 L190 G195 V196 Y197 V239L95-M193 VanDerWaalsContact C-SD 3.51Å; L95-M193 HydrophobicContact CB-CE 4.33Å; L95-M193 HydrophobicContact CB-SD 3.54Å; L95-M193 VanDerWaalsContact CB-SD 3.54Å; L96-M193 HydrophobicContact CB-CG 4.17Å; L96-M193 HydrophobicContact CB-SD 4.27Å; L96-M193 HydrophobicContact CD1-CG 3.71Å; L96-M193 PolarHBondContact N-SD 3.49Å; A99-M193 HydrophobicContact CB-CG 4.18Å; P189-M193 WeakPolarHBondContact O-CG 3.37Å; P189-M193 PolarHBondContact O-N 2.9Å; L190-M193 HydrophobicContact CD2-CE 3.76Å; L190-M193 HydrophobicContact CG-CE 4.42Å; L190-M193 PolarHBondContact O-N 2.97Å; M193-G195 PolarHBondContact O-N 3.49Å; M193-V196 PolarHBondContact O-N 3.45Å; M193-Y197 WeakPolarHBondContact O-CD2 3.36Å; M193-Y197 PolarHBondContact O-N 3.14Å; M193-V239 HydrophobicContact CB-CG1 4.08Å; M193-V239 HydrophobicContact CE-CG1 3.99Å; M193-V239 HydrophobicContact SD-CG1 3.96Å; M193-V239 HydrophobicContact SD-CG2 3.83Å
194L96.3Very high96.1Very high96 Ų9647.7 Ų47.750%0.50326%0.257SS..Hα-helixtrans-57.4-50.1174.8177.862.3000110.9L190 L191 L192 V196 Y197 L198L190-L194 WeakPolarHBondContact O-CB 3.46Å; L190-L194 PolarHBondContact O-N 3.22Å; L191-L194 PolarHBondContact O-N 3.26Å; L192-L194 VanDerWaalsContact C-N 3.33Å; L192-L194 PolarHBondContact O-N 3.05Å; L194-V196 VanDerWaalsContact C-N 3.32Å; L194-V196 PolarHBondContact O-N 3.37Å; L194-Y197 PolarHBondContact O-N 3.46Å; L194-L198 HydrophobicContact CD1-CD1 4.2Å; L194-L198 HydrophobicContact CD1-CG 4.21Å; L194-L198 HydrophobicContact CG-CD1 4.06Å; L194-L198 HydrophobicContact CG-CG 4.48Å; L194-L198 WeakPolarHBondContact O-CB 3.38Å; L194-L198 VanDerWaalsContact O-CG 3.25Å; L194-L198 WeakPolarHBondContact O-CG 3.49Å; L194-L198 PolarHBondContact O-N 3.37Å
195G96.7Very high95.8Very high33 Ų3354.6 Ų54.634%0.3427%0.272SS..Hα-helixtrans-57.1-44.1176.200000112.6L191 L192 M193 L198 R199L191-G195 PolarHBondContact O-N 2.93Å; L192-G195 PolarHBondContact O-N 3.29Å; M193-G195 PolarHBondContact O-N 3.49Å; G195-L198 PolarHBondContact O-N 2.67Å; G195-R199 VanDerWaalsContact O-CG 3.25Å; G195-R199 WeakPolarHBondContact O-CG 3.44Å; G195-R199 PolarHBondContact O-N 2.95Å
196V97Very high95.4Very high28 Ų2862.2 Ų62.217%0.1730%0.299CS..Hα-helixtrans-62.3-50177.3172.60000111.2A99 Y103 L192 M193 L194 L198 R199 I200A99-V196 HydrophobicContact CB-CB 4.45Å; A99-V196 HydrophobicContact CB-CG1 4Å; A99-V196 WeakPolarHBondContact O-CG1 3.33Å; Y103-V196 HydrophobicContact CD2-CG1 4.37Å; Y103-V196 HydrophobicContact CG-CG1 4.19Å; L192-V196 VanDerWaalsContact O-CG2 3.27Å; L192-V196 WeakPolarHBondContact O-CG2 3.3Å; L192-V196 PolarHBondContact O-N 3.11Å; M193-V196 PolarHBondContact O-N 3.45Å; L194-V196 VanDerWaalsContact C-N 3.32Å; L194-V196 PolarHBondContact O-N 3.37Å; V196-L198 PolarHBondContact O-N 2.93Å; V196-R199 WeakPolarHBondContact O-CB 3.37Å; V196-R199 PolarHBondContact O-N 2.84Å; V196-I200 HydrophobicContact CG1-CD1 4.08Å; V196-I200 WeakPolarHBondContact O-CG1 3.36Å; V196-I200 PolarHBondContact O-N 3.39Å
197Y96.1Very high95.1Very high10 Ų1064.6 Ų64.64%0.03931%0.31CS..Hα-helixtrans-64.7-38.8179-79.9-65.4000112.9A99 M193 L194 R199 I200 F201 L235 A236 V239A99-Y197 HydrophobicContact CB-CD2 4.35Å; A99-Y197 HydrophobicContact CB-CE2 3.69Å; M193-Y197 WeakPolarHBondContact O-CD2 3.36Å; M193-Y197 PolarHBondContact O-N 3.14Å; L194-Y197 PolarHBondContact O-N 3.46Å; Y197-R199 VanDerWaalsContact C-N 3.31Å; Y197-R199 PolarHBondContact O-N 2.98Å; Y197-I200 HydrophobicContact CD1-CD1 3.93Å; Y197-I200 HydrophobicContact CE1-CD1 4.26Å; Y197-I200 WeakPolarHBondContact O-CB 3.28Å; Y197-I200 PolarHBondContact O-N 2.82Å; Y197-F201 HydrophobicContact CD1-CE2 4.43Å; Y197-F201 HydrophobicContact CD1-CZ 4.43Å; Y197-F201 WeakPolarHBondContact O-CD2 3.48Å; Y197-F201 WeakPolarHBondContact O-CG 3.29Å; Y197-F201 PolarHBondContact O-N 2.96Å; Y197-L235 WeakPolarHBondContact OH-CB 3.46Å; Y197-A236 HydrophobicContact CD1-CB 3.69Å; Y197-A236 HydrophobicContact CD2-CB 4.3Å; Y197-A236 HydrophobicContact CE1-CB 3.79Å; Y197-A236 HydrophobicContact CE2-CB 4.42Å; Y197-A236 HydrophobicContact CG-CB 3.96Å; Y197-V239 HydrophobicContact CE2-CB 4.25Å; Y197-V239 HydrophobicContact CE2-CG2 3.73Å
198L95.9Very high94.6Very high95 Ų9563.8 Ų63.850%0.49731%0.306SS..Hα-helixtrans-58.9-44.7172.8-71.8173.7000111L194 G195 V196 I200 F201 L202L194-L198 HydrophobicContact CD1-CD1 4.2Å; L194-L198 HydrophobicContact CD1-CG 4.21Å; L194-L198 HydrophobicContact CG-CD1 4.06Å; L194-L198 HydrophobicContact CG-CG 4.48Å; L194-L198 WeakPolarHBondContact O-CB 3.38Å; L194-L198 VanDerWaalsContact O-CG 3.25Å; L194-L198 WeakPolarHBondContact O-CG 3.49Å; L194-L198 PolarHBondContact O-N 3.37Å; G195-L198 PolarHBondContact O-N 2.67Å; V196-L198 PolarHBondContact O-N 2.93Å; L198-I200 PolarHBondContact O-N 3.4Å; L198-F201 PolarHBondContact O-N 2.82Å; L198-L202 WeakPolarHBondContact O-CB 3.19Å; L198-L202 WeakPolarHBondContact O-CG 3.4Å; L198-L202 PolarHBondContact O-N 3.38Å
199R96.3Very high94.2Very high160 Ų16067.7 Ų67.760%0.60432%0.317SS*.Hα-helixtrans-64.4-37.8175.6-67.7-70.4-172.9-179.32112.3Y103 G195 V196 Y197 A203Y103-R199 HydrophobicContact CD2-CB 4.34Å; Y103-R199 HydrophobicContact CE2-CB 3.84Å; G195-R199 VanDerWaalsContact O-CG 3.25Å; G195-R199 WeakPolarHBondContact O-CG 3.44Å; G195-R199 PolarHBondContact O-N 2.95Å; V196-R199 WeakPolarHBondContact O-CB 3.37Å; V196-R199 PolarHBondContact O-N 2.84Å; Y197-R199 VanDerWaalsContact C-N 3.31Å; Y197-R199 PolarHBondContact O-N 2.98Å; R199-A203 WeakPolarHBondContact O-CB 3.3Å; R199-A203 PolarHBondContact O-N 3.18Å
200I94.9Very high93.7Very high0 Ų073 Ų730%034%0.34CS..Hα-helixtrans-58.3-55.1173.4-71.1170.8000110.3R102 Y103 I106 V196 Y197 L198 L202 A203 A204 A232R102-I200 HydrophobicContact CB-CD1 3.98Å; Y103-I200 HydrophobicContact CD2-CG1 3.94Å; Y103-I200 HydrophobicContact CG-CG1 4.48Å; I106-I200 HydrophobicContact CD1-CG2 3.42Å; I106-I200 VanDerWaalsContact CD1-CG2 3.42Å; V196-I200 HydrophobicContact CG1-CD1 4.08Å; V196-I200 WeakPolarHBondContact O-CG1 3.36Å; V196-I200 PolarHBondContact O-N 3.39Å; Y197-I200 HydrophobicContact CD1-CD1 3.93Å; Y197-I200 HydrophobicContact CE1-CD1 4.26Å; Y197-I200 WeakPolarHBondContact O-CB 3.28Å; Y197-I200 PolarHBondContact O-N 2.82Å; L198-I200 PolarHBondContact O-N 3.4Å; I200-L202 VanDerWaalsContact C-N 3.34Å; I200-L202 PolarHBondContact O-N 3.35Å; I200-A203 PolarHBondContact O-N 2.87Å; I200-A204 WeakPolarHBondContact O-CB 3.43Å; I200-A204 PolarHBondContact O-N 3.25Å; I200-A232 HydrophobicContact CG2-CB 3.97Å
201F94.8Very high93.1Very high70 Ų7074.9 Ų74.931%0.30735%0.35SS..Hα-helixtrans-65.7-37.7-176.1-63.7-51.4000112.3Y197 L198 R205 K233 A236Y197-F201 HydrophobicContact CD1-CE2 4.43Å; Y197-F201 HydrophobicContact CD1-CZ 4.43Å; Y197-F201 WeakPolarHBondContact O-CD2 3.48Å; Y197-F201 WeakPolarHBondContact O-CG 3.29Å; Y197-F201 PolarHBondContact O-N 2.96Å; L198-F201 PolarHBondContact O-N 2.82Å; F201-R205 WeakPolarHBondContact O-CB 3.36Å; F201-R205 PolarHBondContact O-N 3.41Å; F201-K233 HydrophobicContact CE1-CB 4.19Å; F201-K233 HydrophobicContact CZ-CB 4.41Å; F201-A236 HydrophobicContact CE2-CB 4.18Å; F201-A236 HydrophobicContact CZ-CB 3.88Å
202L95.1Very high92.4Very high87 Ų8775.9 Ų75.946%0.45535%0.352SS..Hα-helixtrans-65.5-42.3173.9-70.8173.7000112.1L198 I200 R205 R206L198-L202 WeakPolarHBondContact O-CB 3.19Å; L198-L202 WeakPolarHBondContact O-CG 3.4Å; L198-L202 PolarHBondContact O-N 3.38Å; I200-L202 VanDerWaalsContact C-N 3.34Å; I200-L202 PolarHBondContact O-N 3.35Å; L202-R205 PolarHBondContact O-N 3.45Å; L202-R206 VanDerWaalsContact O-CG 3.32Å; L202-R206 WeakPolarHBondContact O-CG 3.29Å; L202-R206 PolarHBondContact O-N 3.12Å
203A92.5Very high91.5Very high3 Ų375.8 Ų75.83%0.02536%0.359CS..Hα-helixtrans-65.2-45178.100000111.8R107 R199 I200 R205 R206 Q207R107-A203 VanDerWaalsContact CD-CB 3.45Å; R199-A203 WeakPolarHBondContact O-CB 3.3Å; R199-A203 PolarHBondContact O-N 3.18Å; I200-A203 PolarHBondContact O-N 2.87Å; A203-R205 PolarHBondContact O-N 2.87Å; A203-R206 PolarHBondContact O-N 3.11Å; A203-Q207 PolarHBondContact O-N 2.92Å
204A91Very high90.4Very high2 Ų282.5 Ų82.52%0.01739%0.39CS..Hα-helixtrans-61.6-43.1176.600000112.3I200 R206 Q207 L208 L225 V229I200-A204 WeakPolarHBondContact O-CB 3.43Å; I200-A204 PolarHBondContact O-N 3.25Å; A204-R206 VanDerWaalsContact C-N 3.31Å; A204-R206 PolarHBondContact O-N 3.3Å; A204-Q207 PolarHBondContact O-N 3.25Å; A204-L208 WeakPolarHBondContact O-CB 3.49Å; A204-L208 WeakPolarHBondContact O-CG 3.44Å; A204-L208 PolarHBondContact O-N 2.91Å; A204-L225 HydrophobicContact CB-CD1 4.4Å; A204-V229 HydrophobicContact CB-CG2 3.32Å
205R91.3Very high88.8Confident194 Ų19484.1 Ų84.173%0.73241%0.407SS*.Hα-helixtrans-61.8-39.5175.7-172.8178177.9-171.5-0.3111.8F201 L202 A203 K209F201-R205 WeakPolarHBondContact O-CB 3.36Å; F201-R205 PolarHBondContact O-N 3.41Å; L202-R205 PolarHBondContact O-N 3.45Å; A203-R205 PolarHBondContact O-N 2.87Å; R205-K209 WeakPolarHBondContact O-CB 3.29Å; R205-K209 PolarHBondContact O-N 3.05Å
206R90.9Very high87.4Confident171 Ų17189.2 Ų89.265%0.64543%0.426SS*.Hα-helixtrans-64.2-47175.5-72.5176.3-172.6-1451.6111.7L202 A203 A204 K209 Q210L202-R206 VanDerWaalsContact O-CG 3.32Å; L202-R206 WeakPolarHBondContact O-CG 3.29Å; L202-R206 PolarHBondContact O-N 3.12Å; A203-R206 PolarHBondContact O-N 3.11Å; A204-R206 VanDerWaalsContact C-N 3.31Å; A204-R206 PolarHBondContact O-N 3.3Å; R206-K209 PolarHBondContact O-N 3.12Å; R206-Q210 WeakPolarHBondContact O-CG 3.46Å; R206-Q210 PolarHBondContact O-N 3.42Å
207Q88.7Confident85.5Confident52 Ų5293.5 Ų93.524%0.24345%0.454CS..Hα-helixtrans-62.4-42.7178-73.5176.9-0.400111.8I106 A203 A204 K209 Q210 M211 L225I106-Q207 PolarHBondContact O-NE2 3.33Å; A203-Q207 PolarHBondContact O-N 2.92Å; A204-Q207 PolarHBondContact O-N 3.25Å; Q207-K209 PolarHBondContact O-N 2.98Å; Q207-Q210 PolarHBondContact O-N 3.02Å; Q207-M211 HydrophobicContact CB-CE 4.49Å; Q207-M211 VanDerWaalsContact O-CG 3.25Å; Q207-M211 WeakPolarHBondContact O-CG 3.43Å; Q207-M211 PolarHBondContact O-N 2.88Å; Q207-L225 HydrophobicContact CB-CD2 3.54Å; Q207-L225 VanDerWaalsContact OE1-CD1 3.32Å
208L87.2Confident84.5Confident38 Ų3894.6 Ų94.620%0.19947%0.468CS..Hα-helixtrans-62.2-43.3175.4-73.1170.9000112.2A204 Q210 M211 E212 R222 L225 Q226A204-L208 WeakPolarHBondContact O-CB 3.49Å; A204-L208 WeakPolarHBondContact O-CG 3.44Å; A204-L208 PolarHBondContact O-N 2.91Å; L208-Q210 VanDerWaalsContact C-N 3.34Å; L208-Q210 PolarHBondContact O-N 3.28Å; L208-M211 PolarHBondContact O-N 3.13Å; L208-E212 PolarHBondContact O-N 3.4Å; L208-R222 HydrophobicContact CD2-CG 4Å; L208-L225 HydrophobicContact CD2-CD2 3.81Å; L208-L225 HydrophobicContact CD2-CG 4.31Å; L208-L225 HydrophobicContact CG-CD2 3.73Å; L208-L225 HydrophobicContact CG-CG 4.39Å; L208-Q226 HydrophobicContact CD2-CG 4.25Å
