A0A077YXV5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YXV5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 316 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
1M61.1Low86.5Confident116 Ų11657.8 Ų57.857%0.57131%0.313SS*.  0-40.40-150.9143.2139.400113.1I3 L4 G5 V86 F90M1-I3 PolarHBondContact O-N 3.17Å; M1-I3 VanDerWaalsContact O-N 3.17Å; M1-L4 WeakPolarHBondContact O-CA 3.24Å; M1-L4 VanDerWaalsContact O-CB 3.29Å; M1-L4 WeakPolarHBondContact O-CB 3.42Å; M1-L4 PolarHBondContact O-N 2.87Å; M1-G5 PolarHBondContact O-N 3.38Å; M1-V86 HydrophobicContact CB-CB 4.49Å; M1-V86 HydrophobicContact CB-CG1 3.47Å; M1-V86 VanDerWaalsContact CB-CG1 3.47Å; M1-V86 HydrophobicContact CB-CG2 4.4Å; M1-V86 HydrophobicContact CE-CG1 4.17Å; M1-V86 HydrophobicContact CG-CG1 3.9Å; M1-V86 HydrophobicContact SD-CG1 3.34Å; M1-V86 WeakPolarHBondContact SD-CG1 3.15Å; M1-F90 HydrophobicContact CE-CB 4Å; M1-F90 HydrophobicContact CE-CD2 4.18Å; M1-F90 HydrophobicContact CE-CG 4.13Å
2C81.1Confident87.1Confident12 Ų1254.6 Ų54.68%0.08130%0.298CS..Hα-helixtrans-55.4-31.7169.5-500000112.7L4 G5 Y6 I64 C89C2-L4 VanDerWaalsContact C-N 3.31Å; C2-L4 PolarHBondContact O-N 2.98Å; C2-G5 PolarHBondContact O-N 3.46Å; C2-Y6 PolarHBondContact O-N 2.89Å; C2-I64 HydrophobicContact CB-CD1 4.49Å; C2-I64 HydrophobicContact CB-CG1 3.78Å; C2-C89 PolarHBondContact SG-SG 3.49Å
3I85Confident87.3Confident114 Ų11450.9 Ų50.959%0.58528%0.278SS*.Hα-helixtrans-60.2-37.7171.4-58.6171.5000111.8M1 Y6 C7M1-I3 PolarHBondContact O-N 3.17Å; M1-I3 VanDerWaalsContact O-N 3.17Å; I3-Y6 WeakPolarHBondContact O-CB 3.27Å; I3-Y6 PolarHBondContact O-N 3.14Å; I3-C7 PolarHBondContact O-N 3.16Å; I3-C7 PolarHBondContact O-SG 3.5Å
4L87.2Confident87.5Confident114 Ų11451.4 Ų51.460%0.59729%0.287SS*.Hα-helixtrans-66.2-45.1176.5-177.367.2000110.5M1 C2 Y6 C7 V8M1-L4 WeakPolarHBondContact O-CA 3.24Å; M1-L4 VanDerWaalsContact O-CB 3.29Å; M1-L4 WeakPolarHBondContact O-CB 3.42Å; M1-L4 PolarHBondContact O-N 2.87Å; C2-L4 VanDerWaalsContact C-N 3.31Å; C2-L4 PolarHBondContact O-N 2.98Å; L4-Y6 VanDerWaalsContact C-N 3.29Å; L4-Y6 PolarHBondContact O-N 2.88Å; L4-C7 PolarHBondContact O-N 3.36Å; L4-V8 WeakPolarHBondContact O-CG2 3.42Å; L4-V8 PolarHBondContact O-N 3.33Å
5G89.7Confident87.7Confident9 Ų952.6 Ų52.69%0.09329%0.291CS..Hα-helixtrans-56.9-43.5172.800000111.9M1 C2 V8 A9 L56 S60M1-G5 PolarHBondContact O-N 3.38Å; C2-G5 PolarHBondContact O-N 3.46Å; G5-V8 PolarHBondContact O-N 3.02Å; G5-A9 WeakPolarHBondContact O-CB 3.39Å; G5-A9 PolarHBondContact O-N 3.41Å; G5-L56 WeakPolarHBondContact O-CD2 3.45Å; G5-S60 VanDerWaalsContact C-OG 3.26Å
6Y89.6Confident87.8Confident16 Ų1649.3 Ų49.36%0.06327%0.273CS..Hα-helixtrans-59.5-47.4174-178.9-90.2000112.2C2 I3 L4 A9 M10 L57 S60 L184 V188 F226C2-Y6 PolarHBondContact O-N 2.89Å; I3-Y6 WeakPolarHBondContact O-CB 3.27Å; I3-Y6 PolarHBondContact O-N 3.14Å; L4-Y6 VanDerWaalsContact C-N 3.29Å; L4-Y6 PolarHBondContact O-N 2.88Å; Y6-A9 WeakPolarHBondContact O-CB 3.37Å; Y6-A9 PolarHBondContact O-N 3.41Å; Y6-M10 HydrophobicContact CD1-CG 4.02Å; Y6-M10 HydrophobicContact CE1-CG 3.61Å; Y6-M10 HydrophobicContact CE1-SD 4.41Å; Y6-M10 WeakPolarHBondContact O-CB 3.44Å; Y6-M10 WeakPolarHBondContact O-CG 3.47Å; Y6-M10 PolarHBondContact O-N 3.21Å; Y6-L57 HydrophobicContact CD2-CD1 3.53Å; Y6-L57 HydrophobicContact CE2-CD1 3.37Å; Y6-L57 HydrophobicContact CG-CD1 4.39Å; Y6-S60 PolarHBondContact N-OG 3.5Å; Y6-L184 HydrophobicContact CE1-CD1 4.26Å; Y6-L184 HydrophobicContact CE2-CD1 4.18Å; Y6-L184 HydrophobicContact CE2-CD2 3.95Å; Y6-L184 HydrophobicContact CE2-CG 4.25Å; Y6-V188 HydrophobicContact CE2-CG2 3.94Å; Y6-F226 HydrophobicContact CE1-CE1 4.13Å; Y6-F226 WeakPolarHBondContact OH-CE1 3.42Å
7C90.7Very high87.7Confident57 Ų5748.4 Ų48.439%0.38527%0.269SS..Hα-helixtrans-62.1-45.2178.1-68.70000112I3 L4 A9 M10 I11I3-C7 PolarHBondContact O-N 3.16Å; I3-C7 PolarHBondContact O-SG 3.5Å; L4-C7 PolarHBondContact O-N 3.36Å; C7-A9 VanDerWaalsContact C-N 3.31Å; C7-A9 PolarHBondContact O-N 3.05Å; C7-M10 PolarHBondContact O-N 3.26Å; C7-I11 VanDerWaalsContact O-CG1 3.31Å; C7-I11 WeakPolarHBondContact O-CG1 2.98Å; C7-I11 PolarHBondContact O-N 3.25Å
8V92.5Very high87.7Confident64 Ų6451.4 Ų51.439%0.38829%0.288SS..Hα-helixtrans-60.5-44.1175.81730000110.2L4 G5 M10 I11 C12 L56L4-V8 WeakPolarHBondContact O-CG2 3.42Å; L4-V8 PolarHBondContact O-N 3.33Å; G5-V8 PolarHBondContact O-N 3.02Å; V8-M10 PolarHBondContact O-N 3.41Å; V8-I11 PolarHBondContact O-N 2.95Å; V8-C12 PolarHBondContact O-N 3.17Å; V8-C12 PolarHBondContact O-SG 3.03Å; V8-L56 HydrophobicContact CB-CD2 4.05Å; V8-L56 HydrophobicContact CG1-CD2 3.78Å