209K88.9Confident83.8Confident157 Ų15797.6 Ų97.668%0.68348%0.479SS*.Hα-helixtrans-64.9-36.9177.3-170.5178.2-180-177.20112.4R205 R206 Q207 E212R205-K209 WeakPolarHBondContact O-CB 3.29Å; R205-K209 PolarHBondContact O-N 3.05Å; R206-K209 PolarHBondContact O-N 3.12Å; Q207-K209 PolarHBondContact O-N 2.98Å; K209-E212 PolarHBondContact O-N 2.92Å
210Q86.8Confident83.2Confident122 Ų122100.4 Ų100.457%0.5749%0.49SS*.Hα-helixtrans-67.4-38.5175.8-74.3171.8-24.200111.9R206 Q207 L208 E212 S213R206-Q210 WeakPolarHBondContact O-CG 3.46Å; R206-Q210 PolarHBondContact O-N 3.42Å; Q207-Q210 PolarHBondContact O-N 3.02Å; L208-Q210 VanDerWaalsContact C-N 3.34Å; L208-Q210 PolarHBondContact O-N 3.28Å; Q210-E212 VanDerWaalsContact C-N 3.27Å; Q210-E212 PolarHBondContact O-N 3.47Å; Q210-S213 PolarHBondContact O-N 3.45Å; Q210-S213 PolarHBondContact O-OG 3.21Å
211M84.6Confident82.8Confident58 Ų58102.8 Ų102.829%0.28651%0.51SS..Hα-helixtrans-66.5-27.3176.7-69171.6-173.100112.9Q207 L208 S213 A221 R222 L225Q207-M211 HydrophobicContact CB-CE 4.49Å; Q207-M211 VanDerWaalsContact O-CG 3.25Å; Q207-M211 WeakPolarHBondContact O-CG 3.43Å; Q207-M211 PolarHBondContact O-N 2.88Å; L208-M211 PolarHBondContact O-N 3.13Å; M211-S213 VanDerWaalsContact C-N 3.29Å; M211-S213 PolarHBondContact O-N 2.9Å; M211-A221 HydrophobicContact CE-CB 4.25Å; M211-R222 HydrophobicContact SD-CB 4.35Å; M211-L225 HydrophobicContact CE-CD2 4Å; M211-L225 HydrophobicContact SD-CD2 4.23Å
212E82Confident82.4Confident122 Ų122104 Ų10457%0.5751%0.513SS*.Hα-helixtrans-72.1-22.2175.8-72.7175167.400113.2L208 K209 Q210 R222L208-E212 PolarHBondContact O-N 3.4Å; K209-E212 PolarHBondContact O-N 2.92Å; Q210-E212 VanDerWaalsContact C-N 3.27Å; Q210-E212 PolarHBondContact O-N 3.47Å; E212-R222 IonicContact OE1-CZ 3.68Å; E212-R222 IonicContact OE1-NH1 3.16Å; E212-R222 IonicContact OE1-NH2 3.35Å; E212-R222 PolarHBondContact OE1-NH2 3.29Å
213S77.6Confident82.1Confident94 Ų94102 Ų10266%0.65751%0.506SS*.THydrogen-bonded Turntrans-88-8.8177.960.30000114.9Q210 M211Q210-S213 PolarHBondContact O-N 3.45Å; Q210-S213 PolarHBondContact O-OG 3.21Å; M211-S213 VanDerWaalsContact C-N 3.29Å; M211-S213 PolarHBondContact O-N 2.9Å
214Q74.5Confident81.9Confident140 Ų140105.7 Ų105.765%0.65453%0.528SS*.  trans-100.9125.4-178.2-76-176.3-10.100111.6L216Q214-L216 VanDerWaalsContact C-N 3.3Å; Q214-L216 PolarHBondContact O-N 3.11Å
215P61.4Low81.7Confident131 Ų131106.2 Ų106.285%0.85153%0.531SS*.  trans-78.55.7-174.328-33.6000116.2
216L67.5Low81.7Confident140 Ų140101.5 Ų101.573%0.73352%0.517SS*.SBendtrans-99.6155.8179.4-84.8110.9000112.1Q214 G218Q214-L216 VanDerWaalsContact C-N 3.3Å; Q214-L216 PolarHBondContact O-N 3.11Å; L216-G218 VanDerWaalsContact C-N 3.27Å; L216-G218 PolarHBondContact O-N 3.04Å
217P58Low81.6Confident118 Ų118100.1 Ų100.177%0.76652%0.515SS*.  trans-71.879.5-167.729.6-34.6000112E219P217-E219 PolarHBondContact O-N 3.49Å
218G74Confident81.6Confident32 Ų32100.7 Ų100.733%0.3352%0.518SS..  trans-78.313.5170.900000113.2L216 R220 A221 R222L216-G218 VanDerWaalsContact C-N 3.27Å; L216-G218 PolarHBondContact O-N 3.04Å; G218-R220 VanDerWaalsContact C-N 3.31Å; G218-R220 PolarHBondContact O-N 3.44Å; G218-A221 PolarHBondContact O-N 2.84Å; G218-A221 VanDerWaalsContact O-N 3.11Å; G218-R222 WeakPolarHBondContact O-CB 3.31Å; G218-R222 PolarHBondContact O-N 3.29Å
219E81.5Confident81.8Confident158 Ų158100.4 Ų100.474%0.73852%0.518SS*.Hα-helixtrans-57.8-42-175.9-66.5-170.8147.700112.5P217 R222 S223P217-E219 PolarHBondContact O-N 3.49Å; E219-R222 PolarHBondContact O-N 3.29Å; E219-S223 WeakPolarHBondContact O-CB 3.43Å; E219-S223 PolarHBondContact O-N 3.28Å
220R84.5Confident81.9Confident219 Ų21997.2 Ų97.283%0.82651%0.505SS*.Hα-helixtrans-63.9-45.1175.9-69.4-174.8-174.2168.33.1111.5G218 S223 T224G218-R220 VanDerWaalsContact C-N 3.31Å; G218-R220 PolarHBondContact O-N 3.44Å; R220-S223 PolarHBondContact O-N 3.22Å; R220-T224 PolarHBondContact O-N 2.89Å; R220-T224 PolarHBondContact O-OG1 2.97Å; R220-T224 VanDerWaalsContact O-OG1 3.06Å
221A85.3Confident82Confident51 Ų5192.8 Ų92.842%0.42149%0.489SS..Hα-helixtrans-64-43.1178.500000111.5M211 G218 T224 L225M211-A221 HydrophobicContact CE-CB 4.25Å; G218-A221 PolarHBondContact O-N 2.84Å; G218-A221 VanDerWaalsContact O-N 3.11Å; A221-T224 PolarHBondContact O-N 3.22Å; A221-L225 WeakPolarHBondContact O-CB 3.39Å; A221-L225 PolarHBondContact O-N 3.31Å
222R87Confident82.4Confident96 Ų9690 Ų9036%0.36248%0.476SS..Hα-helixtrans-60-48.4174.6-174.4-178.8-174.5145.313.2111.3L208 M211 E212 G218 E219 T224 L225 Q226L208-R222 HydrophobicContact CD2-CG 4Å; M211-R222 HydrophobicContact SD-CB 4.35Å; E212-R222 IonicContact OE1-CZ 3.68Å; E212-R222 IonicContact OE1-NH1 3.16Å; E212-R222 IonicContact OE1-NH2 3.35Å; E212-R222 PolarHBondContact OE1-NH2 3.29Å; G218-R222 WeakPolarHBondContact O-CB 3.31Å; G218-R222 PolarHBondContact O-N 3.29Å; E219-R222 PolarHBondContact O-N 3.29Å; R222-T224 PolarHBondContact O-N 3.39Å; R222-L225 PolarHBondContact O-N 3.14Å; R222-Q226 WeakPolarHBondContact O-CB 3.4Å; R222-Q226 VanDerWaalsContact O-CG 3.29Å; R222-Q226 WeakPolarHBondContact O-CG 2.95Å; R222-Q226 PolarHBondContact O-N 2.98Å
223S88.5Confident83Confident45 Ų4589.8 Ų89.832%0.31547%0.473SS..Hα-helixtrans-59.3-46.4176.7147.20000111.6E219 R220 Q226 K227E219-S223 WeakPolarHBondContact O-CB 3.43Å; E219-S223 PolarHBondContact O-N 3.28Å; R220-S223 PolarHBondContact O-N 3.22Å; S223-Q226 PolarHBondContact O-N 3.27Å; S223-K227 WeakPolarHBondContact O-CG 3.34Å; S223-K227 PolarHBondContact O-N 3.36Å
224T88.5Confident83.7Confident80 Ų8085.4 Ų85.449%0.49144%0.442SS..Hα-helixtrans-62-46.8178.4-610000111.1R220 A221 R222 Q226 K227 E228R220-T224 PolarHBondContact O-N 2.89Å; R220-T224 PolarHBondContact O-OG1 2.97Å; R220-T224 VanDerWaalsContact O-OG1 3.06Å; A221-T224 PolarHBondContact O-N 3.22Å; R222-T224 PolarHBondContact O-N 3.39Å; T224-Q226 PolarHBondContact O-N 3Å; T224-K227 WeakPolarHBondContact O-CB 3.38Å; T224-K227 PolarHBondContact O-N 3.19Å; T224-E228 WeakPolarHBondContact O-CG 3.46Å; T224-E228 PolarHBondContact O-N 3.37Å
225L87.9Confident84.5Confident13 Ų1379.1 Ų79.17%0.06841%0.413CS..Hα-helixtrans-61.2-43176.8179.458.7000112A204 Q207 L208 M211 A221 R222 K227 E228 V229A204-L225 HydrophobicContact CB-CD1 4.4Å; Q207-L225 HydrophobicContact CB-CD2 3.54Å; Q207-L225 VanDerWaalsContact OE1-CD1 3.32Å; L208-L225 HydrophobicContact CD2-CD2 3.81Å; L208-L225 HydrophobicContact CD2-CG 4.31Å; L208-L225 HydrophobicContact CG-CD2 3.73Å; L208-L225 HydrophobicContact CG-CG 4.39Å; M211-L225 HydrophobicContact CE-CD2 4Å; M211-L225 HydrophobicContact SD-CD2 4.23Å; A221-L225 WeakPolarHBondContact O-CB 3.39Å; A221-L225 PolarHBondContact O-N 3.31Å; R222-L225 PolarHBondContact O-N 3.14Å; L225-K227 VanDerWaalsContact C-N 3.3Å; L225-K227 PolarHBondContact O-N 3.34Å; L225-E228 PolarHBondContact O-N 3.3Å; L225-V229 HydrophobicContact CD1-CG2 4.11Å; L225-V229 HydrophobicContact CG-CG2 4.37Å; L225-V229 WeakPolarHBondContact O-CB 3.38Å; L225-V229 WeakPolarHBondContact O-CG2 3.46Å; L225-V229 PolarHBondContact O-N 3.25Å
226Q91Very high86Confident95 Ų9574 Ų7444%0.44438%0.381SS..Hα-helixtrans-61.2-38.2176.2-76.5176.1-24.400112.3L208 R222 S223 T224 H230L208-Q226 HydrophobicContact CD2-CG 4.25Å; R222-Q226 WeakPolarHBondContact O-CB 3.4Å; R222-Q226 VanDerWaalsContact O-CG 3.29Å; R222-Q226 WeakPolarHBondContact O-CG 2.95Å; R222-Q226 PolarHBondContact O-N 2.98Å; S223-Q226 PolarHBondContact O-N 3.27Å; T224-Q226 PolarHBondContact O-N 3Å; Q226-H230 WeakPolarHBondContact O-CB 3.38Å; Q226-H230 PolarHBondContact O-N 2.8Å
227K89.4Confident87.4Confident141 Ų14170.5 Ų70.561%0.61336%0.363SS*.Hα-helixtrans-64.6-45.8174.2-71.2174.2-174.3179.30111.7S223 T224 L225 V229 H230 A231S223-K227 WeakPolarHBondContact O-CG 3.34Å; S223-K227 PolarHBondContact O-N 3.36Å; T224-K227 WeakPolarHBondContact O-CB 3.38Å; T224-K227 PolarHBondContact O-N 3.19Å; L225-K227 VanDerWaalsContact C-N 3.3Å; L225-K227 PolarHBondContact O-N 3.34Å; K227-V229 PolarHBondContact O-N 3.03Å; K227-H230 PolarHBondContact O-N 3.44Å; K227-A231 PolarHBondContact O-N 3.47Å
228E87.7Confident89.1Confident65 Ų6565 Ų6530%0.30433%0.327SS..Hα-helixtrans-62.2-41.4176.5-69.6-61.2156.700112R102 I106 T224 L225 A231 A232R102-E228 IonicContact NH1-OE2 3.77Å; R102-E228 PolarHBondContact NH1-OE2 2.72Å; I106-E228 HydrophobicContact CD1-CB 4.45Å; I106-E228 HydrophobicContact CG1-CB 4.21Å; T224-E228 WeakPolarHBondContact O-CG 3.46Å; T224-E228 PolarHBondContact O-N 3.37Å; L225-E228 PolarHBondContact O-N 3.3Å; E228-A231 PolarHBondContact O-N 2.63Å; E228-A232 WeakPolarHBondContact O-CB 3.17Å; E228-A232 PolarHBondContact O-N 3.23Å
229V91.1Very high90Very high32 Ų3264 Ų6419%0.19432%0.315CS..Hα-helixtrans-65.2-41175.6172.50000111.4A204 L225 K227 A231 A232 K233A204-V229 HydrophobicContact CB-CG2 3.32Å; L225-V229 HydrophobicContact CD1-CG2 4.11Å; L225-V229 HydrophobicContact CG-CG2 4.37Å; L225-V229 WeakPolarHBondContact O-CB 3.38Å; L225-V229 WeakPolarHBondContact O-CG2 3.46Å; L225-V229 PolarHBondContact O-N 3.25Å; K227-V229 PolarHBondContact O-N 3.03Å; V229-A231 VanDerWaalsContact C-N 3.33Å; V229-A232 PolarHBondContact O-N 3.5Å; V229-K233 VanDerWaalsContact O-CB 3.29Å; V229-K233 WeakPolarHBondContact O-CB 3.34Å; V229-K233 PolarHBondContact O-N 3.23Å
230H91.7Very high90.7Very high90 Ų9058.5 Ų58.542%0.41730%0.3SS..Hα-helixtrans-64.3-40175.6176.574.8000111.7Q226 K227 K233 S234 R291Q226-H230 WeakPolarHBondContact O-CB 3.38Å; Q226-H230 PolarHBondContact O-N 2.8Å; K227-H230 PolarHBondContact O-N 3.44Å; H230-K233 PolarHBondContact O-N 3.47Å; H230-S234 PolarHBondContact O-N 3.35Å; H230-S234 PolarHBondContact O-OG 3.07Å; H230-R291 PolarHBondContact CE1-NH2 3.29Å; H230-R291 PolarHBondContact ND1-NH2 3.3Å; H230-R291 PolarHBondContact NE2-O 3.26Å; H230-R291 PolarHBondContact O-NH2 2.75Å
231A89.7Confident91.2Very high28 Ų2850.3 Ų50.323%0.23127%0.272CS..Hα-helixtrans-62.7-50.5173.300000111.3K227 E228 V229 K233 S234 L235K227-A231 PolarHBondContact O-N 3.47Å; E228-A231 PolarHBondContact O-N 2.63Å; V229-A231 VanDerWaalsContact C-N 3.33Å; A231-K233 VanDerWaalsContact C-N 3.32Å; A231-K233 PolarHBondContact O-N 2.96Å; A231-S234 WeakPolarHBondContact O-CA 3.37Å; A231-S234 VanDerWaalsContact O-CB 3.28Å; A231-S234 WeakPolarHBondContact O-CB 3.34Å; A231-S234 PolarHBondContact O-N 2.93Å; A231-L235 WeakPolarHBondContact O-CG 3.46Å; A231-L235 PolarHBondContact O-N 3.02Å
232A91.8Very high91.6Very high0 Ų047.9 Ų47.90%025%0.252CS..Hα-helixtrans-59.2-40.3176.100000112.4I106 I200 E228 V229 S234 L235 A236I106-A232 HydrophobicContact CD1-CB 4.05Å; I200-A232 HydrophobicContact CG2-CB 3.97Å; E228-A232 WeakPolarHBondContact O-CB 3.17Å; E228-A232 PolarHBondContact O-N 3.23Å; V229-A232 PolarHBondContact O-N 3.5Å; A232-S234 PolarHBondContact O-N 3.48Å; A232-L235 PolarHBondContact O-N 2.64Å; A232-A236 WeakPolarHBondContact O-CB 3.4Å; A232-A236 PolarHBondContact O-N 3.32Å