9A93.2Very high87.7Confident0 Ų052.8 Ų52.80%030%0.295CS..Hα-helixtrans-60.7-45.3177.100000112.3G5 Y6 C7 I11 C12 I13 L56 L57G5-A9 WeakPolarHBondContact O-CB 3.39Å; G5-A9 PolarHBondContact O-N 3.41Å; Y6-A9 WeakPolarHBondContact O-CB 3.37Å; Y6-A9 PolarHBondContact O-N 3.41Å; C7-A9 VanDerWaalsContact C-N 3.31Å; C7-A9 PolarHBondContact O-N 3.05Å; A9-I11 VanDerWaalsContact C-N 3.33Å; A9-I11 PolarHBondContact O-N 3.4Å; A9-C12 PolarHBondContact O-N 2.97Å; A9-I13 WeakPolarHBondContact O-CB 3.32Å; A9-I13 WeakPolarHBondContact O-CG1 3.46Å; A9-I13 PolarHBondContact O-N 3.05Å; A9-L56 HydrophobicContact CB-CB 3.89Å; A9-L56 HydrophobicContact CB-CD2 4.01Å; A9-L56 HydrophobicContact CB-CG 3.86Å; A9-L57 HydrophobicContact CB-CB 3.74Å; A9-L57 HydrophobicContact CB-CD1 4.18Å
10M89.9Confident87.5Confident30 Ų3050.5 Ų50.515%0.14828%0.282CS..Hα-helixtrans-60.5-41.8176.6-76-61.7-60.700112Y6 C7 V8 S14 L57 Y223Y6-M10 HydrophobicContact CD1-CG 4.02Å; Y6-M10 HydrophobicContact CE1-CG 3.61Å; Y6-M10 HydrophobicContact CE1-SD 4.41Å; Y6-M10 WeakPolarHBondContact O-CB 3.44Å; Y6-M10 WeakPolarHBondContact O-CG 3.47Å; Y6-M10 PolarHBondContact O-N 3.21Å; C7-M10 PolarHBondContact O-N 3.26Å; V8-M10 PolarHBondContact O-N 3.41Å; M10-S14 VanDerWaalsContact O-CB 3.23Å; M10-S14 WeakPolarHBondContact O-CB 3.23Å; M10-S14 PolarHBondContact O-N 2.87Å; M10-S14 PolarHBondContact O-OG 2.81Å; M10-L57 HydrophobicContact CG-CD1 4.19Å; M10-L57 HydrophobicContact SD-CD1 3.95Å; M10-L57 HydrophobicContact SD-CD2 4.47Å; M10-Y223 HydrophobicContact CE-CD1 3.61Å; M10-Y223 HydrophobicContact CE-CE1 4.06Å; M10-Y223 HydrophobicContact CE-CG 4.43Å; M10-Y223 HydrophobicContact SD-CD1 3.96Å; M10-Y223 HydrophobicContact SD-CE1 3.77Å
11I91.8Very high87.2Confident104 Ų10450.9 Ų50.953%0.53328%0.282SS..Hα-helixtrans-63.7-49.4175.5-67.8165.1000110.1C7 V8 A9 I13 S14 I15C7-I11 VanDerWaalsContact O-CG1 3.31Å; C7-I11 WeakPolarHBondContact O-CG1 2.98Å; C7-I11 PolarHBondContact O-N 3.25Å; V8-I11 PolarHBondContact O-N 2.95Å; A9-I11 VanDerWaalsContact C-N 3.33Å; A9-I11 PolarHBondContact O-N 3.4Å; I11-I13 PolarHBondContact O-N 2.82Å; I11-S14 PolarHBondContact O-N 3.18Å; I11-I15 HydrophobicContact CG2-CD1 3.71Å; I11-I15 HydrophobicContact CG2-CG1 4.44Å; I11-I15 VanDerWaalsContact O-CG1 3.29Å; I11-I15 WeakPolarHBondContact O-CG1 3.19Å; I11-I15 PolarHBondContact O-N 3.45Å
12C93.1Very high87.9Confident19 Ų1948.3 Ų48.313%0.12827%0.274CS..Hα-helixtrans-58.6-47.3178.6-70.60000112.1V8 A9 I15 G16 F49V8-C12 PolarHBondContact O-N 3.17Å; V8-C12 PolarHBondContact O-SG 3.03Å; A9-C12 PolarHBondContact O-N 2.97Å; C12-I15 PolarHBondContact O-N 3.5Å; C12-G16 PolarHBondContact O-N 3.11Å; C12-F49 HydrophobicContact CB-CD1 4.21Å
13I90.5Very high87.5Confident7 Ų749.5 Ų49.54%0.03628%0.279CS..Hα-helixtrans-64.2-43.7178.2-69.8168.1000110.3A9 I11 I15 G16 V17 Y50 L57 Y223A9-I13 WeakPolarHBondContact O-CB 3.32Å; A9-I13 WeakPolarHBondContact O-CG1 3.46Å; A9-I13 PolarHBondContact O-N 3.05Å; I11-I13 PolarHBondContact O-N 2.82Å; I13-I15 PolarHBondContact O-N 2.79Å; I13-G16 CarbonylContact O-C 3.6Å; I13-G16 PolarHBondContact O-N 3.1Å; I13-G16 VanDerWaalsContact O-N 3.16Å; I13-V17 HydrophobicContact CG2-CG2 4.24Å; I13-V17 VanDerWaalsContact O-CG2 3.31Å; I13-V17 WeakPolarHBondContact O-CG2 3.39Å; I13-V17 PolarHBondContact O-N 2.85Å; I13-Y50 HydrophobicContact CG2-CE1 4.46Å; I13-L57 HydrophobicContact CD1-CB 3.73Å; I13-L57 HydrophobicContact CD1-CD2 3.41Å; I13-L57 VanDerWaalsContact CD1-CD2 3.41Å; I13-L57 HydrophobicContact CD1-CG 4.12Å; I13-Y223 HydrophobicContact CG2-CE2 4.29Å
14S88.9Confident86.9Confident58 Ų5847.9 Ų47.941%0.40627%0.266SS..Hα-helixtrans-61.3-44.5179.4-59.50000111.6M10 I11 V17 V18M10-S14 VanDerWaalsContact O-CB 3.23Å; M10-S14 WeakPolarHBondContact O-CB 3.23Å; M10-S14 PolarHBondContact O-N 2.87Å; M10-S14 PolarHBondContact O-OG 2.81Å; I11-S14 PolarHBondContact O-N 3.18Å; S14-V17 PolarHBondContact O-N 2.91Å; S14-V18 WeakPolarHBondContact O-CG2 3.35Å; S14-V18 PolarHBondContact O-N 3.47Å
15I91.3Very high86.2Confident69 Ų6948.5 Ų48.535%0.35427%0.269SS..Hα-helixtrans-61.9-45.3174.2-66.2167.7000110.2I11 C12 I13 V17 V18 L19 F49I11-I15 HydrophobicContact CG2-CD1 3.71Å; I11-I15 HydrophobicContact CG2-CG1 4.44Å; I11-I15 VanDerWaalsContact O-CG1 3.29Å; I11-I15 WeakPolarHBondContact O-CG1 3.19Å; I11-I15 PolarHBondContact O-N 3.45Å; C12-I15 PolarHBondContact O-N 3.5Å; I13-I15 PolarHBondContact O-N 2.79Å; I15-V17 VanDerWaalsContact C-N 3.33Å; I15-V17 PolarHBondContact O-N 3.44Å; I15-V18 PolarHBondContact O-N 3.12Å; I15-L19 HydrophobicContact CG2-CD1 3.76Å; I15-L19 HydrophobicContact CG2-CG 4.2Å; I15-L19 WeakPolarHBondContact O-CB 3.33Å; I15-L19 VanDerWaalsContact O-CG 3.28Å; I15-L19 WeakPolarHBondContact O-CG 3.17Å; I15-L19 PolarHBondContact O-N 3.37Å; I15-F49 HydrophobicContact CB-CD1 4.39Å; I15-F49 HydrophobicContact CB-CE1 4.42Å; I15-F49 HydrophobicContact CD1-CE1 4.29Å; I15-F49 HydrophobicContact CG2-CD1 4.22Å; I15-F49 HydrophobicContact CG2-CD2 3.86Å; I15-F49 HydrophobicContact CG2-CE1 4.01Å; I15-F49 HydrophobicContact CG2-CE2 3.63Å; I15-F49 HydrophobicContact CG2-CG 4.15Å; I15-F49 HydrophobicContact CG2-CZ 3.71Å