233K94.1Very high92.1Very high118 Ų11844.3 Ų44.351%0.51324%0.243SC..Hα-helixtrans-61.2-34.3172.9-172.3-176.8174.6176.50111.6F201 V229 H230 A231 I237 R291F201-K233 HydrophobicContact CE1-CB 4.19Å; F201-K233 HydrophobicContact CZ-CB 4.41Å; V229-K233 VanDerWaalsContact O-CB 3.29Å; V229-K233 WeakPolarHBondContact O-CB 3.34Å; V229-K233 PolarHBondContact O-N 3.23Å; H230-K233 PolarHBondContact O-N 3.47Å; A231-K233 VanDerWaalsContact C-N 3.32Å; A231-K233 PolarHBondContact O-N 2.96Å; K233-I237 WeakPolarHBondContact O-CG1 3.47Å; K233-I237 PolarHBondContact O-N 3.31Å; K233-R291 PolarHBondContact O-NH1 2.71Å
234S92.1Very high92.5Very high1 Ų147.7 Ų47.71%0.00726%0.257CS..Hα-helixtrans-68.3-43.9178-53.90000111.3H230 A231 A232 I237 I238 R291H230-S234 PolarHBondContact O-N 3.35Å; H230-S234 PolarHBondContact O-OG 3.07Å; A231-S234 WeakPolarHBondContact O-CA 3.37Å; A231-S234 VanDerWaalsContact O-CB 3.28Å; A231-S234 WeakPolarHBondContact O-CB 3.34Å; A231-S234 PolarHBondContact O-N 2.93Å; A232-S234 PolarHBondContact O-N 3.48Å; S234-I237 PolarHBondContact O-N 3.2Å; S234-I238 PolarHBondContact O-N 3.16Å; S234-R291 WeakPolarHBondContact OG-CB 3.42Å; S234-R291 PolarHBondContact OG-NE 3.03Å; S234-R291 PolarHBondContact OG-NH2 3.03Å
235L91.5Very high92.9Very high9 Ų944.2 Ų44.25%0.04724%0.236CC..Hα-helixtrans-72-33.4178.7-59.1166.1000112.1T41 I98 R102 Y197 A231 A232 I237 I238 V239 Y288T41-L235 HydrophobicContact CG2-CD1 4.31Å; I98-L235 HydrophobicContact CG2-CB 4.06Å; I98-L235 HydrophobicContact CG2-CD1 3.64Å; I98-L235 HydrophobicContact CG2-CD2 3.97Å; I98-L235 HydrophobicContact CG2-CG 4.07Å; R102-L235 HydrophobicContact CG-CD1 3.52Å; Y197-L235 WeakPolarHBondContact OH-CB 3.46Å; A231-L235 WeakPolarHBondContact O-CG 3.46Å; A231-L235 PolarHBondContact O-N 3.02Å; A232-L235 PolarHBondContact O-N 2.64Å; L235-I237 VanDerWaalsContact C-N 3.32Å; L235-I237 PolarHBondContact O-N 3.23Å; L235-I238 HydrophobicContact CD2-CD1 4.2Å; L235-I238 WeakPolarHBondContact O-CB 3.49Å; L235-I238 PolarHBondContact O-N 2.8Å; L235-I238 VanDerWaalsContact O-N 3.14Å; L235-V239 PolarHBondContact O-N 2.95Å; L235-Y288 HydrophobicContact CD2-CE1 4.33Å
236A94.4Very high93.3Very high22 Ų2244.6 Ų44.618%0.18224%0.236CC..Hα-helixtrans-63.4-35.9172.300000112.7Y197 F201 A232 I238 V239 G240Y197-A236 HydrophobicContact CD1-CB 3.69Å; Y197-A236 HydrophobicContact CD2-CB 4.3Å; Y197-A236 HydrophobicContact CE1-CB 3.79Å; Y197-A236 HydrophobicContact CE2-CB 4.42Å; Y197-A236 HydrophobicContact CG-CB 3.96Å; F201-A236 HydrophobicContact CE2-CB 4.18Å; F201-A236 HydrophobicContact CZ-CB 3.88Å; A232-A236 WeakPolarHBondContact O-CB 3.4Å; A232-A236 PolarHBondContact O-N 3.32Å; A236-I238 VanDerWaalsContact C-N 3.29Å; A236-I238 PolarHBondContact O-N 3.28Å; A236-V239 PolarHBondContact O-N 2.91Å; A236-G240 PolarHBondContact O-N 3.49Å
237I95.4Very high93.6Very high67 Ų6742.6 Ų42.634%0.34423%0.229SC..Hα-helixtrans-61.6-41173.2-72.4-174000110.5K233 S234 L235 V239 G240 L241 I287K233-I237 WeakPolarHBondContact O-CG1 3.47Å; K233-I237 PolarHBondContact O-N 3.31Å; S234-I237 PolarHBondContact O-N 3.2Å; L235-I237 VanDerWaalsContact C-N 3.32Å; L235-I237 PolarHBondContact O-N 3.23Å; I237-V239 VanDerWaalsContact C-N 3.32Å; I237-V239 PolarHBondContact O-N 2.94Å; I237-G240 PolarHBondContact O-N 3.5Å; I237-L241 HydrophobicContact CG2-CD1 3.85Å; I237-L241 HydrophobicContact CG2-CG 4.19Å; I237-L241 WeakPolarHBondContact O-CG 3.4Å; I237-L241 PolarHBondContact O-N 2.91Å; I237-I287 HydrophobicContact CG2-CD1 4.1Å
238I93.6Very high94Very high3 Ų338 Ų382%0.01521%0.213CC..Hα-helixtrans-59.9-44.7178.1-62.8175.7000110.5L95 S234 L235 A236 G240 L241 F242 N284 I287 Y288L95-I238 HydrophobicContact CD2-CG2 3.62Å; S234-I238 PolarHBondContact O-N 3.16Å; L235-I238 HydrophobicContact CD2-CD1 4.2Å; L235-I238 WeakPolarHBondContact O-CB 3.49Å; L235-I238 PolarHBondContact O-N 2.8Å; L235-I238 VanDerWaalsContact O-N 3.14Å; A236-I238 VanDerWaalsContact C-N 3.29Å; A236-I238 PolarHBondContact O-N 3.28Å; I238-G240 PolarHBondContact O-N 3.3Å; I238-L241 PolarHBondContact O-N 3.07Å; I238-F242 PolarHBondContact O-N 3.41Å; I238-N284 WeakPolarHBondContact CG2-OD1 3.39Å; I238-I287 HydrophobicContact CD1-CG2 4.19Å; I238-I287 HydrophobicContact CG1-CB 4.25Å; I238-I287 HydrophobicContact CG1-CG1 4.46Å; I238-I287 HydrophobicContact CG1-CG2 3.86Å; I238-Y288 HydrophobicContact CD1-CD1 4.22Å; I238-Y288 HydrophobicContact CD1-CE1 3.37Å
239V93.5Very high94.5Very high12 Ų1236.1 Ų36.17%0.07321%0.205CC..Hα-helixtrans-63.7-40.9175.9176.80000112.2L95 L190 M193 Y197 L235 A236 I237 L241 F242 A243L95-V239 HydrophobicContact CB-CG2 4.21Å; L95-V239 HydrophobicContact CD1-CG2 4.48Å; L95-V239 HydrophobicContact CD2-CG2 4.16Å; L190-V239 HydrophobicContact CD2-CG1 4.35Å; M193-V239 HydrophobicContact CB-CG1 4.08Å; M193-V239 HydrophobicContact CE-CG1 3.99Å; M193-V239 HydrophobicContact SD-CG1 3.96Å; M193-V239 HydrophobicContact SD-CG2 3.83Å; Y197-V239 HydrophobicContact CE2-CB 4.25Å; Y197-V239 HydrophobicContact CE2-CG2 3.73Å; L235-V239 PolarHBondContact O-N 2.95Å; A236-V239 PolarHBondContact O-N 2.91Å; I237-V239 VanDerWaalsContact C-N 3.32Å; I237-V239 PolarHBondContact O-N 2.94Å; V239-L241 PolarHBondContact O-N 3.44Å; V239-F242 WeakPolarHBondContact O-CB 3.48Å; V239-F242 PolarHBondContact O-N 3.32Å; V239-A243 PolarHBondContact O-N 2.93Å
240G95.5Very high94.8Very high42 Ų4234.8 Ų34.843%0.43320%0.197SC..Hα-helixtrans-62.3-41.1175.400000112.8A236 I237 I238 A243 L244A236-G240 PolarHBondContact O-N 3.49Å; I237-G240 PolarHBondContact O-N 3.5Å; I238-G240 PolarHBondContact O-N 3.3Å; G240-A243 PolarHBondContact O-N 2.7Å; G240-L244 WeakPolarHBondContact O-CB 3.37Å; G240-L244 PolarHBondContact O-N 3.27Å
241L96Very high95.1Very high46 Ų4634.4 Ų34.424%0.24120%0.197CC..Hα-helixtrans-68.3-37.2175.5-70173.6000112I237 I238 V239 L244 C245 V283 I287I237-L241 HydrophobicContact CG2-CD1 3.85Å; I237-L241 HydrophobicContact CG2-CG 4.19Å; I237-L241 WeakPolarHBondContact O-CG 3.4Å; I237-L241 PolarHBondContact O-N 2.91Å; I238-L241 PolarHBondContact O-N 3.07Å; V239-L241 PolarHBondContact O-N 3.44Å; L241-L244 HydrophobicContact CD2-CD2 4.49Å; L241-L244 PolarHBondContact O-N 3.02Å; L241-C245 WeakPolarHBondContact O-CB 3.3Å; L241-C245 PolarHBondContact O-N 3.02Å; L241-C245 PolarHBondContact O-SG 3.02Å; L241-V283 HydrophobicContact CB-CG2 4.46Å; L241-V283 HydrophobicContact CD1-CB 4.46Å; L241-V283 HydrophobicContact CD1-CG2 4.19Å; L241-I287 HydrophobicContact CD1-CD1 3.9Å; L241-I287 HydrophobicContact CD1-CG1 4.03Å
242F94Very high95.5Very high1 Ų133.9 Ų33.90%0.00419%0.19CC..Hα-helixtrans-57.2-51.5171.5-177.7-83.5000111.1T88 I92 L95 L190 I238 V239 L244 C245 W246 N280T88-F242 HydrophobicContact CG2-CZ 4.03Å; I92-F242 HydrophobicContact CD1-CE1 4.17Å; I92-F242 HydrophobicContact CD1-CZ 3.89Å; I92-F242 HydrophobicContact CG1-CE1 3.68Å; I92-F242 HydrophobicContact CG1-CE2 4.25Å; I92-F242 HydrophobicContact CG1-CZ 3.38Å; L95-F242 HydrophobicContact CD1-CB 3.87Å; L95-F242 HydrophobicContact CD1-CD1 4.4Å; L95-F242 HydrophobicContact CD1-CD2 3.74Å; L95-F242 HydrophobicContact CD1-CE2 4.45Å; L95-F242 HydrophobicContact CD1-CG 3.73Å; L190-F242 HydrophobicContact CD2-CD1 3.99Å; L190-F242 HydrophobicContact CD2-CE1 4.45Å; I238-F242 PolarHBondContact O-N 3.41Å; V239-F242 WeakPolarHBondContact O-CB 3.48Å; V239-F242 PolarHBondContact O-N 3.32Å; F242-L244 PolarHBondContact O-N 3.28Å; F242-C245 PolarHBondContact O-N 3.33Å; F242-W246 AromaticContact CD2-CD1 3.69Å; F242-W246 AromaticContact CD2-NE1 3.88Å; F242-W246 HydrophobicContact CE1-CB 4.44Å; F242-W246 AromaticContact CE1-CD1 3.9Å; F242-W246 HydrophobicContact CE1-CG 4.22Å; F242-W246 AromaticContact CE2-CD1 3.46Å; F242-W246 VanDerWaalsContact CE2-CD1 3.46Å; F242-W246 HydrophobicContact CE2-CG 4.33Å; F242-W246 AromaticContact CE2-NE1 3.42Å; F242-W246 AromaticContact CG-CD1 4Å; F242-W246 AromaticContact CZ-CD1 3.56Å; F242-W246 HydrophobicContact CZ-CG 4.01Å; F242-W246 AromaticContact CZ-NE1 3.81Å; F242-W246 WeakPolarHBondContact O-CB 3.34Å; F242-W246 PolarHBondContact O-N 3.15Å; F242-N280 VanDerWaalsContact CA-ND2 3.28Å; F242-N280 WeakPolarHBondContact CA-ND2 3.13Å; F242-N280 WeakPolarHBondContact CD2-OD1 3.5Å; F242-N280 PolarHBondContact N-ND2 2.91Å
243A95.9Very high95.7Very high20 Ų2034.1 Ų34.117%0.16519%0.191CC..Hα-helixtrans-59.8-46176.800000111.7L190 V239 G240 C245 W246 L247L190-A243 HydrophobicContact CD1-CB 4.26Å; L190-A243 HydrophobicContact CD2-CB 4.09Å; V239-A243 PolarHBondContact O-N 2.93Å; G240-A243 PolarHBondContact O-N 2.7Å; A243-C245 VanDerWaalsContact C-N 3.29Å; A243-C245 PolarHBondContact O-N 3.02Å; A243-W246 PolarHBondContact O-N 3.28Å; A243-L247 HydrophobicContact CB-CD1 4.1Å; A243-L247 HydrophobicContact CB-CG 4.47Å; A243-L247 WeakPolarHBondContact O-CB 3.49Å; A243-L247 WeakPolarHBondContact O-CD1 3.35Å; A243-L247 WeakPolarHBondContact O-CG 3.44Å; A243-L247 PolarHBondContact O-N 2.9Å
244L97.3Very high95.9Very high116 Ų11629.4 Ų29.461%0.60717%0.173SC*.Hα-helixtrans-61.1-36.7179.9-174.664.5000112.8G240 L241 F242 P248G240-L244 WeakPolarHBondContact O-CB 3.37Å; G240-L244 PolarHBondContact O-N 3.27Å; L241-L244 HydrophobicContact CD2-CD2 4.49Å; L241-L244 PolarHBondContact O-N 3.02Å; F242-L244 PolarHBondContact O-N 3.28Å; L244-P248 VanDerWaalsContact O-CD 3.24Å; L244-P248 WeakPolarHBondContact O-CD 3.44Å
245C97.4Very high96.2Very high8 Ų835.8 Ų35.85%0.05420%0.201CC..Hα-helixtrans-76.8-37.5-179.6-75.20000113.4L241 F242 A243 L276 N280L241-C245 WeakPolarHBondContact O-CB 3.3Å; L241-C245 PolarHBondContact O-N 3.02Å; L241-C245 PolarHBondContact O-SG 3.02Å; F242-C245 PolarHBondContact O-N 3.33Å; A243-C245 VanDerWaalsContact C-N 3.29Å; A243-C245 PolarHBondContact O-N 3.02Å; C245-L276 WeakPolarHBondContact CB-O 3.3Å; C245-L276 PolarHBondContact SG-O 3.36Å; C245-N280 HydrophobicContact CB-CB 3.77Å
246W97Very high96.4Very high20 Ų2037 Ų378%0.07621%0.209CC..Hα-helixtrans-93.6-32.2-172.8-78.894.7000114.3V84 T88 F242 A243 P248 L249 H250V84-W246 HydrophobicContact CG2-CH2 4.31Å; T88-W246 HydrophobicContact CG2-CD2 3.99Å; T88-W246 HydrophobicContact CG2-CE3 4Å; T88-W246 HydrophobicContact CG2-CH2 3.77Å; T88-W246 HydrophobicContact CG2-CZ2 3.72Å; T88-W246 HydrophobicContact CG2-CZ3 3.89Å; T88-W246 WeakPolarHBondContact OG1-CH2 3.42Å; T88-W246 VanDerWaalsContact OG1-CZ2 3.27Å; T88-W246 WeakPolarHBondContact OG1-CZ2 3.27Å; F242-W246 AromaticContact CD2-CD1 3.69Å; F242-W246 AromaticContact CD2-NE1 3.88Å; F242-W246 HydrophobicContact CE1-CB 4.44Å; F242-W246 AromaticContact CE1-CD1 3.9Å; F242-W246 HydrophobicContact CE1-CG 4.22Å; F242-W246 AromaticContact CE2-CD1 3.46Å; F242-W246 VanDerWaalsContact CE2-CD1 3.46Å; F242-W246 HydrophobicContact CE2-CG 4.33Å; F242-W246 AromaticContact CE2-NE1 3.42Å; F242-W246 AromaticContact CG-CD1 4Å; F242-W246 AromaticContact CZ-CD1 3.56Å; F242-W246 HydrophobicContact CZ-CG 4.01Å; F242-W246 AromaticContact CZ-NE1 3.81Å; F242-W246 WeakPolarHBondContact O-CB 3.34Å; F242-W246 PolarHBondContact O-N 3.15Å; A243-W246 PolarHBondContact O-N 3.28Å; W246-P248 VanDerWaalsContact C-CD 3.48Å; W246-L249 HydrophobicContact CZ3-CD2 4.46Å; W246-L249 PolarHBondContact O-N 2.95Å; W246-H250 PolarHBondContact O-CD2 2.96Å; W246-H250 VanDerWaalsContact O-CD2 3.25Å; W246-H250 PolarHBondContact O-N 3.29Å