16G89.7Confident85.1Confident0 Ų055.8 Ų55.80%030%0.295CS..Hα-helixtrans-57.7-43.1175.900000112.9C12 I13 L19 S20 Y50C12-G16 PolarHBondContact O-N 3.11Å; I13-G16 CarbonylContact O-C 3.6Å; I13-G16 PolarHBondContact O-N 3.1Å; I13-G16 VanDerWaalsContact O-N 3.16Å; G16-L19 PolarHBondContact O-N 2.62Å; G16-S20 VanDerWaalsContact O-CB 3.29Å; G16-S20 WeakPolarHBondContact O-CB 3.42Å; G16-S20 PolarHBondContact O-N 2.8Å; G16-S20 PolarHBondContact O-OG 3.33Å; G16-Y50 PolarHBondContact O-OH 3.31Å
17V85.5Confident83.8Confident33 Ų3358.4 Ų58.420%0.231%0.308CS..Hα-helixtrans-61.8-54.2175.8172.20000109.9I13 S14 I15 L19 S20 Q21 Y50 I220I13-V17 HydrophobicContact CG2-CG2 4.24Å; I13-V17 VanDerWaalsContact O-CG2 3.31Å; I13-V17 WeakPolarHBondContact O-CG2 3.39Å; I13-V17 PolarHBondContact O-N 2.85Å; S14-V17 PolarHBondContact O-N 2.91Å; I15-V17 VanDerWaalsContact C-N 3.33Å; I15-V17 PolarHBondContact O-N 3.44Å; V17-L19 VanDerWaalsContact C-N 3.3Å; V17-L19 PolarHBondContact O-N 2.97Å; V17-S20 WeakPolarHBondContact CA-OG 3.44Å; V17-S20 PolarHBondContact O-N 3.16Å; V17-S20 PolarHBondContact O-OG 2.9Å; V17-Q21 HydrophobicContact CG1-CG 4.43Å; V17-Q21 WeakPolarHBondContact O-CG 3.1Å; V17-Q21 PolarHBondContact O-N 3.04Å; V17-Y50 VanDerWaalsContact CA-OH 3.22Å; V17-Y50 WeakPolarHBondContact CA-OH 3.11Å; V17-Y50 HydrophobicContact CG2-CE1 4.26Å; V17-Y50 WeakPolarHBondContact CG2-OH 3.27Å; V17-Y50 PolarHBondContact N-OH 2.84Å; V17-I220 HydrophobicContact CG1-CG1 4.49Å
18V88Confident82.2Confident103 Ų10360.5 Ų60.562%0.62432%0.321SS*.Hα-helixtrans-56.7-43.6-179.9171.80000111.6S14 I15 S20 Q21 P22S14-V18 WeakPolarHBondContact O-CG2 3.35Å; S14-V18 PolarHBondContact O-N 3.47Å; I15-V18 PolarHBondContact O-N 3.12Å; V18-S20 VanDerWaalsContact C-N 3.31Å; V18-S20 PolarHBondContact O-N 3.04Å; V18-Q21 PolarHBondContact O-N 3.44Å; V18-P22 VanDerWaalsContact O-CD 3.24Å; V18-P22 WeakPolarHBondContact O-CD 3.46Å
19L87.3Confident80.4Confident78 Ų7865.8 Ų65.841%0.40834%0.339SS..Hα-helixtrans-68.8-27177.5-69.9176.8000113.3I15 G16 V17 W45 H46 F49I15-L19 HydrophobicContact CG2-CD1 3.76Å; I15-L19 HydrophobicContact CG2-CG 4.2Å; I15-L19 WeakPolarHBondContact O-CB 3.33Å; I15-L19 VanDerWaalsContact O-CG 3.28Å; I15-L19 WeakPolarHBondContact O-CG 3.17Å; I15-L19 PolarHBondContact O-N 3.37Å; G16-L19 PolarHBondContact O-N 2.62Å; V17-L19 VanDerWaalsContact C-N 3.3Å; V17-L19 PolarHBondContact O-N 2.97Å; L19-W45 HydrophobicContact CD1-CB 4.27Å; L19-H46 HydrophobicContact CB-CB 3.91Å; L19-F49 HydrophobicContact CD1-CD2 3.82Å; L19-F49 HydrophobicContact CD1-CE2 3.8Å
20S84.1Confident78.8Confident7 Ų771.5 Ų71.55%0.04936%0.364CS..Hα-helixtrans-84-22.817970.50000114.1G16 V17 V18 L23 R24 Y50G16-S20 VanDerWaalsContact O-CB 3.29Å; G16-S20 WeakPolarHBondContact O-CB 3.42Å; G16-S20 PolarHBondContact O-N 2.8Å; G16-S20 PolarHBondContact O-OG 3.33Å; V17-S20 WeakPolarHBondContact CA-OG 3.44Å; V17-S20 PolarHBondContact O-N 3.16Å; V17-S20 PolarHBondContact O-OG 2.9Å; V18-S20 VanDerWaalsContact C-N 3.31Å; V18-S20 PolarHBondContact O-N 3.04Å; S20-L23 WeakPolarHBondContact O-CB 3Å; S20-L23 PolarHBondContact O-N 3.47Å; S20-R24 PolarHBondContact O-N 2.86Å; S20-Y50 PolarHBondContact OG-OH 3.43Å
21Q80Confident77.1Confident58 Ų5874.3 Ų74.327%0.27138%0.384SS..Hα-helixtrans-60.5-47.1-176.5-72.2-58.5-29.500113.9V17 V18 L23 R24 L25V17-Q21 HydrophobicContact CG1-CG 4.43Å; V17-Q21 WeakPolarHBondContact O-CG 3.1Å; V17-Q21 PolarHBondContact O-N 3.04Å; V18-Q21 PolarHBondContact O-N 3.44Å; Q21-L23 PolarHBondContact O-N 3.39Å; Q21-R24 PolarHBondContact O-N 3.5Å; Q21-L25 PolarHBondContact O-N 3.35Å
22P77.3Confident75.8Confident63 Ų6377.9 Ų77.941%0.40940%0.399SS..Hα-helixtrans-55.6-41.9176.5-24.633.7000111.1V18 R24 L25 Y26V18-P22 VanDerWaalsContact O-CD 3.24Å; V18-P22 WeakPolarHBondContact O-CD 3.46Å; P22-R24 VanDerWaalsContact C-N 3.32Å; P22-R24 PolarHBondContact O-N 2.89Å; P22-L25 PolarHBondContact O-N 3.32Å; P22-L25 VanDerWaalsContact O-N 3.14Å; P22-Y26 HydrophobicContact CB-CD2 4.21Å; P22-Y26 HydrophobicContact CB-CE2 4.16Å; P22-Y26 WeakPolarHBondContact O-CD2 3.27Å; P22-Y26 PolarHBondContact O-N 3.16Å
23L72.9Confident74.8Confident36 Ų3681.3 Ų81.319%0.18842%0.416CS..Hα-helixtrans-63.5-37.9-177.5-140.566.4000112.9S20 Q21 E27 F44 R119S20-L23 WeakPolarHBondContact O-CB 3Å; S20-L23 PolarHBondContact O-N 3.47Å; Q21-L23 PolarHBondContact O-N 3.39Å; L23-E27 PolarHBondContact O-N 3.18Å; L23-F44 HydrophobicContact CD1-CD1 3.99Å; L23-F44 HydrophobicContact CD1-CE1 3.24Å; L23-F44 HydrophobicContact CD1-CZ 3.65Å; L23-F44 HydrophobicContact CD2-CD1 3.97Å; L23-F44 HydrophobicContact CD2-CE1 3.98Å; L23-F44 HydrophobicContact CD2-CG 4.38Å; L23-F44 HydrophobicContact CD2-CZ 4.38Å; L23-F44 HydrophobicContact CG-CE1 4.28Å; L23-R119 WeakPolarHBondContact CD2-O 3.2Å
24R72Confident74.3Confident80 Ų8085.4 Ų85.430%0.30245%0.445SS..Hα-helixtrans-71.5-33.6175-69.5177.8172.1-174.3-7.7112.8S20 Q21 P22 E27 S216S20-R24 PolarHBondContact O-N 2.86Å; Q21-R24 PolarHBondContact O-N 3.5Å; P22-R24 VanDerWaalsContact C-N 3.32Å; P22-R24 PolarHBondContact O-N 2.89Å; R24-E27 VanDerWaalsContact O-CB 3.31Å; R24-E27 WeakPolarHBondContact O-CB 3.33Å; R24-S216 PolarHBondContact NH1-OG 2.85Å
25L71.6Confident74.1Confident127 Ų12783.6 Ų83.667%0.66543%0.431SS*.Hα-helixtrans-74.8-34.1176.7-72165.6000112.6Q21 P22 E27 P28Q21-L25 PolarHBondContact O-N 3.35Å; P22-L25 PolarHBondContact O-N 3.32Å; P22-L25 VanDerWaalsContact O-N 3.14Å; L25-E27 VanDerWaalsContact C-N 3.3Å; L25-P28 WeakPolarHBondContact O-CD 3.09Å
26Y67.3Low73.9Confident163 Ų16383.1 Ų83.164%0.63943%0.432SS*.SBendtrans-80.1-8.3176.3-74.7-68.4000113.7P22 F29P22-Y26 HydrophobicContact CB-CD2 4.21Å; P22-Y26 HydrophobicContact CB-CE2 4.16Å; P22-Y26 WeakPolarHBondContact O-CD2 3.27Å; P22-Y26 PolarHBondContact O-N 3.16Å; Y26-F29 PolarHBondContact O-N 3.25Å; Y26-F29 VanDerWaalsContact O-N 3.15Å
27E62.3Low73.9Confident70 Ų7083.1 Ų83.133%0.32743%0.432SS..G310 helixtrans-50-41.5-177.7-170.9169.5-163.300115.6L23 R24 L25 F29 R119L23-E27 PolarHBondContact O-N 3.18Å; R24-E27 VanDerWaalsContact O-CB 3.31Å; R24-E27 WeakPolarHBondContact O-CB 3.33Å; L25-E27 VanDerWaalsContact C-N 3.3Å; E27-F29 VanDerWaalsContact C-N 3.27Å; E27-F29 PolarHBondContact O-N 3.23Å; E27-R119 IonicContact OE1-CZ 3Å; E27-R119 IonicContact OE1-NE 3.91Å; E27-R119 IonicContact OE1-NH1 2.85Å; E27-R119 PolarHBondContact OE1-NH1 3.35Å
28P57.5Low74Confident101 Ų10183.7 Ų83.766%0.65644%0.435SS*.G310 helixtrans-76.7-5.2-177.325.3-26.8000114.9L25L25-P28 WeakPolarHBondContact O-CD 3.09Å
29F55.1Low74.1Confident175 Ų17585 Ų8577%0.76843%0.432SS*.G310 helixtrans-114.3-5.6-168.5-69.9-76.7000115.8Y26 E27Y26-F29 PolarHBondContact O-N 3.25Å; Y26-F29 VanDerWaalsContact O-N 3.15Å; E27-F29 VanDerWaalsContact C-N 3.27Å; E27-F29 PolarHBondContact O-N 3.23Å
30K57.6Low74.1Confident121 Ų12181.3 Ų81.353%0.52641%0.413SS..  trans-98125.7-173.7-154.7170.2-177.3177.20111.4
31P56Low74.4Confident89 Ų8981.2 Ų81.258%0.57841%0.413SS*.  trans-60.9153.8172.425-32.5000110.7N33P31-N33 PolarHBondContact O-N 3.43Å
32E63.7Low74.8Confident179 Ų17983.1 Ų83.184%0.83643%0.428SS*.  trans-62.572.2177.9-69.3-174.516500111.8
33N73.1Confident75.3Confident91 Ų9184 Ų8449%0.48743%0.433SS..  trans-87135.5168.7-71.3-12.9000108P31 T118P31-N33 PolarHBondContact O-N 3.43Å; N33-T118 HydrophobicContact CB-CG2 3.85Å; N33-T118 WeakPolarHBondContact O-CG2 3.26Å; N33-T118 PolarHBondContact O-N 2.91Å; N33-T118 PolarHBondContact O-OG1 3.04Å
34S78.8Confident76.1Confident92 Ų9284.5 Ų84.564%0.64343%0.433SS*.EExtended strand (participates in β ladder)trans-83139.4169.6580000110.5I116S34-I116 CarbonylContact C-O 3.38Å; S34-I116 WeakPolarHBondContact CA-O 3.42Å
35T85.1Confident76.9Confident21 Ų2188.3 Ų88.313%0.12945%0.447CS..EExtended strand (participates in β ladder)trans-129.7170.9169.4-174.50000109.4C40 I116 T118T35-C40 WeakPolarHBondContact CG2-SG 3.42Å; T35-I116 HydrophobicContact CG2-CD1 4.5Å; T35-I116 HydrophobicContact CG2-CG1 4.04Å; T35-I116 PolarHBondContact N-O 2.86Å; T35-I116 WeakPolarHBondContact O-CG1 3.38Å; T35-I116 PolarHBondContact O-N 3.46Å; T35-T118 HydrophobicContact CG2-CG2 3.85Å
36T87.4Confident77.8Confident59 Ų5982.8 Ų82.836%0.36242%0.418SS..  trans-96.7150.9175.358.50000111.4V38 K39 C40 S112T36-V38 VanDerWaalsContact C-N 3.29Å; T36-V38 PolarHBondContact O-N 3.25Å; T36-K39 PolarHBondContact O-N 2.89Å; T36-K39 WeakPolarHBondContact OG1-CB 3.39Å; T36-C40 PolarHBondContact O-N 3.36Å; T36-S112 WeakPolarHBondContact CB-O 3.39Å; T36-S112 WeakPolarHBondContact CG2-O 3.28Å
37P88.7Confident78.8Confident0 Ų075.3 Ų75.30%039%0.389CS..Hα-helixtrans-55-40.2176.5-31.238.5000113.9C40 A41 I108 R111 V114 I116 V125P37-C40 WeakPolarHBondContact O-CB 3.35Å; P37-C40 PolarHBondContact O-N 3.31Å; P37-A41 WeakPolarHBondContact O-CB 3.46Å; P37-A41 PolarHBondContact O-N 2.74Å; P37-I108 HydrophobicContact CB-CG2 4.29Å; P37-R111 HydrophobicContact CG-CB 4.17Å; P37-R111 WeakPolarHBondContact CG-O 3.39Å; P37-V114 VanDerWaalsContact CD-O 3.26Å; P37-V114 WeakPolarHBondContact CD-O 3.33Å; P37-I116 HydrophobicContact CB-CD1 4.32Å; P37-I116 HydrophobicContact CG-CD1 3.96Å; P37-I116 HydrophobicContact CG-CG1 4.23Å; P37-I116 HydrophobicContact CG-CG2 4.06Å; P37-V125 HydrophobicContact CB-CG1 4.16Å