247L97.1Very high96.5Very high54 Ų5438.9 Ų38.928%0.28321%0.213SC..Hα-helixtrans-57.8-40.2-177-74.6174.5000113.9F182 A243 L249 H250 I251F182-L247 HydrophobicContact CE2-CD2 3.8Å; F182-L247 HydrophobicContact CZ-CD2 4.04Å; A243-L247 HydrophobicContact CB-CD1 4.1Å; A243-L247 HydrophobicContact CB-CG 4.47Å; A243-L247 WeakPolarHBondContact O-CB 3.49Å; A243-L247 WeakPolarHBondContact O-CD1 3.35Å; A243-L247 WeakPolarHBondContact O-CG 3.44Å; A243-L247 PolarHBondContact O-N 2.9Å; L247-L249 VanDerWaalsContact C-N 3.31Å; L247-L249 PolarHBondContact O-N 3.47Å; L247-H250 PolarHBondContact O-N 3.29Å; L247-I251 HydrophobicContact CB-CD1 4.25Å; L247-I251 WeakPolarHBondContact O-CB 3.47Å; L247-I251 WeakPolarHBondContact O-CD1 3.49Å; L247-I251 WeakPolarHBondContact O-CG1 3.35Å; L247-I251 PolarHBondContact O-N 3.33Å
248P97.9Very high96.6Very high45 Ų4540.8 Ų40.829%0.29222%0.219SC..Hα-helixtrans-56.4-42.9179.4-29.839.5000113.4L244 W246 I251 I252 L276L244-P248 VanDerWaalsContact O-CD 3.24Å; L244-P248 WeakPolarHBondContact O-CD 3.44Å; W246-P248 VanDerWaalsContact C-CD 3.48Å; P248-I251 PolarHBondContact O-N 3.04Å; P248-I252 VanDerWaalsContact O-CG1 3.29Å; P248-I252 WeakPolarHBondContact O-CG1 3.46Å; P248-I252 PolarHBondContact O-N 3Å; P248-L276 HydrophobicContact CB-CD2 4.4Å; P248-L276 HydrophobicContact CG-CD2 3.83Å
249L97.3Very high96.8Very high25 Ų2542.6 Ų42.613%0.13123%0.231CC..Hα-helixtrans-66.4-44.2178.5-174.163.4000111.6W246 L247 I251 I252 N253 M270 A273 I274W246-L249 HydrophobicContact CZ3-CD2 4.46Å; W246-L249 PolarHBondContact O-N 2.95Å; L247-L249 VanDerWaalsContact C-N 3.31Å; L247-L249 PolarHBondContact O-N 3.47Å; L249-I251 PolarHBondContact O-N 3.3Å; L249-I252 PolarHBondContact O-N 3.35Å; L249-N253 PolarHBondContact O-N 2.86Å; L249-M270 HydrophobicContact CD1-CE 4.42Å; L249-A273 HydrophobicContact CB-CB 4.2Å; L249-A273 HydrophobicContact CD1-CB 4.07Å; L249-I274 HydrophobicContact CD1-CG1 4.19Å
250H97.7Very high96.8Very high4 Ų447 Ų472%0.01926%0.26CS..Hα-helixtrans-65.2-38.1176.8-70.9-60.8000113N181 F182 W246 L247 N253 C254N181-H250 PolarHBondContact OD1-CE1 3Å; N181-H250 VanDerWaalsContact OD1-CE1 3.27Å; F182-H250 HydrophobicContact CB-CB 4.32Å; F182-H250 HydrophobicContact CD1-CB 3.93Å; F182-H250 HydrophobicContact CD2-CB 3.45Å; F182-H250 VanDerWaalsContact CD2-CB 3.45Å; F182-H250 AromaticContact CD2-CD2 3.79Å; F182-H250 AromaticContact CD2-CG 3.39Å; F182-H250 AromaticContact CD2-ND1 3.77Å; F182-H250 HydrophobicContact CE1-CB 4.04Å; F182-H250 HydrophobicContact CE2-CB 3.59Å; F182-H250 AromaticContact CE2-CG 3.91Å; F182-H250 HydrophobicContact CG-CB 3.64Å; F182-H250 AromaticContact CG-CG 3.76Å; F182-H250 AromaticContact CG-ND1 3.82Å; F182-H250 HydrophobicContact CZ-CB 3.88Å; W246-H250 PolarHBondContact O-CD2 2.96Å; W246-H250 VanDerWaalsContact O-CD2 3.25Å; W246-H250 PolarHBondContact O-N 3.29Å; L247-H250 PolarHBondContact O-N 3.29Å; H250-N253 PolarHBondContact O-N 3.29Å; H250-C254 PolarHBondContact O-N 3.17Å; H250-C254 PolarHBondContact O-SG 3.32Å; H250-C254 VanDerWaalsContact O-SG 3.36Å
251I97.7Very high96.8Very high81 Ų8152.7 Ų52.742%0.41528%0.281SS..Hα-helixtrans-63.3-43.6176.1-70.2164.8000110L247 P248 L249 N253 C254 F255L247-I251 HydrophobicContact CB-CD1 4.25Å; L247-I251 WeakPolarHBondContact O-CB 3.47Å; L247-I251 WeakPolarHBondContact O-CD1 3.49Å; L247-I251 WeakPolarHBondContact O-CG1 3.35Å; L247-I251 PolarHBondContact O-N 3.33Å; P248-I251 PolarHBondContact O-N 3.04Å; L249-I251 PolarHBondContact O-N 3.3Å; I251-N253 VanDerWaalsContact C-N 3.35Å; I251-N253 PolarHBondContact O-N 3.4Å; I251-C254 WeakPolarHBondContact O-CB 3.33Å; I251-C254 PolarHBondContact O-N 2.91Å; I251-C254 VanDerWaalsContact O-N 3.15Å; I251-F255 HydrophobicContact CG2-CD2 3.84Å; I251-F255 HydrophobicContact CG2-CE2 3.65Å; I251-F255 VanDerWaalsContact O-CD2 3.27Å; I251-F255 WeakPolarHBondContact O-CD2 3.47Å; I251-F255 PolarHBondContact O-N 2.86Å
252I97.8Very high96.8Very high18 Ų1853.7 Ų53.79%0.09229%0.291CS..Hα-helixtrans-60-45.7175.2-66.1162.5000110.7P248 L249 C254 F255 T256 A265 L269 M270 A273P248-I252 VanDerWaalsContact O-CG1 3.29Å; P248-I252 WeakPolarHBondContact O-CG1 3.46Å; P248-I252 PolarHBondContact O-N 3Å; L249-I252 PolarHBondContact O-N 3.35Å; I252-C254 PolarHBondContact O-N 3.34Å; I252-F255 WeakPolarHBondContact O-CB 3.28Å; I252-F255 PolarHBondContact O-N 3.19Å; I252-T256 PolarHBondContact O-N 3.01Å; I252-T256 PolarHBondContact O-OG1 3.05Å; I252-A265 HydrophobicContact CG2-CB 3.6Å; I252-L269 HydrophobicContact CD1-CD2 4.35Å; I252-L269 HydrophobicContact CD1-CG 4Å; I252-M270 HydrophobicContact CB-SD 4.43Å; I252-M270 HydrophobicContact CD1-SD 4.37Å; I252-M270 HydrophobicContact CG2-SD 3.44Å; I252-M270 WeakPolarHBondContact CG2-SD 3.3Å; I252-A273 HydrophobicContact CD1-CB 3.79Å
253N97.5Very high96.8Very high5 Ų559.3 Ų59.33%0.02733%0.33CS..Hα-helixtrans-58.4-37.4175.8-66.8-17.6000112.2M174 V178 L249 H250 I251 F257M174-N253 HydrophobicContact SD-CB 4.47Å; V178-N253 HydrophobicContact CG2-CB 4.29Å; L249-N253 PolarHBondContact O-N 2.86Å; H250-N253 PolarHBondContact O-N 3.29Å; I251-N253 VanDerWaalsContact C-N 3.35Å; I251-N253 PolarHBondContact O-N 3.4Å; N253-F257 VanDerWaalsContact O-CB 3.28Å; N253-F257 WeakPolarHBondContact O-CB 3.47Å; N253-F257 PolarHBondContact O-N 2.91Å
254C98Very high96.7Very high19 Ų1962.6 Ų62.613%0.12834%0.342CS..Hα-helixtrans-63.3-43.6172.9-70.60000112.2F182 H250 I251 I252 F257 F258F182-C254 VanDerWaalsContact CD1-SG 3.57Å; H250-C254 PolarHBondContact O-N 3.17Å; H250-C254 PolarHBondContact O-SG 3.32Å; H250-C254 VanDerWaalsContact O-SG 3.36Å; I251-C254 WeakPolarHBondContact O-CB 3.33Å; I251-C254 PolarHBondContact O-N 2.91Å; I251-C254 VanDerWaalsContact O-N 3.15Å; I252-C254 PolarHBondContact O-N 3.34Å; C254-F257 PolarHBondContact O-N 3.37Å; C254-F258 HydrophobicContact CB-CD2 4.01Å; C254-F258 HydrophobicContact CB-CE2 4.23Å; C254-F258 WeakPolarHBondContact O-CB 3.46Å; C254-F258 VanDerWaalsContact O-CD2 3.23Å; C254-F258 WeakPolarHBondContact O-CD2 3.37Å; C254-F258 PolarHBondContact O-N 3.36Å
255F97.4Very high96.6Very high134 Ų13458.1 Ų58.159%0.58832%0.322SS*.Hα-helixtrans-62.3-47.4175.6-83.3-78.3000111.7I251 I252 F257 C259I251-F255 HydrophobicContact CG2-CD2 3.84Å; I251-F255 HydrophobicContact CG2-CE2 3.65Å; I251-F255 VanDerWaalsContact O-CD2 3.27Å; I251-F255 WeakPolarHBondContact O-CD2 3.47Å; I251-F255 PolarHBondContact O-N 2.86Å; I252-F255 WeakPolarHBondContact O-CB 3.28Å; I252-F255 PolarHBondContact O-N 3.19Å; F255-F257 PolarHBondContact O-N 3.1Å; F255-C259 WeakPolarHBondContact O-CB 3.48Å; F255-C259 PolarHBondContact O-N 2.63Å
256T95.9Very high96.4Very high35 Ų3560.5 Ų60.522%0.21534%0.337CS..Hα-helixtrans-58.7-35.3177.4-61.30000112M174 I252 H264M174-T256 HydrophobicContact CG-CG2 4.45Å; I252-T256 PolarHBondContact O-N 3.01Å; I252-T256 PolarHBondContact O-OG1 3.05Å; T256-H264 PolarHBondContact OG1-NE2 3.48Å
257F97.2Very high96.2Very high62 Ų6264.8 Ų64.827%0.27236%0.361SS..Hα-helixtrans-84.9-46.1-178.6-177.2-107.6000114.1M174 N175 V178 Y179 N253 C254 F255M174-F257 HydrophobicContact CB-CB 4.22Å; M174-F257 HydrophobicContact CB-CD2 3.69Å; M174-F257 HydrophobicContact CB-CG 4.32Å; N175-F257 HydrophobicContact CB-CE2 3.8Å; N175-F257 HydrophobicContact CB-CZ 3.97Å; V178-F257 HydrophobicContact CB-CD1 4.2Å; V178-F257 HydrophobicContact CB-CG 4.47Å; V178-F257 HydrophobicContact CG1-CD1 4.13Å; V178-F257 HydrophobicContact CG2-CB 3.78Å; V178-F257 HydrophobicContact CG2-CD1 4.21Å; V178-F257 HydrophobicContact CG2-CG 4.08Å; Y179-F257 HydrophobicContact CD2-CE1 4.37Å; Y179-F257 HydrophobicContact CD2-CZ 4.38Å; Y179-F257 HydrophobicContact CE1-CE1 4.3Å; Y179-F257 AromaticContact CE2-CE1 3.51Å; Y179-F257 HydrophobicContact CE2-CE1 3.51Å; Y179-F257 AromaticContact CE2-CZ 3.55Å; Y179-F257 HydrophobicContact CE2-CZ 3.55Å; Y179-F257 AromaticContact CZ-CE1 3.48Å; Y179-F257 VanDerWaalsContact CZ-CE1 3.48Å; Y179-F257 AromaticContact CZ-CZ 3.99Å; Y179-F257 WeakPolarHBondContact OH-CE1 3.22Å; N253-F257 VanDerWaalsContact O-CB 3.28Å; N253-F257 WeakPolarHBondContact O-CB 3.47Å; N253-F257 PolarHBondContact O-N 2.91Å; C254-F257 PolarHBondContact O-N 3.37Å; F255-F257 PolarHBondContact O-N 3.1Å
258F97.9Very high96.1Very high107 Ų10770.2 Ų70.247%0.46938%0.378SS..Hα-helixtrans-86.9-17.4-173.9-67.3-60.5000113.9V178 Y179 F183 C254 P260V178-F258 HydrophobicContact CG1-CE2 3.59Å; V178-F258 HydrophobicContact CG1-CZ 3.71Å; Y179-F258 HydrophobicContact CE1-CE1 4.08Å; Y179-F258 AromaticContact CE1-CZ 3.87Å; Y179-F258 HydrophobicContact CE1-CZ 3.87Å; F183-F258 HydrophobicContact CE2-CE2 4.36Å; F183-F258 HydrophobicContact CE2-CZ 4.1Å; F183-F258 HydrophobicContact CZ-CE2 4.12Å; F183-F258 HydrophobicContact CZ-CZ 4.31Å; C254-F258 HydrophobicContact CB-CD2 4.01Å; C254-F258 HydrophobicContact CB-CE2 4.23Å; C254-F258 WeakPolarHBondContact O-CB 3.46Å; C254-F258 VanDerWaalsContact O-CD2 3.23Å; C254-F258 WeakPolarHBondContact O-CD2 3.37Å; C254-F258 PolarHBondContact O-N 3.36Å; F258-P260 VanDerWaalsContact C-CD 3.49Å; F258-P260 WeakPolarHBondContact O-CD 3.34Å
259C96.8Very high96Very high41 Ų4170.8 Ų70.828%0.27738%0.378SS..  trans-121.974.5174.7-166.90000111F255 D261 C262F255-C259 WeakPolarHBondContact O-CB 3.48Å; F255-C259 PolarHBondContact O-N 2.63Å; C259-D261 PolarHBondContact O-N 3.34Å; C259-C262 HydrophobicContact CB-CB 3.69Å; C259-C262 WeakPolarHBondContact CB-SG 3.45Å; C259-C262 WeakPolarHBondContact O-CB 3.47Å; C259-C262 PolarHBondContact O-N 3.2Å; C259-C262 VanDerWaalsContact O-N 3.07Å; C259-C262 WeakPolarHBondContact SG-CB 3.4Å; C259-C262 PolarHBondContact SG-N 2.87Å; C259-C262 VanDerWaalsContact SG-N 3.38Å; C259-C262 CovalentContact SG-SG 2.03Å; C259-C262 PolarHBondContact SG-SG 3.34Å
260P94.1Very high95.8Very high104 Ų10470.5 Ų70.568%0.67538%0.376SS*.THydrogen-bonded Turntrans-62.8-25178.526.1-34.9000113.3F258 C262F258-P260 VanDerWaalsContact C-CD 3.49Å; F258-P260 WeakPolarHBondContact O-CD 3.34Å; P260-C262 VanDerWaalsContact C-N 3.35Å
261D95.1Very high95.7Very high161 Ų16172.6 Ų72.686%0.86138%0.384SS*.THydrogen-bonded Turntrans-81.8-13.3177-58.9-39.9000113.1C259C259-D261 PolarHBondContact O-N 3.34Å
262C95.3Very high95.6Very high67 Ų6773.2 Ų73.245%0.45339%0.388SS..SBendtrans-73.6147.3175.6-71.20000110.4C259 P260 H264C259-C262 HydrophobicContact CB-CB 3.69Å; C259-C262 WeakPolarHBondContact CB-SG 3.45Å; C259-C262 WeakPolarHBondContact O-CB 3.47Å; C259-C262 PolarHBondContact O-N 3.2Å; C259-C262 VanDerWaalsContact O-N 3.07Å; C259-C262 WeakPolarHBondContact SG-CB 3.4Å; C259-C262 PolarHBondContact SG-N 2.87Å; C259-C262 VanDerWaalsContact SG-N 3.38Å; C259-C262 CovalentContact SG-SG 2.03Å; C259-C262 PolarHBondContact SG-SG 3.34Å; P260-C262 VanDerWaalsContact C-N 3.35Å; C262-H264 PolarHBondContact O-N 3.4Å
263S94Very high95.6Very high119 Ų11972.5 Ų72.583%0.83239%0.385SS*.PPolyproline II helixtrans-60.8134.7168.6-60.90000110.2
264H94.2Very high95.6Very high89 Ų8974 Ų7441%0.41239%0.393SS..PPolyproline II helixtrans-55144.5176.2-163.1-82.8000110.8E169 T256 C262E169-H264 IonicContact OE1-CE1 3.73Å; E169-H264 PolarHBondContact OE1-CE1 2.89Å; E169-H264 IonicContact OE1-NE2 2.82Å; E169-H264 PolarHBondContact OE1-NE2 2.97Å; E169-H264 IonicContact OE2-CE1 2.95Å; E169-H264 IonicContact OE2-NE2 2.97Å; E169-H264 PolarHBondContact OE2-NE2 3.01Å; E169-H264 VanDerWaalsContact OE2-NE2 3.16Å; T256-H264 PolarHBondContact OG1-NE2 3.48Å; C262-H264 PolarHBondContact O-N 3.4Å
265A94.9Very high95.5Very high22 Ų2274.2 Ų74.218%0.18239%0.393CS..PPolyproline II helixtrans-53.1134.5174.900000110.1I252 L269 M270I252-A265 HydrophobicContact CG2-CB 3.6Å; A265-L269 HydrophobicContact CB-CD2 4.38Å; A265-M270 HydrophobicContact CB-CG 4.41Å; A265-M270 HydrophobicContact CB-SD 4.18Å
266P94.7Very high95.5Very high59 Ų5970.8 Ų70.838%0.38338%0.38SS..PPolyproline II helixtrans-64.4147.7-176.327.8-35.4000110.5W268 L269 M270P266-W268 VanDerWaalsContact C-N 3.26Å; P266-W268 HydrophobicContact CG-CZ2 4.07Å; P266-W268 PolarHBondContact O-N 2.03Å; P266-W268 VanDerWaalsContact O-N 3.14Å; P266-L269 HydrophobicContact CG-CB 3.93Å; P266-L269 WeakPolarHBondContact O-CA 3.37Å; P266-L269 WeakPolarHBondContact O-CB 3.07Å; P266-L269 PolarHBondContact O-N 3.39Å; P266-M270 PolarHBondContact O-N 3.07Å
267L91.8Very high95.6Very high109 Ų10969.2 Ų69.257%0.57137%0.371SS*.Hα-helixtrans-56.5-36.4-171.8-173.765.2000113.8L269 M270 Y271L267-L269 VanDerWaalsContact C-N 3.26Å; L267-L269 PolarHBondContact O-N 3.38Å; L267-M270 PolarHBondContact O-N 3.24Å; L267-Y271 HydrophobicContact CD1-CD2 4.35Å; L267-Y271 HydrophobicContact CD1-CE1 4.28Å; L267-Y271 HydrophobicContact CD1-CE2 3.79Å; L267-Y271 HydrophobicContact CD2-CD2 4.49Å; L267-Y271 HydrophobicContact CD2-CE2 3.63Å; L267-Y271 HydrophobicContact CG-CD2 3.88Å; L267-Y271 HydrophobicContact CG-CE2 3.4Å; L267-Y271 VanDerWaalsContact CG-CE2 3.4Å; L267-Y271 WeakPolarHBondContact O-CD2 3.29Å; L267-Y271 PolarHBondContact O-N 3.26Å
268W94.2Very high95.7Very high169 Ų16966.6 Ų66.664%0.6436%0.36SS*.Hα-helixtrans-62.8-33.3176.869-98.2000112.4P266 L272P266-W268 VanDerWaalsContact C-N 3.26Å; P266-W268 HydrophobicContact CG-CZ2 4.07Å; P266-W268 PolarHBondContact O-N 2.03Å; P266-W268 VanDerWaalsContact O-N 3.14Å; W268-L272 HydrophobicContact CZ3-CD2 4.16Å; W268-L272 VanDerWaalsContact O-CB 3.28Å; W268-L272 WeakPolarHBondContact O-CB 3.23Å; W268-L272 PolarHBondContact O-N 2.99Å
269L95.8Very high95.7Very high56 Ų5663.6 Ų63.629%0.29335%0.35SS..Hα-helixtrans-75-37.7178.6-178.361.9000110.6I252 A265 P266 L267 L272 A273I252-L269 HydrophobicContact CD1-CD2 4.35Å; I252-L269 HydrophobicContact CD1-CG 4Å; A265-L269 HydrophobicContact CB-CD2 4.38Å; P266-L269 HydrophobicContact CG-CB 3.93Å; P266-L269 WeakPolarHBondContact O-CA 3.37Å; P266-L269 WeakPolarHBondContact O-CB 3.07Å; P266-L269 PolarHBondContact O-N 3.39Å; L267-L269 VanDerWaalsContact C-N 3.26Å; L267-L269 PolarHBondContact O-N 3.38Å; L269-L272 PolarHBondContact O-N 3.43Å; L269-A273 WeakPolarHBondContact O-CB 3.06Å; L269-A273 PolarHBondContact O-N 3.42Å
270M94.4Very high95.7Very high20 Ų2061.8 Ų61.810%0.09934%0.338CS..Hα-helixtrans-60.6-51172.2-69.4-60-70.800111.2E169 L249 I252 A265 P266 L267 L272 A273 I274E169-M270 WeakPolarHBondContact OE1-CE 3.47Å; L249-M270 HydrophobicContact CD1-CE 4.42Å; I252-M270 HydrophobicContact CB-SD 4.43Å; I252-M270 HydrophobicContact CD1-SD 4.37Å; I252-M270 HydrophobicContact CG2-SD 3.44Å; I252-M270 WeakPolarHBondContact CG2-SD 3.3Å; A265-M270 HydrophobicContact CB-CG 4.41Å; A265-M270 HydrophobicContact CB-SD 4.18Å; P266-M270 PolarHBondContact O-N 3.07Å; L267-M270 PolarHBondContact O-N 3.24Å; M270-L272 VanDerWaalsContact C-N 3.31Å; M270-L272 PolarHBondContact O-N 2.84Å; M270-A273 PolarHBondContact O-N 3.47Å; M270-I274 VanDerWaalsContact O-CG1 3.29Å; M270-I274 WeakPolarHBondContact O-CG1 3.36Å; M270-I274 PolarHBondContact O-N 2.97Å
271Y94.5Very high95.8Very high47 Ų4757.1 Ų57.118%0.18431%0.308CS..Hα-helixtrans-61.6-39.2176.7-69.5-39000112.3Y9 L267 A273 I274 V275Y9-Y271 HydrophobicContact CD1-CD1 4.24Å; Y9-Y271 HydrophobicContact CD1-CE1 4.23Å; Y9-Y271 AromaticContact CD2-CD1 3.79Å; Y9-Y271 HydrophobicContact CD2-CD1 3.79Å; Y9-Y271 AromaticContact CD2-CG 3.88Å; Y9-Y271 HydrophobicContact CD2-CG 3.88Å; Y9-Y271 HydrophobicContact CE1-CD1 4.17Å; Y9-Y271 HydrophobicContact CE1-CE1 4.12Å; Y9-Y271 AromaticContact CE2-CD1 3.7Å; Y9-Y271 HydrophobicContact CE2-CD1 3.7Å; Y9-Y271 HydrophobicContact CE2-CE1 4.45Å; Y9-Y271 HydrophobicContact CE2-CG 4.21Å; Y9-Y271 HydrophobicContact CG-CD1 4.05Å; Y9-Y271 HydrophobicContact CG-CE1 4.44Å; Y9-Y271 HydrophobicContact CG-CG 4.14Å; Y9-Y271 AromaticContact CZ-CD1 3.9Å; L267-Y271 HydrophobicContact CD1-CD2 4.35Å; L267-Y271 HydrophobicContact CD1-CE1 4.28Å; L267-Y271 HydrophobicContact CD1-CE2 3.79Å; L267-Y271 HydrophobicContact CD2-CD2 4.49Å; L267-Y271 HydrophobicContact CD2-CE2 3.63Å; L267-Y271 HydrophobicContact CG-CD2 3.88Å; L267-Y271 HydrophobicContact CG-CE2 3.4Å; L267-Y271 VanDerWaalsContact CG-CE2 3.4Å; L267-Y271 WeakPolarHBondContact O-CD2 3.29Å; L267-Y271 PolarHBondContact O-N 3.26Å; Y271-A273 PolarHBondContact O-N 2.9Å; Y271-I274 PolarHBondContact O-N 3.28Å; Y271-V275 WeakPolarHBondContact O-CB 3.28Å; Y271-V275 VanDerWaalsContact O-CG2 3.23Å; Y271-V275 WeakPolarHBondContact O-CG2 3.43Å; Y271-V275 PolarHBondContact O-N 3.35Å
272L96.4Very high96Very high95 Ų9550.1 Ų50.150%0.49727%0.27SS..Hα-helixtrans-62.1-43.2175.5-178.464.5000112.1W268 L269 M270 V275 L276W268-L272 HydrophobicContact CZ3-CD2 4.16Å; W268-L272 VanDerWaalsContact O-CB 3.28Å; W268-L272 WeakPolarHBondContact O-CB 3.23Å; W268-L272 PolarHBondContact O-N 2.99Å; L269-L272 PolarHBondContact O-N 3.43Å; M270-L272 VanDerWaalsContact C-N 3.31Å; M270-L272 PolarHBondContact O-N 2.84Å; L272-V275 PolarHBondContact O-N 3.16Å; L272-L276 VanDerWaalsContact O-CB 3.24Å; L272-L276 WeakPolarHBondContact O-CB 3.46Å; L272-L276 PolarHBondContact O-N 3.35Å
273A97.7Very high96Very high3 Ų348.5 Ų48.53%0.02526%0.258CS..Hα-helixtrans-66.5-37.9178.200000112.4L249 I252 L269 M270 Y271 L276 S277L249-A273 HydrophobicContact CB-CB 4.2Å; L249-A273 HydrophobicContact CD1-CB 4.07Å; I252-A273 HydrophobicContact CD1-CB 3.79Å; L269-A273 WeakPolarHBondContact O-CB 3.06Å; L269-A273 PolarHBondContact O-N 3.42Å; M270-A273 PolarHBondContact O-N 3.47Å; Y271-A273 PolarHBondContact O-N 2.9Å; A273-L276 PolarHBondContact O-N 3.24Å; A273-S277 PolarHBondContact O-N 2.97Å
274I96.5Very high96Very high37 Ų3742.9 Ų42.919%0.1922%0.219CC..Hα-helixtrans-66-48.9174.3-66.8165000110.8Y9 L249 M270 Y271 L276 S277 H278Y9-I274 HydrophobicContact CE2-CG2 4.39Å; L249-I274 HydrophobicContact CD1-CG1 4.19Å; M270-I274 VanDerWaalsContact O-CG1 3.29Å; M270-I274 WeakPolarHBondContact O-CG1 3.36Å; M270-I274 PolarHBondContact O-N 2.97Å; Y271-I274 PolarHBondContact O-N 3.28Å; I274-L276 PolarHBondContact O-N 3.34Å; I274-S277 PolarHBondContact O-N 3.38Å; I274-S277 VanDerWaalsContact O-N 3.13Å; I274-S277 PolarHBondContact O-OG 3.15Å; I274-H278 WeakPolarHBondContact CG2-CE1 3.36Å; I274-H278 PolarHBondContact O-N 2.89Å
275V97.4Very high96.1Very high23 Ų2339.1 Ų39.114%0.13920%0.202CC..Hα-helixtrans-58-40.7176.4165.30000110.9Y9 V12 E13 I16 Y271 L272 H278 T279Y9-V275 HydrophobicContact CD2-CG2 3.88Å; Y9-V275 HydrophobicContact CE2-CG2 3.96Å; V12-V275 HydrophobicContact CG1-CG1 3.68Å; V12-V275 HydrophobicContact CG1-CG2 4.21Å; E13-V275 HydrophobicContact CG-CG2 4.35Å; E13-V275 WeakPolarHBondContact OE1-CG2 3.4Å; I16-V275 HydrophobicContact CD1-CG1 3.69Å; Y271-V275 WeakPolarHBondContact O-CB 3.28Å; Y271-V275 VanDerWaalsContact O-CG2 3.23Å; Y271-V275 WeakPolarHBondContact O-CG2 3.43Å; Y271-V275 PolarHBondContact O-N 3.35Å; L272-V275 PolarHBondContact O-N 3.16Å; V275-H278 PolarHBondContact O-N 3.2Å; V275-T279 WeakPolarHBondContact O-CB 3.45Å; V275-T279 PolarHBondContact O-N 2.86Å; V275-T279 PolarHBondContact O-OG1 3.13Å
276L97.7Very high96.1Very high61 Ų6143.2 Ų43.232%0.31922%0.217SC..Hα-helixtrans-66.3-38.8178.2-178.762.9000112.3C245 P248 L272 A273 I274 T279C245-L276 WeakPolarHBondContact CB-O 3.3Å; C245-L276 PolarHBondContact SG-O 3.36Å; P248-L276 HydrophobicContact CB-CD2 4.4Å; P248-L276 HydrophobicContact CG-CD2 3.83Å; L272-L276 VanDerWaalsContact O-CB 3.24Å; L272-L276 WeakPolarHBondContact O-CB 3.46Å; L272-L276 PolarHBondContact O-N 3.35Å; A273-L276 PolarHBondContact O-N 3.24Å; I274-L276 PolarHBondContact O-N 3.34Å; L276-T279 PolarHBondContact O-N 2.77Å
277S97.8Very high96.1Very high3 Ų341.9 Ų41.92%0.02121%0.206CC..Hα-helixtrans-67.1-42.5175.873.10000111.4A273 I274 T279 N280A273-S277 PolarHBondContact O-N 2.97Å; I274-S277 PolarHBondContact O-N 3.38Å; I274-S277 VanDerWaalsContact O-N 3.13Å; I274-S277 PolarHBondContact O-OG 3.15Å; S277-T279 VanDerWaalsContact C-N 3.34Å; S277-T279 PolarHBondContact O-N 2.95Å; S277-N280 WeakPolarHBondContact O-CB 3.44Å; S277-N280 PolarHBondContact O-N 2.7Å; S277-N280 VanDerWaalsContact O-N 3.17Å
278H97.8Very high96.2Very high7 Ų736.9 Ų36.93%0.03218%0.179CC..Hα-helixtrans-67.3-32.2175.9-63.9158000113.3E13 I16 I60 I274 V275 N280 S281E13-H278 IonicContact OE1-CE1 3.96Å; E13-H278 IonicContact OE1-ND1 3.82Å; E13-H278 PolarHBondContact OE1-ND1 3.31Å; E13-H278 IonicContact OE2-CE1 3.42Å; E13-H278 IonicContact OE2-CG 2.91Å; E13-H278 IonicContact OE2-ND1 3.72Å; E13-H278 PolarHBondContact OE2-ND1 3.3Å; I16-H278 HydrophobicContact CG2-CB 4.02Å; I60-H278 HydrophobicContact CD1-CB 4.14Å; I60-H278 HydrophobicContact CG1-CB 4.28Å; I274-H278 WeakPolarHBondContact CG2-CE1 3.36Å; I274-H278 PolarHBondContact O-N 2.89Å; V275-H278 PolarHBondContact O-N 3.2Å; H278-N280 PolarHBondContact O-N 3.39Å; H278-N280 VanDerWaalsContact O-N 3.12Å; H278-S281 PolarHBondContact O-N 2.92Å; H278-S281 VanDerWaalsContact O-N 3.07Å
279T97.6Very high96.3Very high44 Ų4430 Ų3027%0.2716%0.159SC..Hα-helixtrans-58.9-24.2174.2-61.60000112I16 V275 L276 S277 S281 V282 V283I16-T279 WeakPolarHBondContact CD1-OG1 3.4Å; V275-T279 WeakPolarHBondContact O-CB 3.45Å; V275-T279 PolarHBondContact O-N 2.86Å; V275-T279 PolarHBondContact O-OG1 3.13Å; L276-T279 PolarHBondContact O-N 2.77Å; S277-T279 VanDerWaalsContact C-N 3.34Å; S277-T279 PolarHBondContact O-N 2.95Å; T279-S281 PolarHBondContact O-N 3.25Å; T279-V282 WeakPolarHBondContact O-CB 3.38Å; T279-V282 PolarHBondContact O-N 3.12Å; T279-V283 HydrophobicContact CG2-CG1 4.4Å; T279-V283 PolarHBondContact O-N 2.93Å