38V89Confident80.2Confident44 Ų4473.9 Ų73.927%0.26738%0.383SS..Hα-helixtrans-63.6-44.5178.6177.50000110.8T36 C40 A41 V42 I108 F109T36-V38 VanDerWaalsContact C-N 3.29Å; T36-V38 PolarHBondContact O-N 3.25Å; V38-C40 VanDerWaalsContact C-N 3.33Å; V38-C40 PolarHBondContact O-N 3.45Å; V38-A41 PolarHBondContact O-N 3.22Å; V38-V42 WeakPolarHBondContact O-CG2 3.37Å; V38-V42 PolarHBondContact O-N 3.48Å; V38-I108 HydrophobicContact CG2-CG2 4.17Å; V38-F109 HydrophobicContact CG2-CD1 4.29Å
39K88.5Confident81.9Confident131 Ų13171.7 Ų71.757%0.5736%0.363SS*.Hα-helixtrans-64-40.4176.6-173.5174.1-179.7179.20111.2T36 V43T36-K39 PolarHBondContact O-N 2.89Å; T36-K39 WeakPolarHBondContact OG1-CB 3.39Å; K39-V43 HydrophobicContact CG-CG2 4.38Å; K39-V43 WeakPolarHBondContact O-CB 3.37Å; K39-V43 VanDerWaalsContact O-CG2 3.22Å; K39-V43 WeakPolarHBondContact O-CG2 3.36Å; K39-V43 PolarHBondContact O-N 2.85Å; K39-V43 VanDerWaalsContact O-N 3.09Å
40C89.1Confident83.7Confident0 Ų064.8 Ų64.80%033%0.332CS..Hα-helixtrans-59.4-48.2173.3-79.20000111.9T35 T36 P37 V38 V42 V43 F44 I116 C120 V125T35-C40 WeakPolarHBondContact CG2-SG 3.42Å; T36-C40 PolarHBondContact O-N 3.36Å; P37-C40 WeakPolarHBondContact O-CB 3.35Å; P37-C40 PolarHBondContact O-N 3.31Å; V38-C40 VanDerWaalsContact C-N 3.33Å; V38-C40 PolarHBondContact O-N 3.45Å; C40-V42 PolarHBondContact O-N 2.89Å; C40-V43 PolarHBondContact O-N 2.93Å; C40-F44 WeakPolarHBondContact O-CA 3.48Å; C40-F44 VanDerWaalsContact O-CB 3.29Å; C40-F44 WeakPolarHBondContact O-CB 3.37Å; C40-F44 WeakPolarHBondContact O-CD2 3.38Å; C40-F44 PolarHBondContact O-N 3.13Å; C40-I116 HydrophobicContact CB-CD1 4.33Å; C40-I116 VanDerWaalsContact SG-CD1 3.53Å; C40-C120 HydrophobicContact CB-CB 3.57Å; C40-C120 WeakPolarHBondContact CB-SG 3.28Å; C40-C120 WeakPolarHBondContact SG-CB 3.36Å; C40-C120 CovalentContact SG-SG 2.03Å; C40-C120 PolarHBondContact SG-SG 2.94Å; C40-V125 HydrophobicContact CB-CG2 3.99Å
41A89.4Confident85.3Confident6 Ų659.1 Ų59.15%0.0531%0.308CS..Hα-helixtrans-62.3-42.6-17800000112.6P37 V38 H48 I108P37-A41 WeakPolarHBondContact O-CB 3.46Å; P37-A41 PolarHBondContact O-N 2.74Å; V38-A41 PolarHBondContact O-N 3.22Å; A41-H48 PolarHBondContact O-NE2 3.42Å; A41-I108 HydrophobicContact CB-CD1 3.92Å; A41-I108 HydrophobicContact CB-CG2 3.91Å
42V88.9Confident87.2Confident98 Ų9856.5 Ų56.559%0.59429%0.29SS*.Hα-helixtrans-68.9-37.9179.6173.50000112.2V38 C40 W45V38-V42 WeakPolarHBondContact O-CG2 3.37Å; V38-V42 PolarHBondContact O-N 3.48Å; C40-V42 PolarHBondContact O-N 2.89Å; V42-W45 PolarHBondContact O-NE1 3.45Å
43V87.4Confident88.6Confident82 Ų8248 Ų4850%0.49725%0.25SS..Hα-helixtrans-81-41.9-178.3174.80000111.4K39 C40K39-V43 HydrophobicContact CG-CG2 4.38Å; K39-V43 WeakPolarHBondContact O-CB 3.37Å; K39-V43 VanDerWaalsContact O-CG2 3.22Å; K39-V43 WeakPolarHBondContact O-CG2 3.36Å; K39-V43 PolarHBondContact O-N 2.85Å; K39-V43 VanDerWaalsContact O-N 3.09Å; C40-V43 PolarHBondContact O-N 2.93Å
44F88.8Confident89.6Confident46 Ų4644.4 Ų44.420%0.20223%0.231CC..  trans-10786.4-170.8-63.5-68.9000112.2L23 C40 H46 L47 C120L23-F44 HydrophobicContact CD1-CD1 3.99Å; L23-F44 HydrophobicContact CD1-CE1 3.24Å; L23-F44 HydrophobicContact CD1-CZ 3.65Å; L23-F44 HydrophobicContact CD2-CD1 3.97Å; L23-F44 HydrophobicContact CD2-CE1 3.98Å; L23-F44 HydrophobicContact CD2-CG 4.38Å; L23-F44 HydrophobicContact CD2-CZ 4.38Å; L23-F44 HydrophobicContact CG-CE1 4.28Å; C40-F44 WeakPolarHBondContact O-CA 3.48Å; C40-F44 VanDerWaalsContact O-CB 3.29Å; C40-F44 WeakPolarHBondContact O-CB 3.37Å; C40-F44 WeakPolarHBondContact O-CD2 3.38Å; C40-F44 PolarHBondContact O-N 3.13Å; F44-H46 PolarHBondContact O-N 3.28Å; F44-H46 VanDerWaalsContact O-N 3.08Å; F44-L47 HydrophobicContact CB-CD1 4.34Å; F44-L47 PolarHBondContact O-N 2.85Å; F44-C120 HydrophobicContact CD2-CB 3.62Å; F44-C120 WeakPolarHBondContact CD2-SG 3.07Å; F44-C120 HydrophobicContact CE2-CB 4.02Å; F44-C120 WeakPolarHBondContact CE2-SG 3.43Å; F44-C120 HydrophobicContact CG-CB 4.35Å
45W89.4Confident90.3Very high159 Ų15940.4 Ų40.460%0.60220%0.203SC*.THydrogen-bonded Turntrans-62.3-18-177.6-73.876.3000115.2L19 V42 L47 H48 F49L19-W45 HydrophobicContact CD1-CB 4.27Å; V42-W45 PolarHBondContact O-NE1 3.45Å; W45-L47 PolarHBondContact O-N 2.91Å; W45-L47 VanDerWaalsContact O-N 3.16Å; W45-H48 PolarHBondContact O-N 3.33Å; W45-H48 VanDerWaalsContact O-N 3.09Å; W45-F49 HydrophobicContact CB-CD2 4.42Å; W45-F49 HydrophobicContact CB-CE2 4.25Å; W45-F49 VanDerWaalsContact O-CD2 3.27Å; W45-F49 WeakPolarHBondContact O-CD2 3.27Å; W45-F49 PolarHBondContact O-N 2.96Å
46H90.2Very high90.8Very high11 Ų1140.2 Ų40.25%0.05120%0.2CC..Hα-helixtrans-57.5-30.7177.872.5-94.5000112.5L19 F44 H48 F49 Y50L19-H46 HydrophobicContact CB-CB 3.91Å; F44-H46 PolarHBondContact O-N 3.28Å; F44-H46 VanDerWaalsContact O-N 3.08Å; H46-H48 VanDerWaalsContact C-N 3.34Å; H46-H48 PolarHBondContact O-N 3.23Å; H46-F49 PolarHBondContact O-N 3.18Å; H46-Y50 HydrophobicContact CB-CD2 4.47Å; H46-Y50 HydrophobicContact CB-CE2 4.28Å; H46-Y50 AromaticContact CD2-CE2 3.95Å; H46-Y50 WeakPolarHBondContact O-CD2 3.44Å; H46-Y50 PolarHBondContact O-N 2.92Å