280N97Very high96.2Very high3 Ų336 Ų362%0.01618%0.178CC..Hα-helixtrans-56-35.8174.7-172.1-112.5000113F242 C245 S277 H278 V282 V283F242-N280 VanDerWaalsContact CA-ND2 3.28Å; F242-N280 WeakPolarHBondContact CA-ND2 3.13Å; F242-N280 WeakPolarHBondContact CD2-OD1 3.5Å; F242-N280 PolarHBondContact N-ND2 2.91Å; C245-N280 HydrophobicContact CB-CB 3.77Å; S277-N280 WeakPolarHBondContact O-CB 3.44Å; S277-N280 PolarHBondContact O-N 2.7Å; S277-N280 VanDerWaalsContact O-N 3.17Å; H278-N280 PolarHBondContact O-N 3.39Å; H278-N280 VanDerWaalsContact O-N 3.12Å; N280-V282 PolarHBondContact O-N 3.21Å; N280-V283 VanDerWaalsContact O-CG2 3.25Å; N280-V283 WeakPolarHBondContact O-CG2 3.38Å; N280-V283 PolarHBondContact O-N 3.36Å
281S97.4Very high96.2Very high6 Ų637.1 Ų37.14%0.04218%0.182CC..Hα-helixtrans-71.7-13.1178.7-64.10000113.4N24 D52 H278 T279N24-S281 PolarHBondContact ND2-O 2.78Å; D52-S281 VanDerWaalsContact OD1-CA 3.3Å; D52-S281 WeakPolarHBondContact OD1-CA 3.46Å; D52-S281 VanDerWaalsContact OD1-CB 3.23Å; D52-S281 WeakPolarHBondContact OD1-CB 3.39Å; D52-S281 PolarHBondContact OD1-OG 3.38Å; H278-S281 PolarHBondContact O-N 2.92Å; H278-S281 VanDerWaalsContact O-N 3.07Å; T279-S281 PolarHBondContact O-N 3.25Å
282V98Very high96.1Very high13 Ų1336.4 Ų36.48%0.07918%0.181CC..Hα-helixtrans-90.8-35.1177.9179.30000111.9I16 L19 A20 T279 N280 N284 P285 F286I16-V282 HydrophobicContact CB-CG2 4.49Å; I16-V282 HydrophobicContact CG2-CG2 3.77Å; L19-V282 HydrophobicContact CB-CG1 3.79Å; L19-V282 HydrophobicContact CB-CG2 3.94Å; L19-V282 HydrophobicContact CD1-CG1 4.33Å; A20-V282 HydrophobicContact CB-CG2 4.03Å; T279-V282 WeakPolarHBondContact O-CB 3.38Å; T279-V282 PolarHBondContact O-N 3.12Å; N280-V282 PolarHBondContact O-N 3.21Å; V282-N284 PolarHBondContact O-N 3.39Å; V282-P285 WeakPolarHBondContact O-CD 3.38Å; V282-F286 HydrophobicContact CG1-CD2 4.39Å; V282-F286 HydrophobicContact CG1-CE2 3.79Å; V282-F286 VanDerWaalsContact O-CD2 3.26Å; V282-F286 WeakPolarHBondContact O-CD2 3.24Å
283V96.7Very high96Very high33 Ų3339.1 Ų39.120%0.218%0.184CC..Hα-helixtrans-71.3-27.6-167.9-63.30000113.9L241 T279 N280 F286 I287L241-V283 HydrophobicContact CB-CG2 4.46Å; L241-V283 HydrophobicContact CD1-CB 4.46Å; L241-V283 HydrophobicContact CD1-CG2 4.19Å; T279-V283 HydrophobicContact CG2-CG1 4.4Å; T279-V283 PolarHBondContact O-N 2.93Å; N280-V283 VanDerWaalsContact O-CG2 3.25Å; N280-V283 WeakPolarHBondContact O-CG2 3.38Å; N280-V283 PolarHBondContact O-N 3.36Å; V283-F286 WeakPolarHBondContact O-CB 3Å; V283-F286 PolarHBondContact O-N 3.19Å; V283-F286 VanDerWaalsContact O-N 3.16Å; V283-I287 WeakPolarHBondContact O-CG1 2.97Å; V283-I287 PolarHBondContact O-N 3.23Å; V283-I287 VanDerWaalsContact O-N 3.11Å
284N93.9Very high95.8Very high2 Ų243 Ų431%0.01120%0.202CC..Hα-helixtrans-57.1-54.2-172.7-66.8-21.3000113.3D52 I238 V282 F286 I287 Y288D52-N284 PolarHBondContact OD2-ND2 2.98Å; I238-N284 WeakPolarHBondContact CG2-OD1 3.39Å; V282-N284 PolarHBondContact O-N 3.39Å; N284-F286 VanDerWaalsContact C-N 3.28Å; N284-F286 PolarHBondContact O-N 2.03Å; N284-I287 PolarHBondContact O-N 3.25Å; N284-I287 VanDerWaalsContact O-N 3.1Å; N284-Y288 HydrophobicContact CB-CE2 4.1Å; N284-Y288 WeakPolarHBondContact O-CD2 3.22Å; N284-Y288 PolarHBondContact O-N 3.43Å; N284-Y288 VanDerWaalsContact O-N 3.09Å
285P95.2Very high95.7Very high9 Ų941.3 Ų41.36%0.05819%0.193CC..Hα-helixtrans-51.9-40.1174-28.132.2000114.6G23 V27 V282 Y288 A289G23-P285 WeakPolarHBondContact O-CG 3.16Å; V27-P285 HydrophobicContact CG2-CB 4.06Å; V27-P285 HydrophobicContact CG2-CG 3.9Å; V282-P285 WeakPolarHBondContact O-CD 3.38Å; P285-Y288 PolarHBondContact O-N 3.03Å; P285-A289 WeakPolarHBondContact O-CB 3.47Å; P285-A289 PolarHBondContact O-N 3.46Å
286F95.6Very high95.7Very high109 Ų10944.4 Ų44.448%0.47820%0.203SC..Hα-helixtrans-65.9-43.1178.4-68.1-83.4000111.1V282 V283 N284 Y288 A289 Y290V282-F286 HydrophobicContact CG1-CD2 4.39Å; V282-F286 HydrophobicContact CG1-CE2 3.79Å; V282-F286 VanDerWaalsContact O-CD2 3.26Å; V282-F286 WeakPolarHBondContact O-CD2 3.24Å; V283-F286 WeakPolarHBondContact O-CB 3Å; V283-F286 PolarHBondContact O-N 3.19Å; V283-F286 VanDerWaalsContact O-N 3.16Å; N284-F286 VanDerWaalsContact C-N 3.28Å; N284-F286 PolarHBondContact O-N 2.03Å; F286-Y288 VanDerWaalsContact C-N 3.32Å; F286-Y288 PolarHBondContact O-N 3.39Å; F286-A289 PolarHBondContact O-N 3.27Å; F286-Y290 HydrophobicContact CB-CD2 4.49Å; F286-Y290 HydrophobicContact CD1-CE2 4.48Å; F286-Y290 WeakPolarHBondContact O-CD2 3.47Å; F286-Y290 PolarHBondContact O-N 2.84Å
287I95.3Very high95.6Very high31 Ų3145.6 Ų45.616%0.15921%0.207CC..Hα-helixtrans-59.9-44.3176.3-59.8-57000110.9I237 I238 L241 V283 N284 Y290 R291I237-I287 HydrophobicContact CG2-CD1 4.1Å; I238-I287 HydrophobicContact CD1-CG2 4.19Å; I238-I287 HydrophobicContact CG1-CB 4.25Å; I238-I287 HydrophobicContact CG1-CG1 4.46Å; I238-I287 HydrophobicContact CG1-CG2 3.86Å; L241-I287 HydrophobicContact CD1-CD1 3.9Å; L241-I287 HydrophobicContact CD1-CG1 4.03Å; V283-I287 WeakPolarHBondContact O-CG1 2.97Å; V283-I287 PolarHBondContact O-N 3.23Å; V283-I287 VanDerWaalsContact O-N 3.11Å; N284-I287 PolarHBondContact O-N 3.25Å; N284-I287 VanDerWaalsContact O-N 3.1Å; I287-Y290 PolarHBondContact O-N 3.46Å; I287-R291 HydrophobicContact CG2-CG 4.39Å; I287-R291 VanDerWaalsContact O-CB 3.31Å; I287-R291 WeakPolarHBondContact O-CB 3.07Å; I287-R291 PolarHBondContact O-N 3.25Å
288Y94.2Very high95.5Very high4 Ų446 Ų462%0.01621%0.209CC..Hα-helixtrans-62.2-44.5176.3-58.2-45.3000112.1V27 V45 L235 I238 N284 P285 F286 Y290 I292V27-Y288 HydrophobicContact CG1-CD2 4.44Å; V27-Y288 HydrophobicContact CG1-CE2 4.36Å; V27-Y288 HydrophobicContact CG2-CD2 3.84Å; V27-Y288 HydrophobicContact CG2-CE2 4.23Å; V45-Y288 HydrophobicContact CG1-CE1 4.32Å; V45-Y288 HydrophobicContact CG1-CE2 3.79Å; L235-Y288 HydrophobicContact CD2-CE1 4.33Å; I238-Y288 HydrophobicContact CD1-CD1 4.22Å; I238-Y288 HydrophobicContact CD1-CE1 3.37Å; N284-Y288 HydrophobicContact CB-CE2 4.1Å; N284-Y288 WeakPolarHBondContact O-CD2 3.22Å; N284-Y288 PolarHBondContact O-N 3.43Å; N284-Y288 VanDerWaalsContact O-N 3.09Å; P285-Y288 PolarHBondContact O-N 3.03Å; F286-Y288 VanDerWaalsContact C-N 3.32Å; F286-Y288 PolarHBondContact O-N 3.39Å; Y288-Y290 PolarHBondContact O-N 3.39Å; Y288-I292 HydrophobicContact CD1-CD1 3.7Å; Y288-I292 HydrophobicContact CE1-CD1 4.38Å; Y288-I292 PolarHBondContact O-N 2.68Å
289A94.5Very high95.5Very high25 Ų2546.2 Ų46.221%0.20721%0.209CC..Hα-helixtrans-62.4-42.2178.900000112.9P285 F286 R296 F299P285-A289 WeakPolarHBondContact O-CB 3.47Å; P285-A289 PolarHBondContact O-N 3.46Å; F286-A289 PolarHBondContact O-N 3.27Å; A289-R296 WeakPolarHBondContact O-CB 3.43Å; A289-R296 VanDerWaalsContact O-CD 3.24Å; A289-R296 WeakPolarHBondContact O-CD 3.49Å; A289-R296 VanDerWaalsContact O-CG 3.27Å; A289-R296 WeakPolarHBondContact O-CG 3.3Å; A289-R296 PolarHBondContact O-NH1 2.86Å; A289-F299 HydrophobicContact CB-CD2 3.84Å; A289-F299 HydrophobicContact CB-CE2 4.01Å
290Y95.3Very high95.3Very high180 Ų18049.6 Ų49.671%0.70622%0.217SC*.Hα-helixtrans-77.3-40.6-179.7-79.1-71000112.3F286 I287 Y288 R296F286-Y290 HydrophobicContact CB-CD2 4.49Å; F286-Y290 HydrophobicContact CD1-CE2 4.48Å; F286-Y290 WeakPolarHBondContact O-CD2 3.47Å; F286-Y290 PolarHBondContact O-N 2.84Å; I287-Y290 PolarHBondContact O-N 3.46Å; Y288-Y290 PolarHBondContact O-N 3.39Å; Y290-R296 PolarHBondContact O-NH1 3.05Å
291R93.9Very high95.2Very high44 Ų4456.3 Ų56.317%0.16625%0.247CC..Hα-helixtrans-100.6-24.6-167.4-58.4-154.264.4-160.4-15.3115.7H230 K233 S234 I287H230-R291 PolarHBondContact CE1-NH2 3.29Å; H230-R291 PolarHBondContact ND1-NH2 3.3Å; H230-R291 PolarHBondContact NE2-O 3.26Å; H230-R291 PolarHBondContact O-NH2 2.75Å; K233-R291 PolarHBondContact O-NH1 2.71Å; S234-R291 WeakPolarHBondContact OG-CB 3.42Å; S234-R291 PolarHBondContact OG-NE 3.03Å; S234-R291 PolarHBondContact OG-NH2 3.03Å; I287-R291 HydrophobicContact CG2-CG 4.39Å; I287-R291 VanDerWaalsContact O-CB 3.31Å; I287-R291 WeakPolarHBondContact O-CB 3.07Å; I287-R291 PolarHBondContact O-N 3.25Å
292I92.3Very high95Very high33 Ų3356.2 Ų56.217%0.16925%0.245CC..  trans-112.6115.9-176.5-49.3-178.6000110.2Y288 E294 F295 R296Y288-I292 HydrophobicContact CD1-CD1 3.7Å; Y288-I292 HydrophobicContact CE1-CD1 4.38Å; Y288-I292 PolarHBondContact O-N 2.68Å; I292-E294 PolarHBondContact O-N 3.39Å; I292-F295 HydrophobicContact CB-CB 4.28Å; I292-F295 HydrophobicContact CB-CD2 4.04Å; I292-F295 HydrophobicContact CD1-CD2 4.05Å; I292-F295 HydrophobicContact CD1-CE2 4.4Å; I292-F295 HydrophobicContact CG2-CB 4.49Å; I292-F295 HydrophobicContact CG2-CD2 3.83Å; I292-F295 PolarHBondContact O-N 3.2Å; I292-R296 WeakPolarHBondContact O-CB 3.43Å; I292-R296 PolarHBondContact O-N 3.14Å
293R93.3Very high94.8Very high151 Ų15158.9 Ų58.957%0.5726%0.259SS*.Hα-helixtrans-63-43.5-171.8177.7-178.9173.6175-1111.8R296 Q297R293-R296 PolarHBondContact O-N 3.44Å; R293-Q297 HydrophobicContact CG-CG 4.32Å; R293-Q297 VanDerWaalsContact NE-NE2 3.2Å; R293-Q297 WeakPolarHBondContact O-CB 3.48Å; R293-Q297 WeakPolarHBondContact O-CG 3.49Å; R293-Q297 PolarHBondContact O-N 3.37Å
294E94.1Very high94.6Very high85 Ų8563.1 Ų63.140%0.39727%0.271SS..Hα-helixtrans-63.9-44.8-176.7-68.268.9-154.500110.7L37 I292 T298L37-E294 HydrophobicContact CD2-CB 3.67Å; L37-E294 HydrophobicContact CG-CB 4.39Å; I292-E294 PolarHBondContact O-N 3.39Å; E294-T298 WeakPolarHBondContact O-CB 3.48Å; E294-T298 PolarHBondContact O-N 2.9Å; E294-T298 PolarHBondContact O-OG1 3.08Å
295F95.5Very high94.4Very high1 Ų165 Ų650%0.00429%0.285CS..Hα-helixtrans-60.8-51.3170.6-86.8-75.2000111.4V27 A30 V31 L37 V45 I292 Q297 T298 F299V27-F295 HydrophobicContact CG1-CE1 4.15Å; A30-F295 HydrophobicContact CB-CD1 4.1Å; A30-F295 HydrophobicContact CB-CE1 4.25Å; V31-F295 HydrophobicContact CG2-CE1 3.81Å; V31-F295 HydrophobicContact CG2-CZ 3.72Å; L37-F295 HydrophobicContact CD1-CD1 3.9Å; L37-F295 HydrophobicContact CD1-CD2 4.49Å; L37-F295 HydrophobicContact CD1-CE1 3.95Å; L37-F295 HydrophobicContact CD1-CG 4.18Å; L37-F295 HydrophobicContact CD1-CZ 4.28Å; L37-F295 HydrophobicContact CD2-CD2 3.82Å; L37-F295 HydrophobicContact CD2-CE2 3.8Å; L37-F295 HydrophobicContact CD2-CG 4.26Å; L37-F295 HydrophobicContact CD2-CZ 4.22Å; V45-F295 HydrophobicContact CG1-CZ 4.38Å; I292-F295 HydrophobicContact CB-CB 4.28Å; I292-F295 HydrophobicContact CB-CD2 4.04Å; I292-F295 HydrophobicContact CD1-CD2 4.05Å; I292-F295 HydrophobicContact CD1-CE2 4.4Å; I292-F295 HydrophobicContact CG2-CB 4.49Å; I292-F295 HydrophobicContact CG2-CD2 3.83Å; I292-F295 PolarHBondContact O-N 3.2Å; F295-Q297 VanDerWaalsContact C-N 3.3Å; F295-Q297 PolarHBondContact O-N 3.25Å; F295-T298 PolarHBondContact O-N 3.19Å; F295-T298 VanDerWaalsContact O-N 3.08Å; F295-F299 HydrophobicContact CB-CE2 4.41Å; F295-F299 HydrophobicContact CB-CZ 4.38Å; F295-F299 AromaticContact CD1-CE1 3.77Å; F295-F299 HydrophobicContact CD1-CE1 3.77Å; F295-F299 HydrophobicContact CD1-CE2 4.5Å; F295-F299 AromaticContact CD1-CZ 3.69Å; F295-F299 HydrophobicContact CD1-CZ 3.69Å; F295-F299 HydrophobicContact CE1-CZ 4.47Å; F295-F299 HydrophobicContact CG-CZ 4.44Å; F295-F299 WeakPolarHBondContact O-CB 3.36Å; F295-F299 VanDerWaalsContact O-CG 3.3Å; F295-F299 WeakPolarHBondContact O-CG 3.08Å; F295-F299 PolarHBondContact O-N 3.27Å