47L89.9Confident91.1Very high6 Ų637.4 Ų37.43%0.03118%0.183CC..Hα-helixtrans-58.4-45176.5-69.7160.9000111.6F44 W45 A51 Q122 V125F44-L47 HydrophobicContact CB-CD1 4.34Å; F44-L47 PolarHBondContact O-N 2.85Å; W45-L47 PolarHBondContact O-N 2.91Å; W45-L47 VanDerWaalsContact O-N 3.16Å; L47-A51 WeakPolarHBondContact O-CB 3.44Å; L47-A51 PolarHBondContact O-N 2.77Å; L47-Q122 HydrophobicContact CD2-CB 3.97Å; L47-V125 HydrophobicContact CD1-CG1 4.43Å; L47-V125 HydrophobicContact CD1-CG2 4.24Å; L47-V125 HydrophobicContact CD2-CG2 4.47Å
48H91.7Very high91.3Very high40 Ų4037.6 Ų37.619%0.18519%0.185CC..Hα-helixtrans-71-39.2179-62-52.3000111.9A41 W45 H46 Y50 A51 V52A41-H48 PolarHBondContact O-NE2 3.42Å; W45-H48 PolarHBondContact O-N 3.33Å; W45-H48 VanDerWaalsContact O-N 3.09Å; H46-H48 VanDerWaalsContact C-N 3.34Å; H46-H48 PolarHBondContact O-N 3.23Å; H48-Y50 PolarHBondContact O-N 3.42Å; H48-A51 PolarHBondContact O-N 3.21Å; H48-V52 PolarHBondContact O-N 3.05Å; H48-V52 VanDerWaalsContact O-N 3.08Å
49F93.2Very high91.6Very high56 Ų5636.9 Ų36.925%0.24618%0.18CC..Hα-helixtrans-63-39.6176.6-78.9-67.1000112.7C12 I15 L19 W45 H46 G53C12-F49 HydrophobicContact CB-CD1 4.21Å; I15-F49 HydrophobicContact CB-CD1 4.39Å; I15-F49 HydrophobicContact CB-CE1 4.42Å; I15-F49 HydrophobicContact CD1-CE1 4.29Å; I15-F49 HydrophobicContact CG2-CD1 4.22Å; I15-F49 HydrophobicContact CG2-CD2 3.86Å; I15-F49 HydrophobicContact CG2-CE1 4.01Å; I15-F49 HydrophobicContact CG2-CE2 3.63Å; I15-F49 HydrophobicContact CG2-CG 4.15Å; I15-F49 HydrophobicContact CG2-CZ 3.71Å; L19-F49 HydrophobicContact CD1-CD2 3.82Å; L19-F49 HydrophobicContact CD1-CE2 3.8Å; W45-F49 HydrophobicContact CB-CD2 4.42Å; W45-F49 HydrophobicContact CB-CE2 4.25Å; W45-F49 VanDerWaalsContact O-CD2 3.27Å; W45-F49 WeakPolarHBondContact O-CD2 3.27Å; W45-F49 PolarHBondContact O-N 2.96Å; H46-F49 PolarHBondContact O-N 3.18Å; F49-G53 WeakPolarHBondContact O-CA 3.27Å; F49-G53 PolarHBondContact O-N 3.35Å
50Y91.5Very high91.9Very high29 Ų2930.7 Ų30.711%0.11415%0.152CC..Hα-helixtrans-70.3-40.8173.6-71.5-55.7000112.4I13 G16 V17 S20 H46 H48 V52 G53 E54I13-Y50 HydrophobicContact CG2-CE1 4.46Å; G16-Y50 PolarHBondContact O-OH 3.31Å; V17-Y50 VanDerWaalsContact CA-OH 3.22Å; V17-Y50 WeakPolarHBondContact CA-OH 3.11Å; V17-Y50 HydrophobicContact CG2-CE1 4.26Å; V17-Y50 WeakPolarHBondContact CG2-OH 3.27Å; V17-Y50 PolarHBondContact N-OH 2.84Å; S20-Y50 PolarHBondContact OG-OH 3.43Å; H46-Y50 HydrophobicContact CB-CD2 4.47Å; H46-Y50 HydrophobicContact CB-CE2 4.28Å; H46-Y50 AromaticContact CD2-CE2 3.95Å; H46-Y50 WeakPolarHBondContact O-CD2 3.44Å; H46-Y50 PolarHBondContact O-N 2.92Å; H48-Y50 PolarHBondContact O-N 3.42Å; Y50-V52 PolarHBondContact O-N 3.15Å; Y50-G53 PolarHBondContact O-N 2.89Å; Y50-E54 HydrophobicContact CD1-CG 4.31Å; Y50-E54 WeakPolarHBondContact O-CB 3.32Å; Y50-E54 PolarHBondContact O-N 3.47Å
51A92.5Very high92.1Very high2 Ų230.8 Ų30.82%0.01715%0.153CC..Hα-helixtrans-59.8-28.5177.100000113.1L47 H48 P55 N100 N104L47-A51 WeakPolarHBondContact O-CB 3.44Å; L47-A51 PolarHBondContact O-N 2.77Å; H48-A51 PolarHBondContact O-N 3.21Å; A51-P55 WeakPolarHBondContact O-CD 2.99Å; A51-P55 WeakPolarHBondContact O-CG 3.42Å; A51-N100 PolarHBondContact O-ND2 2.87Å; A51-N104 HydrophobicContact CB-CB 4.48Å
52V94.6Very high92.3Very high35 Ų3532.8 Ų32.821%0.21216%0.161CC..Hα-helixtrans-90.1-48.9173.7172.40000111.5H48 Y50 P55 L56 V97 L101H48-V52 PolarHBondContact O-N 3.05Å; H48-V52 VanDerWaalsContact O-N 3.08Å; Y50-V52 PolarHBondContact O-N 3.15Å; V52-P55 WeakPolarHBondContact O-CD 3.42Å; V52-P55 WeakPolarHBondContact O-CG 3.37Å; V52-L56 WeakPolarHBondContact O-CB 3.4Å; V52-L56 PolarHBondContact O-N 3.12Å; V52-V97 HydrophobicContact CB-CG1 4.31Å; V52-V97 HydrophobicContact CG1-CG1 3.86Å; V52-V97 HydrophobicContact CG2-CG1 4.14Å; V52-L101 HydrophobicContact CG2-CD1 4.47Å; V52-L101 HydrophobicContact CG2-CD2 4.5Å
53G93.9Very high92.5Very high0 Ų029 Ų290%014%0.137CC..Hα-helixtrans-69.4-44.3-169.600000114F49 Y50 L56 L57F49-G53 WeakPolarHBondContact O-CA 3.27Å; F49-G53 PolarHBondContact O-N 3.35Å; Y50-G53 PolarHBondContact O-N 2.89Å; G53-L56 PolarHBondContact O-N 3.3Å; G53-L57 WeakPolarHBondContact O-CB 3.37Å; G53-L57 PolarHBondContact O-N 3.47Å
54E92.9Very high92.7Very high16 Ų1626.2 Ų26.28%0.07512%0.119CC..Hα-helixtrans-60.9-53.9-178.1-68.6-171.3152.800113Y50 L56 L57 A58 F135 L138 Q192 K199Y50-E54 HydrophobicContact CD1-CG 4.31Å; Y50-E54 WeakPolarHBondContact O-CB 3.32Å; Y50-E54 PolarHBondContact O-N 3.47Å; E54-L56 VanDerWaalsContact C-N 3.33Å; E54-L56 PolarHBondContact O-N 2.98Å; E54-L57 PolarHBondContact O-N 3.14Å; E54-A58 PolarHBondContact O-N 2.95Å; E54-F135 WeakPolarHBondContact OE2-CE1 3.25Å; E54-L138 HydrophobicContact CB-CD1 3.94Å; E54-Q192 PolarHBondContact O-NE2 3.2Å; E54-K199 IonicContact OE1-NZ 3.48Å; E54-K199 PolarHBondContact OE1-NZ 3.37Å
55P94.3Very high92.8Very high8 Ų824 Ų245%0.05211%0.109CC..Hα-helixtrans-65.2-37.4177.625.1-33.8000112.4A51 V52 L57 A58 L59 V97 N100 L138A51-P55 WeakPolarHBondContact O-CD 2.99Å; A51-P55 WeakPolarHBondContact O-CG 3.42Å; V52-P55 WeakPolarHBondContact O-CD 3.42Å; V52-P55 WeakPolarHBondContact O-CG 3.37Å; P55-L57 VanDerWaalsContact C-N 3.33Å; P55-L57 PolarHBondContact O-N 3.15Å; P55-A58 PolarHBondContact O-N 3.4Å; P55-L59 VanDerWaalsContact O-CB 3.31Å; P55-L59 WeakPolarHBondContact O-CB 3.39Å; P55-L59 VanDerWaalsContact O-CG 3.28Å; P55-L59 WeakPolarHBondContact O-CG 3.45Å; P55-L59 PolarHBondContact O-N 3.33Å; P55-V97 HydrophobicContact CG-CG2 4.44Å; P55-N100 HydrophobicContact CG-CB 4.49Å; P55-L138 HydrophobicContact CB-CD2 4.17Å
56L95Very high92.9Very high16 Ų1619.9 Ų19.98%0.08410%0.096CC..Hα-helixtrans-64.3-39.4178.2-171.362.5000111.6G5 V8 A9 V52 G53 E54 S60 Q93 V97G5-L56 WeakPolarHBondContact O-CD2 3.45Å; V8-L56 HydrophobicContact CB-CD2 4.05Å; V8-L56 HydrophobicContact CG1-CD2 3.78Å; A9-L56 HydrophobicContact CB-CB 3.89Å; A9-L56 HydrophobicContact CB-CD2 4.01Å; A9-L56 HydrophobicContact CB-CG 3.86Å; V52-L56 WeakPolarHBondContact O-CB 3.4Å; V52-L56 PolarHBondContact O-N 3.12Å; G53-L56 PolarHBondContact O-N 3.3Å; E54-L56 VanDerWaalsContact C-N 3.33Å; E54-L56 PolarHBondContact O-N 2.98Å; L56-S60 WeakPolarHBondContact O-CB 3.48Å; L56-S60 PolarHBondContact O-N 3.41Å; L56-S60 PolarHBondContact O-OG 3.41Å; L56-Q93 HydrophobicContact CD1-CB 3.88Å; L56-Q93 HydrophobicContact CD1-CG 4.16Å; L56-V97 HydrophobicContact CB-CG2 3.92Å; L56-V97 HydrophobicContact CD1-CG2 4.12Å
57L94Very high92.8Very high0 Ų019.9 Ų19.90%010%0.098CC..Hα-helixtrans-66.3-48177-174.965.6000111.3Y6 A9 M10 I13 G53 E54 P55 S60 T61 Q192 Y223Y6-L57 HydrophobicContact CD2-CD1 3.53Å; Y6-L57 HydrophobicContact CE2-CD1 3.37Å; Y6-L57 HydrophobicContact CG-CD1 4.39Å; A9-L57 HydrophobicContact CB-CB 3.74Å; A9-L57 HydrophobicContact CB-CD1 4.18Å; M10-L57 HydrophobicContact CG-CD1 4.19Å; M10-L57 HydrophobicContact SD-CD1 3.95Å; M10-L57 HydrophobicContact SD-CD2 4.47Å; I13-L57 HydrophobicContact CD1-CB 3.73Å; I13-L57 HydrophobicContact CD1-CD2 3.41Å; I13-L57 VanDerWaalsContact CD1-CD2 3.41Å; I13-L57 HydrophobicContact CD1-CG 4.12Å; G53-L57 WeakPolarHBondContact O-CB 3.37Å; G53-L57 PolarHBondContact O-N 3.47Å; E54-L57 PolarHBondContact O-N 3.14Å; P55-L57 VanDerWaalsContact C-N 3.33Å; P55-L57 PolarHBondContact O-N 3.15Å; L57-S60 PolarHBondContact O-N 3Å; L57-T61 WeakPolarHBondContact O-CB 3.31Å; L57-T61 PolarHBondContact O-N 2.97Å; L57-T61 PolarHBondContact O-OG1 3.2Å; L57-Q192 HydrophobicContact CD2-CB 4.45Å; L57-Y223 HydrophobicContact CD2-CE1 4.12Å; L57-Y223 VanDerWaalsContact CD2-OH 3.3Å; L57-Y223 WeakPolarHBondContact CD2-OH 3.11Å
58A94.4Very high92.7Very high4 Ų420.2 Ų20.23%0.03310%0.1CC..Hα-helixtrans-61.8-49.2-178.900000110.8E54 P55 T61 F62 L138 C141E54-A58 PolarHBondContact O-N 2.95Å; P55-A58 PolarHBondContact O-N 3.4Å; A58-T61 PolarHBondContact O-N 3.49Å; A58-F62 WeakPolarHBondContact O-CB 3.49Å; A58-F62 PolarHBondContact O-N 2.86Å; A58-L138 HydrophobicContact CB-CD2 3.83Å; A58-C141 HydrophobicContact CB-CB 4.39Å
59L94.7Very high92.5Very high30 Ų3021.2 Ų21.216%0.15710%0.104CC..Hα-helixtrans-65.5-40.5177.7-70.2175000112.4P55 F62 M63 Q93 V96P55-L59 VanDerWaalsContact O-CB 3.31Å; P55-L59 WeakPolarHBondContact O-CB 3.39Å; P55-L59 VanDerWaalsContact O-CG 3.28Å; P55-L59 WeakPolarHBondContact O-CG 3.45Å; P55-L59 PolarHBondContact O-N 3.33Å; L59-F62 PolarHBondContact O-N 3.4Å; L59-M63 WeakPolarHBondContact O-CB 3.48Å; L59-M63 WeakPolarHBondContact O-CG 3.18Å; L59-M63 PolarHBondContact O-N 3.3Å; L59-Q93 HydrophobicContact CB-CG 4.24Å; L59-V96 HydrophobicContact CD1-CB 3.56Å; L59-V96 HydrophobicContact CD1-CG1 3.65Å; L59-V96 HydrophobicContact CD1-CG2 3.91Å
60S94.3Very high92.2Very high0 Ų020.3 Ų20.30%010%0.102CC..Hα-helixtrans-63.3-44.8178.7-62.80000111.4G5 Y6 L56 L57 M63 I64 Q93G5-S60 VanDerWaalsContact C-OG 3.26Å; Y6-S60 PolarHBondContact N-OG 3.5Å; L56-S60 WeakPolarHBondContact O-CB 3.48Å; L56-S60 PolarHBondContact O-N 3.41Å; L56-S60 PolarHBondContact O-OG 3.41Å; L57-S60 PolarHBondContact O-N 3Å; S60-M63 PolarHBondContact O-N 2.91Å; S60-I64 WeakPolarHBondContact O-CD1 3.4Å; S60-I64 WeakPolarHBondContact O-CG1 3.27Å; S60-I64 PolarHBondContact O-N 3.35Å; S60-Q93 VanDerWaalsContact CA-NE2 3.33Å; S60-Q93 PolarHBondContact OG-NE2 3.32Å