296R96.2Very high94Very high89 Ų8969.3 Ų69.334%0.33630%0.303SS..Hα-helixtrans-56-42-179.9-170.717650.1-116.46.9113.5A289 Y290 I292 R293 R300A289-R296 WeakPolarHBondContact O-CB 3.43Å; A289-R296 VanDerWaalsContact O-CD 3.24Å; A289-R296 WeakPolarHBondContact O-CD 3.49Å; A289-R296 VanDerWaalsContact O-CG 3.27Å; A289-R296 WeakPolarHBondContact O-CG 3.3Å; A289-R296 PolarHBondContact O-NH1 2.86Å; Y290-R296 PolarHBondContact O-NH1 3.05Å; I292-R296 WeakPolarHBondContact O-CB 3.43Å; I292-R296 PolarHBondContact O-N 3.14Å; R293-R296 PolarHBondContact O-N 3.44Å; R296-R300 WeakPolarHBondContact O-CB 3.43Å; R296-R300 WeakPolarHBondContact O-CG 3.2Å; R296-R300 PolarHBondContact O-N 3.13Å; R296-R300 PolarHBondContact O-NE 3.07Å
297Q95.9Very high93.5Very high86 Ų8669 Ų6940%0.40231%0.31SS..Hα-helixtrans-68.1-42178.1-74.7177.8-26.700111R293 F295 R300 K301R293-Q297 HydrophobicContact CG-CG 4.32Å; R293-Q297 VanDerWaalsContact NE-NE2 3.2Å; R293-Q297 WeakPolarHBondContact O-CB 3.48Å; R293-Q297 WeakPolarHBondContact O-CG 3.49Å; R293-Q297 PolarHBondContact O-N 3.37Å; F295-Q297 VanDerWaalsContact C-N 3.3Å; F295-Q297 PolarHBondContact O-N 3.25Å; Q297-R300 PolarHBondContact O-N 3.45Å; Q297-K301 PolarHBondContact O-N 2.87Å
298T96.2Very high93Very high10 Ų1072.6 Ų72.66%0.06133%0.329CS..Hα-helixtrans-68.1-43.5179.8-49.20000111.4A30 N34 E294 F295 R300 K301 I302A30-T298 HydrophobicContact CB-CG2 3.71Å; N34-T298 HydrophobicContact CB-CG2 3.98Å; N34-T298 PolarHBondContact ND2-OG1 2.97Å; E294-T298 WeakPolarHBondContact O-CB 3.48Å; E294-T298 PolarHBondContact O-N 2.9Å; E294-T298 PolarHBondContact O-OG1 3.08Å; F295-T298 PolarHBondContact O-N 3.19Å; F295-T298 VanDerWaalsContact O-N 3.08Å; T298-R300 PolarHBondContact O-N 2.05Å; T298-K301 WeakPolarHBondContact O-CB 3.47Å; T298-K301 PolarHBondContact O-N 2.03Å; T298-K301 VanDerWaalsContact O-N 3.16Å; T298-I302 HydrophobicContact CG2-CD1 4.07Å; T298-I302 WeakPolarHBondContact O-CG1 3.28Å; T298-I302 PolarHBondContact O-N 3.28Å
299F96.5Very high92.2Very high12 Ų1282.9 Ų82.95%0.05337%0.368CS..Hα-helixtrans-57.8-46.9173.5-68.5-10000111.9L26 V27 A30 A289 F295 K301 I302 I303L26-F299 HydrophobicContact CD1-CD1 4.14Å; L26-F299 HydrophobicContact CD2-CB 4.19Å; L26-F299 HydrophobicContact CD2-CD1 3.86Å; L26-F299 HydrophobicContact CD2-CD2 4.18Å; L26-F299 HydrophobicContact CD2-CE1 4.23Å; L26-F299 HydrophobicContact CD2-CG 3.84Å; L26-F299 HydrophobicContact CG-CD1 3.59Å; L26-F299 HydrophobicContact CG-CE1 3.75Å; L26-F299 HydrophobicContact CG-CG 4.11Å; L26-F299 HydrophobicContact CG-CZ 4.39Å; L26-F299 WeakPolarHBondContact O-CE1 2.97Å; V27-F299 HydrophobicContact CG2-CZ 3.95Å; A30-F299 HydrophobicContact CB-CD1 3.75Å; A30-F299 HydrophobicContact CB-CE1 3.49Å; A30-F299 VanDerWaalsContact CB-CE1 3.49Å; A289-F299 HydrophobicContact CB-CD2 3.84Å; A289-F299 HydrophobicContact CB-CE2 4.01Å; F295-F299 HydrophobicContact CB-CE2 4.41Å; F295-F299 HydrophobicContact CB-CZ 4.38Å; F295-F299 AromaticContact CD1-CE1 3.77Å; F295-F299 HydrophobicContact CD1-CE1 3.77Å; F295-F299 HydrophobicContact CD1-CE2 4.5Å; F295-F299 AromaticContact CD1-CZ 3.69Å; F295-F299 HydrophobicContact CD1-CZ 3.69Å; F295-F299 HydrophobicContact CE1-CZ 4.47Å; F295-F299 HydrophobicContact CG-CZ 4.44Å; F295-F299 WeakPolarHBondContact O-CB 3.36Å; F295-F299 VanDerWaalsContact O-CG 3.3Å; F295-F299 WeakPolarHBondContact O-CG 3.08Å; F295-F299 PolarHBondContact O-N 3.27Å; F299-K301 VanDerWaalsContact C-N 3.31Å; F299-K301 PolarHBondContact O-N 3.25Å; F299-I302 PolarHBondContact O-N 3.2Å; F299-I303 WeakPolarHBondContact O-CB 3.06Å; F299-I303 VanDerWaalsContact O-CG1 3.27Å; F299-I303 WeakPolarHBondContact O-CG1 3.36Å; F299-I303 PolarHBondContact O-N 3.33Å
300R94.9Very high90.8Very high115 Ų11587.5 Ų87.543%0.43439%0.385SS..Hα-helixtrans-59.9-40.8175.7-79.2-176.9-77169.8-5.1112.2R296 Q297 T298 R304R296-R300 WeakPolarHBondContact O-CB 3.43Å; R296-R300 WeakPolarHBondContact O-CG 3.2Å; R296-R300 PolarHBondContact O-N 3.13Å; R296-R300 PolarHBondContact O-NE 3.07Å; Q297-R300 PolarHBondContact O-N 3.45Å; T298-R300 PolarHBondContact O-N 2.05Å; R300-R304 WeakPolarHBondContact O-CB 3.07Å; R300-R304 VanDerWaalsContact O-CG 3.27Å; R300-R304 WeakPolarHBondContact O-CG 3.34Å; R300-R304 PolarHBondContact O-N 3.1Å
301K94.5Very high88.8Confident145 Ų14587.8 Ų87.863%0.6339%0.393SS*.Hα-helixtrans-62-50.1175.5-172.8179.7179.5-177.90111Q297 T298 F299 I303 R304 S305Q297-K301 PolarHBondContact O-N 2.87Å; T298-K301 WeakPolarHBondContact O-CB 3.47Å; T298-K301 PolarHBondContact O-N 2.03Å; T298-K301 VanDerWaalsContact O-N 3.16Å; F299-K301 VanDerWaalsContact C-N 3.31Å; F299-K301 PolarHBondContact O-N 3.25Å; K301-I303 PolarHBondContact O-N 3.41Å; K301-R304 PolarHBondContact O-N 3.26Å; K301-S305 WeakPolarHBondContact O-CB 3.25Å; K301-S305 PolarHBondContact O-N 2.85Å; K301-S305 PolarHBondContact O-OG 2.99Å
302I94.1Very high87Confident3 Ų392.1 Ų92.12%0.01542%0.415CS..Hα-helixtrans-59.3-49.4180-66.7166.9000111.1L26 W29 A30 L33 T298 F299 R304 S305 H306L26-I302 HydrophobicContact CD1-CB 4.05Å; L26-I302 HydrophobicContact CD1-CD1 3.95Å; L26-I302 HydrophobicContact CD1-CG2 3.65Å; W29-I302 HydrophobicContact CB-CD1 4.35Å; W29-I302 HydrophobicContact CD2-CD1 4.4Å; W29-I302 HydrophobicContact CD2-CG2 4Å; W29-I302 HydrophobicContact CE3-CG2 3.65Å; W29-I302 HydrophobicContact CG-CD1 4.16Å; W29-I302 HydrophobicContact CH2-CG2 4.1Å; W29-I302 HydrophobicContact CZ2-CG2 4.42Å; W29-I302 HydrophobicContact CZ3-CG2 3.71Å; A30-I302 HydrophobicContact CB-CD1 4.09Å; L33-I302 HydrophobicContact CD1-CD1 3.95Å; L33-I302 HydrophobicContact CD1-CG1 3.71Å; T298-I302 HydrophobicContact CG2-CD1 4.07Å; T298-I302 WeakPolarHBondContact O-CG1 3.28Å; T298-I302 PolarHBondContact O-N 3.28Å; F299-I302 PolarHBondContact O-N 3.2Å; I302-R304 PolarHBondContact O-N 3Å; I302-S305 PolarHBondContact O-N 2.98Å; I302-H306 WeakPolarHBondContact O-CB 3.4Å; I302-H306 PolarHBondContact O-N 3.16Å; I302-H306 PolarHBondContact O-ND1 3.16Å
303I93.2Very high84.9Confident70 Ų7096 Ų9636%0.35944%0.443SS..Iπ-helixtrans-63.6-44.3-178.1-66166.5000110.6L26 F299 K301 V307 L308L26-I303 HydrophobicContact CD2-CD1 4.39Å; F299-I303 WeakPolarHBondContact O-CB 3.06Å; F299-I303 VanDerWaalsContact O-CG1 3.27Å; F299-I303 WeakPolarHBondContact O-CG1 3.36Å; F299-I303 PolarHBondContact O-N 3.33Å; K301-I303 PolarHBondContact O-N 3.41Å; I303-V307 HydrophobicContact CG2-CB 4.33Å; I303-V307 WeakPolarHBondContact O-CA 3.37Å; I303-V307 VanDerWaalsContact O-CB 3.31Å; I303-V307 WeakPolarHBondContact O-CB 3.48Å; I303-V307 PolarHBondContact O-N 3.11Å; I303-V307 VanDerWaalsContact O-N 3.11Å; I303-L308 HydrophobicContact CG2-CD1 4.32Å; I303-L308 HydrophobicContact CG2-CG 4.45Å; I303-L308 PolarHBondContact O-N 2.9Å
304R92.1Very high82.4Confident122 Ų12297.9 Ų97.946%0.4646%0.455SS..Iπ-helixtrans-64.6-46.8178.3-74.2176.9-179.6179.5-3.4112.7R300 K301 I302 R309 Q310R300-R304 WeakPolarHBondContact O-CB 3.07Å; R300-R304 VanDerWaalsContact O-CG 3.27Å; R300-R304 WeakPolarHBondContact O-CG 3.34Å; R300-R304 PolarHBondContact O-N 3.1Å; K301-R304 PolarHBondContact O-N 3.26Å; I302-R304 PolarHBondContact O-N 3Å; R304-R309 PolarHBondContact O-N 3.17Å; R304-Q310 PolarHBondContact O-N 3.11Å; R304-Q310 VanDerWaalsContact O-N 3.09Å
305S89.6Confident80Confident42 Ų42103.9 Ų103.929%0.29448%0.48SS..Iπ-helixtrans-78.6-38.6-173.4670000113.4K301 I302K301-S305 WeakPolarHBondContact O-CB 3.25Å; K301-S305 PolarHBondContact O-N 2.85Å; K301-S305 PolarHBondContact O-OG 2.99Å; I302-S305 PolarHBondContact O-N 2.98Å
306H87.5Confident77.4Confident98 Ų98107.3 Ų107.345%0.45451%0.508SS..Iπ-helixtrans-104.9-34.7-171.5-60.697000113.9W29 I302W29-H306 HydrophobicContact CH2-CB 3.75Å; W29-H306 AromaticContact CH2-CD2 4Å; W29-H306 AromaticContact CH2-CG 3.63Å; W29-H306 AromaticContact CH2-ND1 3.94Å; W29-H306 HydrophobicContact CZ2-CB 4.42Å; W29-H306 AromaticContact CZ2-CD2 3.89Å; W29-H306 AromaticContact CZ2-CE1 3.87Å; W29-H306 AromaticContact CZ2-CG 3.8Å; W29-H306 AromaticContact CZ2-ND1 3.78Å; W29-H306 AromaticContact CZ2-NE2 3.96Å; I302-H306 WeakPolarHBondContact O-CB 3.4Å; I302-H306 PolarHBondContact O-N 3.16Å; I302-H306 PolarHBondContact O-ND1 3.16Å
307V83.7Confident74.6Confident103 Ų103107.6 Ų107.662%0.62453%0.53SS*.Iπ-helixtrans-89.9-48.8-177.6-176.20000110.6I303I303-V307 HydrophobicContact CG2-CB 4.33Å; I303-V307 WeakPolarHBondContact O-CA 3.37Å; I303-V307 VanDerWaalsContact O-CB 3.31Å; I303-V307 WeakPolarHBondContact O-CB 3.48Å; I303-V307 PolarHBondContact O-N 3.11Å; I303-V307 VanDerWaalsContact O-N 3.11Å
308L85.4Confident71.8Confident106 Ų106107.4 Ų107.456%0.55555%0.551SS**SBendtrans-86.3-7.7-179.8-62.7172.4000113.5I303 Q310I303-L308 HydrophobicContact CG2-CD1 4.32Å; I303-L308 HydrophobicContact CG2-CG 4.45Å; I303-L308 PolarHBondContact O-N 2.9Å; L308-Q310 HydrophobicContact CB-CG 4.34Å; L308-Q310 PolarHBondContact O-N 3.5Å
309R78.5Confident69.4Low220 Ų220113.4 Ų113.483%0.8359%0.588SS**  trans45.931.1-175.1-67.3-172.8-179.7-175.50.9114R304 Q311R304-R309 PolarHBondContact O-N 3.17Å; R309-Q311 PolarHBondContact O-N 3.13Å
310Q63.5Low67.1Low123 Ų123117.4 Ų117.458%0.57562%0.617SS**  trans-77108.8171.2-71.7-172.3-26.500107.2R304 L308 E312R304-Q310 PolarHBondContact O-N 3.11Å; R304-Q310 VanDerWaalsContact O-N 3.09Å; L308-Q310 HydrophobicContact CB-CG 4.34Å; L308-Q310 PolarHBondContact O-N 3.5Å; Q310-E312 PolarHBondContact O-N 3.24Å
311Q54.4Low64.7Low186 Ų186116.4 Ų116.487%0.86963%0.633SS**PPolyproline II helixtrans-59.8121.8168.6-77.6-166.2-39.700108.1R309 P313R309-Q311 PolarHBondContact O-N 3.13Å; Q311-P313 WeakPolarHBondContact O-CD 3.12Å
312E56.5Low62.4Low135 Ų135120.8 Ų120.863%0.63165%0.646SS**PPolyproline II helixtrans-57.1124.1166.6-74.7-93.513700107.2Q310 F314Q310-E312 PolarHBondContact O-N 3.24Å; E312-F314 PolarHBondContact O-N 2.95Å; E312-F314 VanDerWaalsContact O-N 3.07Å
313P47.2Very low60.1Low115 Ų115126.3 Ų126.375%0.74768%0.68SS**PPolyproline II helixtrans-59.8120.2176.521.7-29.7000108.4Q311 K315Q311-P313 WeakPolarHBondContact O-CD 3.12Å; P313-K315 PolarHBondContact O-N 3.38Å
314F41.4Very low58Low189 Ų189130.8 Ų130.883%0.82970%0.704SS**  trans-55.4110.7175.6-166.2-92.6000108.3E312 A316E312-F314 PolarHBondContact O-N 2.95Å; E312-F314 VanDerWaalsContact O-N 3.07Å; F314-A316 HydrophobicContact CD1-CB 3.86Å; F314-A316 HydrophobicContact CE1-CB 4.14Å; F314-A316 PolarHBondContact O-N 3.03Å
315K43.9Very low56Low212 Ų212129.4 Ų129.492%0.92272%0.718SS**  trans-69.379169.9-80.6-173.7176-178.80109P313P313-K315 PolarHBondContact O-N 3.38Å
316A40.6Very low54.3Low72 Ų72131.2 Ų131.260%0.59574%0.736SS**  trans-79.8143158.200000109.3F314F314-A316 HydrophobicContact CD1-CB 3.86Å; F314-A316 HydrophobicContact CE1-CB 4.14Å; F314-A316 PolarHBondContact O-N 3.03Å
317A37.2Very low52.5Low96 Ų96135.7 Ų135.779%0.79376%0.756SS**  trans76.184.616900000118.1
318G37.7Very low50.4Low81 Ų81134.2 Ų134.284%0.83576%0.762SS**  trans-997.9154.700000113.9
319T46Very low48.3Very low136 Ų136135 Ų13583%0.83478%0.776SS**SBendtrans-101.65.6-165.3-9.60000116
320S46.7Very low46.5Very low97 Ų97132.8 Ų132.868%0.67878%0.781SS**SBendtrans-120.7-11.9-176.1-151.60000115.7R322S320-R322 PolarHBondContact O-N 3.38Å
321A45.6Very low45.3Very low93 Ų93130.4 Ų130.477%0.76979%0.789SS**THydrogen-bonded Turntrans-82.1-6-174.200000115.6
322R45.6Very low44.4Very low237 Ų237130.5 Ų130.589%0.89479%0.79SS**THydrogen-bonded Turntrans-96.2-7.1-178.4-88.9-175.5178.2166.6-0.7115.6S320S320-R322 PolarHBondContact O-N 3.38Å
323V46.5Very low43.5Very low120 Ų120133.5 Ų133.573%0.72780%0.804SS**SBendtrans-89.3-18.1-177.4178.30000112.7
324L47.7Very low43Very low164 Ų164134.2 Ų134.286%0.85981%0.805SS**THydrogen-bonded Turntrans-87.7-4.9-178.5-78.2159.3000115.1
325A51.3Low42.8Very low93 Ų93130 Ų13077%0.76980%0.799SS**THydrogen-bonded Turntrans-92.90.4179.900000114.2
326A53.1Low42.4Very low80 Ų80127.9 Ų127.966%0.66180%0.797SS**SBendtrans-101.710-169.400000115.3
327H49.1Very low41.9Very low192 Ų192135 Ų13589%0.88981%0.809SS**SBendtrans-13524-171.4-108.2-63.5000116.4
328G41Very low42.1Very low72 Ų72139 Ų13974%0.74282%0.816SS**  trans-128.4119.9179.800000113.7
329S40.7Very low42Very low121 Ų121142.7 Ų142.785%0.84682%0.816SS**  trans96.883.5156.8-136.80000117.8
330D41Very low41.6Very low175 Ų175139.8 Ų139.894%0.93681%0.813SS**  trans-65133.1137.6-78.5-41.9000108.6
331G38Very low41.3Very low72 Ų72144.4 Ų144.474%0.74282%0.824SS**  trans173.189.6-177.700000112.9
332E36.4Very low41.2Very low189 Ų189145 Ų14588%0.88382%0.82SS**  trans-60.2126177.2-153.7170.7126.800112.6
333Q37.9Very low40.8Very low198 Ų198139.4 Ų139.493%0.92581%0.814SS**  trans-153120.1155.7-119.3-178.52400112.8
334V35.7Very low40.6Very low129 Ų129137.8 Ų137.878%0.78282%0.822SS**  trans-80.1133.7172.5168.30000109.5
335S37.1Very low40.2Very low100 Ų100135.1 Ų135.170%0.69981%0.812SS**  trans-177141.8131.255.90000115
336L35.4Very low39.6Very low168 Ų168142.2 Ų142.288%0.8882%0.819SS**  trans77.8103.4149.3-75.8149000120.3
337R31.1Very low39Very low223 Ų223142.7 Ų142.784%0.84282%0.823SS**  trans-70.4144.1163.7-71.2-174.4175178.2-0.8112.1
338L40.6Very low38.5Very low180 Ų180142 Ų14294%0.94283%0.826SS**  trans-137.7125.8147-106.4142000108.4
339N36.1Very low38.4Very low157 Ų157142.1 Ų142.184%0.8483%0.827SS**  trans-65.7145.4-173.6-79.3-28.3000113.4
340G36.6Very low38.5Very low75 Ų75142.1 Ų142.177%0.77383%0.827SS**  trans173.693.1164.300000114.9
341H40.1Very low38.3Very low194 Ų194138.2 Ų138.290%0.89882%0.819SS**  trans79.8134.3165.1-94-56.3000121.2
342P44.1Very low38.6Very low107 Ų107140.2 Ų140.270%0.69582%0.819SS**PPolyproline II helixtrans-89.6162.4-174.137.8-31.3000113
343P37.8Very low38.9Very low118 Ų118139.5 Ų139.577%0.76682%0.816SS**PPolyproline II helixtrans-93135.1-173.429.2-17.8000112.8
344G41.3Very low39.1Very low86 Ų86136 Ų13689%0.88781%0.81SS**PPolyproline II helixtrans-78.1120.3167.400000111.3
345V39.4Very low39.4Very low109 Ų109138.8 Ų138.866%0.66181%0.814SS**PPolyproline II helixtrans-81.7167.3172.71730000109.9
346W38.7Very low39.5Very low242 Ų242144.6 Ų144.692%0.91782%0.821SS**  trans91.7124.9172.4-47.6102.7000113.8
347A41.6Very low39.8Very low90 Ų90147.1 Ų147.174%0.74482%0.819SS**  cis-159155.59.500000109.8
348N38.6Very low40.3Very low177 Ų177141.2 Ų141.295%0.94781%0.81SS**  trans-54.7132.6170-79.9-28.6000111.9
349G38.9Very low40.3Very low74 Ų74140 Ų14076%0.76380%0.804SS**  trans-152.4106.9172.200000110
350S41.4Very low40.3Very low121 Ų121136 Ų13685%0.84680%0.801SS**  trans-52.2141.6-175.8-35.70000114.5
351A37.1Very low40.4Very low94 Ų94143.4 Ų143.478%0.77781%0.807SS**  trans-63.9157.3161.800000111.3
352P44.5Very low40.3Very low114 Ų114138.9 Ų138.974%0.7480%0.803SS**  -146.7149.8106.531.9-13.2000116.5
353H43.6Very low40Very low174 Ų174142.4 Ų142.481%0.80682%0.815SS**  trans55.2128.8144.3-80.4-72.1000123
354P42.2Very low39.8Very low124 Ų124140.4 Ų140.481%0.80582%0.815SS**  trans-98.6120.415032.6-21.2000111
355E41Very low39.3Very low188 Ų188144.5 Ų144.588%0.87982%0.816SS**  trans-82.5122.6168.8-89.7-167.7134.500112.5
356R38.7Very low39.2Very low222 Ų222146.5 Ų146.584%0.83883%0.828SS**  -2150.5129.4-79.2-177179.7-176.12.3116.6
357R41.5Very low39Very low220 Ų220140.5 Ų140.583%0.8382%0.823SS**  cis-176.3-174.71.3-121.8-159.9-1761753.3107.4
358P41.7Very low38.7Very low100 Ų100140 Ų14065%0.64983%0.827SS**  trans-111.3174.4-143.643.9-31.1000114.3
359N41.6Very low38.4Very low153 Ų153134.6 Ų134.682%0.81881%0.813SS**  trans-135.5106.2158.7-83.2-23.7000110.8
360G36.7Very low38.1Very low75 Ų75137.2 Ų137.277%0.77382%0.82SS**  trans-100.6128.916200000108.8
361Y37.3Very low37.8Very low230 Ų230135.6 Ų135.690%0.90281%0.813SS**  trans-80.2119.3176.9-71.3-87.6000110.1
362A39.1Very low37.7Very low99 Ų99140.6 Ų140.682%0.81882%0.821SS**  trans-109.1121.4161.700000108.2
363L36.1Very low37.1Very low181 Ų181143.8 Ų143.895%0.94883%0.826SS**  trans-70.5120.9169.7-98.7125.5000109.2
364G34.2Very low36.6Very low75 Ų75141 Ų14177%0.77383%0.826SS**  trans-126.2112.7167.400000109.4
365L30.7Very low36.2Very low173 Ų173144 Ų14491%0.90683%0.829SS**  trans-64.3127.8168.5-82.1144.4000110.3
366V36.7Very low35.9Very low150 Ų150138.6 Ų138.691%0.90982%0.824SS**  trans-138.9134.9150.9175.10000109.1
367S34.8Very low35.7Very low116 Ų116135.2 Ų135.281%0.81182%0.823SS**  trans-92.8154.2-174.2-175.70000111.9
368G35.3Very low35.3Very low80 Ų80131.1 Ų131.183%0.82582%0.822SS**  trans88129.8162.800000114.2
369G33.3Very low35Very low64 Ų64130.2 Ų130.266%0.6683%0.831SS**  cis162.7145.25.100000107.4
370S32.9Very low34.7Very low129 Ų129130.9 Ų130.990%0.90283%0.834SS**  trans58.3143.1164.155.80000118.3
371A35Very low34.9Very low86 Ų86131.6 Ų131.671%0.71183%0.825SS**  cis-173.1155.5-8.700000106.1
372Q34.8Very low34.8Very low199 Ų199128 Ų12893%0.9382%0.821SS**  trans127.3118.3146.7-77.2179.7-58.400116.7
373E30.7Very low34.7Very low181 Ų181129 Ų12985%0.84682%0.817SS**  trans-77.3151.4-178.2-64.6159.8103.100113.3
374S34.1Very low34.6Very low117 Ų117129.4 Ų129.482%0.81881%0.814SS**  trans-167.892.7138.1-149.30000108.2
375Q34.5Very low34.6Very low187 Ų187133.2 Ų133.287%0.87482%0.816SS**  51.2121.2101-83.8-171.42.700116.5
376G34.1Very low34.8Very low74 Ų74132.7 Ų132.776%0.76381%0.813SS**  trans157.190.3153.700000117.4
377N33.7Very low34.5Very low151 Ų151130.9 Ų130.981%0.80781%0.807SS**  trans52.5113.6145.6-85.2-3.4000121.4
378T34.8Very low34.5Very low133 Ų133132.8 Ų132.882%0.81680%0.803SS**  67.7126.375.562.20000115.9
379G34.5Very low34.7Very low82 Ų82136.9 Ų136.985%0.84580%0.8SS**  trans142.5102.916100000115.8
380L35.4Very low34.9Very low167 Ų167139.2 Ų139.287%0.87480%0.797SS**  trans-79.2-167.6179.3-153.285.3000112.1
381P41.6Very low35.1Very low90 Ų90142.1 Ų142.158%0.58479%0.794SS**  -107.5179.9-87.933.9-16.4000113.8
382D34.4Very low34.9Very low153 Ų153141.4 Ų141.482%0.81879%0.794SS**  trans169.9166.3132-90.5-25.2000113.6
383V38.2Very low35.5Very low122 Ų122139 Ų13974%0.73979%0.793SS**  trans104.472.9158.1-162.20000117
384E33.9Very low36.1Very low188 Ų188136.3 Ų136.388%0.87979%0.793SS**  13.8105.8110.7-147.7170.2-163.600117.1
385L33.7Very low36.8Very low155 Ų155136.6 Ų136.681%0.81279%0.792SS**  trans-162.2114.2158.7-147.775.3000111.1
386L34.2Very low37.3Very low163 Ų163137 Ų13785%0.85379%0.793SS**  trans15566.6143.9-83.9150.7000111.7
387S31.5Very low38.5Very low111 Ų111139 Ų13978%0.77679%0.793SS**  trans-105.7144.2144.543.90000107.5
388H34.2Very low39.1Very low156 Ų156138 Ų13872%0.72280%0.795SS**  trans85.587.4178.2-93.9-98.3000118.6
389E38.9Very low39.3Very low166 Ų166135.1 Ų135.178%0.77679%0.792SS**  trans-135.787.6142.6-87.9-66.815800105.7
390L37.8Very low40Very low113 Ų113138.9 Ų138.959%0.59279%0.792SS**  56.6106.883.3-105.7132.6000114.4
391K36.6Very low40.5Very low191 Ų191137.9 Ų137.983%0.8379%0.788SS**  147.495.8122.2-81.6171.2-179.6174.40112
392G32.2Very low40.3Very low70 Ų70141 Ų14172%0.72280%0.799SS**  trans-115.9151.9148.200000108.3
393V46.1Very low40.9Very low149 Ų149138.5 Ų138.590%0.90379%0.792SS**  trans92.6109.2175.6-167.20000115.4
394C44.6Very low41.1Very low125 Ų125140.4 Ų140.485%0.84580%0.796SS**  trans-94.9144.7162.9-71.50000109.5
395P48.5Very low41.6Very low123 Ų123135 Ų13580%0.79978%0.784SS**  trans-104.6145.7167.632.8-21.1000113
396E45.5Very low42.2Very low194 Ų194136.5 Ų136.591%0.90779%0.787SS**PPolyproline II helixtrans-73.6153.5168.8-84.7179.4107.200112.6
397P57.9Low42.6Very low116 Ų116136.4 Ų136.475%0.75379%0.787SS**PPolyproline II helixtrans-99.7157.1167.536.2-27.1000113.2
398P46.1Very low43.2Very low130 Ų130134 Ų13484%0.84478%0.78SS**PPolyproline II helixtrans-91161.1-16836.4-32.8000114.1
399G39.2Very low43.8Very low74 Ų74132 Ų13276%0.76379%0.791SS**PPolyproline II helixtrans-77.1172.8-172.500000117.2
400L49.3Very low44.3Very low161 Ų161127.3 Ų127.384%0.84379%0.787SS**  trans-148.2112.9168.8-142.286.1000109.6
401D46.4Very low45Very low146 Ų146128.8 Ų128.878%0.78180%0.8SS**  trans56.6113.7141.3-52.3-24000122.9
402D37.9Very low45.8Very low155 Ų155128.8 Ų128.883%0.82982%0.824SS**  trans-62.2179.2150.7-121-19.1000111
403P45.5Very low46.5Very low101 Ų101131.8 Ų131.866%0.65683%0.829SS**  cis-143.8178.715.133.3-8.9000116.2
404L43.1Very low46.5Very low161 Ų161130.8 Ų130.884%0.84383%0.826SS**  trans135.8135.5133.2-83.3146.1000117.3
405A43.9Very low46.6Very low75 Ų75131.2 Ų131.262%0.6283%0.825SS**  trans80.6109.5150.400000117.7
406Q46.7Very low46.5Very low187 Ų187131.6 Ų131.687%0.87483%0.826SS**  63.8126.297-72179.3-21.900111.2
407D43.2Very low46.6Very low161 Ų161127.8 Ų127.886%0.86182%0.821SS**  cis-176.7163.242.2-155.5-6000109.4
408G43.4Very low45.8Very low61 Ų61128.5 Ų128.563%0.62983%0.826SS**  trans95.4104.4143.400000121.1
409A47.6Very low45.8Very low114 Ų114128.4 Ų128.494%0.94282%0.824SS**  trans49138131.300000120.3
410G49.7Very low46.3Very low67 Ų67132.6 Ų132.669%0.69183%0.829SS**  cis143137.317.100000109.4
411V53Low46Very low144 Ų144130.3 Ų130.387%0.87383%0.828SS**  trans72.7100.5149.7-163.90000119.9
412S52.3Low46Very low191 Ų191128.8 Ų128.8100%1.33683%0.832SS**  -1710100.8-730000110.6

Retrieved 412 of 412 residues in 72.7 ms (Link to these results)

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