61T92.9Very high91.7Very high2 Ų222.7 Ų22.71%0.01212%0.116CC..Hα-helixtrans-64.4-43.4177.4-47.90000111.1L57 A58 M63 I64 A65 T145 L184 V185 V188L57-T61 WeakPolarHBondContact O-CB 3.31Å; L57-T61 PolarHBondContact O-N 2.97Å; L57-T61 PolarHBondContact O-OG1 3.2Å; A58-T61 PolarHBondContact O-N 3.49Å; T61-M63 PolarHBondContact O-N 2.91Å; T61-I64 PolarHBondContact O-N 3.5Å; T61-A65 PolarHBondContact O-N 3.06Å; T61-T145 HydrophobicContact CG2-CG2 3.71Å; T61-L184 HydrophobicContact CG2-CD2 3.68Å; T61-V185 HydrophobicContact CG2-CG2 3.88Å; T61-V188 HydrophobicContact CG2-CB 4.29Å; T61-V188 HydrophobicContact CG2-CG1 4.09Å; T61-V188 HydrophobicContact CG2-CG2 4.32Å
62F94.6Very high91Very high48 Ų4823.4 Ų23.421%0.21112%0.119CC..Hα-helixtrans-59.6-46.9175.2178.6-106.7000112.5A58 L59 I64 A65 F66 L144 T145A58-F62 WeakPolarHBondContact O-CB 3.49Å; A58-F62 PolarHBondContact O-N 2.86Å; L59-F62 PolarHBondContact O-N 3.4Å; F62-I64 VanDerWaalsContact C-N 3.3Å; F62-I64 PolarHBondContact O-N 3.01Å; F62-A65 WeakPolarHBondContact O-CB 3.23Å; F62-A65 PolarHBondContact O-N 3.48Å; F62-F66 WeakPolarHBondContact O-CB 3.33Å; F62-F66 PolarHBondContact O-N 2.99Å; F62-L144 HydrophobicContact CD2-CB 4.25Å; F62-L144 HydrophobicContact CE2-CB 3.94Å; F62-T145 VanDerWaalsContact CA-OG1 3.3Å; F62-T145 WeakPolarHBondContact CA-OG1 3.28Å; F62-T145 WeakPolarHBondContact CB-OG1 3.5Å
63M92.9Very high90.2Very high19 Ų1924 Ų249%0.09412%0.119CC..Hα-helixtrans-69.3-27178.8-64.3-56.8-73.800112.5L59 S60 T61 G67 Y85 C89L59-M63 WeakPolarHBondContact O-CB 3.48Å; L59-M63 WeakPolarHBondContact O-CG 3.18Å; L59-M63 PolarHBondContact O-N 3.3Å; S60-M63 PolarHBondContact O-N 2.91Å; T61-M63 PolarHBondContact O-N 2.91Å; M63-G67 PolarHBondContact O-N 3.27Å; M63-Y85 HydrophobicContact CE-CE2 3.75Å; M63-Y85 PolarHBondContact O-OH 2.92Å; M63-C89 HydrophobicContact CE-CB 4.3Å; M63-C89 WeakPolarHBondContact CE-SG 3.45Å
64I91.2Very high89.2Confident24 Ų2424.7 Ų24.712%0.12313%0.127CC..Hα-helixtrans-66.7-48.3170.2-69.3163000109.4C2 S60 T61 F62 F66 G67 N68 T181C2-I64 HydrophobicContact CB-CD1 4.49Å; C2-I64 HydrophobicContact CB-CG1 3.78Å; S60-I64 WeakPolarHBondContact O-CD1 3.4Å; S60-I64 WeakPolarHBondContact O-CG1 3.27Å; S60-I64 PolarHBondContact O-N 3.35Å; T61-I64 PolarHBondContact O-N 3.5Å; F62-I64 VanDerWaalsContact C-N 3.3Å; F62-I64 PolarHBondContact O-N 3.01Å; I64-F66 PolarHBondContact O-N 3.41Å; I64-G67 PolarHBondContact O-N 3.48Å; I64-N68 PolarHBondContact O-N 3.49Å; I64-T181 HydrophobicContact CG2-CG2 3.61Å
65A91.9Very high87.7Confident0 Ų031.5 Ų31.50%016%0.156CC..Hα-helixtrans-61.2-44.817800000113.1T61 F62 G67 N68 F69 T145 T148 E149T61-A65 PolarHBondContact O-N 3.06Å; F62-A65 WeakPolarHBondContact O-CB 3.23Å; F62-A65 PolarHBondContact O-N 3.48Å; A65-G67 VanDerWaalsContact C-N 3.31Å; A65-G67 PolarHBondContact O-N 2.77Å; A65-N68 WeakPolarHBondContact O-CB 3.39Å; A65-N68 PolarHBondContact O-N 2.82Å; A65-F69 PolarHBondContact O-N 3.48Å; A65-T145 HydrophobicContact CB-CG2 3.87Å; A65-T148 HydrophobicContact CB-CG2 4.47Å; A65-E149 VanDerWaalsContact CA-OE1 3.26Å; A65-E149 WeakPolarHBondContact CA-OE1 3.46Å; A65-E149 HydrophobicContact CB-CG 3.68Å
66F91.1Very high85.8Confident72 Ų7237.9 Ų37.932%0.31620%0.195SC..Hα-helixtrans-66.3-35.2176.6-171.3-110.7000112.1F62 I64 F69 L70 Y85F62-F66 WeakPolarHBondContact O-CB 3.33Å; F62-F66 PolarHBondContact O-N 2.99Å; I64-F66 PolarHBondContact O-N 3.41Å; F66-F69 HydrophobicContact CE2-CD1 4.35Å; F66-F69 WeakPolarHBondContact O-CB 3.44Å; F66-F69 PolarHBondContact O-N 3.29Å; F66-L70 HydrophobicContact CD1-CD1 3.9Å; F66-L70 HydrophobicContact CD1-CG 4.22Å; F66-L70 HydrophobicContact CE1-CD1 3.57Å; F66-L70 HydrophobicContact CE1-CD2 4.21Å; F66-L70 HydrophobicContact CE1-CG 3.91Å; F66-L70 HydrophobicContact CZ-CD1 4.24Å; F66-L70 HydrophobicContact CZ-CD2 4.03Å; F66-L70 HydrophobicContact CZ-CG 4.15Å; F66-L70 WeakPolarHBondContact O-CG 3.28Å; F66-L70 PolarHBondContact O-N 2.91Å; F66-Y85 HydrophobicContact CD1-CE2 4.04Å; F66-Y85 HydrophobicContact CE1-CE2 4.44Å
67G88.2Confident83.7Confident10 Ų1042.1 Ų42.110%0.10321%0.213CC..Hα-helixtrans-59.9-45.6172.400000112.1M63 I64 A65 F69 L70 I71 Y85M63-G67 PolarHBondContact O-N 3.27Å; I64-G67 PolarHBondContact O-N 3.48Å; A65-G67 VanDerWaalsContact C-N 3.31Å; A65-G67 PolarHBondContact O-N 2.77Å; G67-F69 VanDerWaalsContact C-N 3.33Å; G67-F69 PolarHBondContact O-N 3.06Å; G67-L70 PolarHBondContact O-N 3.45Å; G67-I71 VanDerWaalsContact O-CG1 3.31Å; G67-I71 WeakPolarHBondContact O-CG1 3.42Å; G67-I71 PolarHBondContact O-N 3.24Å; G67-Y85 PolarHBondContact N-OH 2.9Å
68N86.3Confident81.7Confident14 Ų1446.3 Ų46.38%0.07523%0.233CC..Hα-helixtrans-59.5-44.1175.1-71.5-12.8000111.9I64 A65 L70 I71 I72 E149 T181I64-N68 PolarHBondContact O-N 3.49Å; A65-N68 WeakPolarHBondContact O-CB 3.39Å; A65-N68 PolarHBondContact O-N 2.82Å; N68-L70 PolarHBondContact O-N 2.64Å; N68-I71 PolarHBondContact O-N 3.5Å; N68-I72 WeakPolarHBondContact O-CG1 3.46Å; N68-I72 PolarHBondContact O-N 2.99Å; N68-E149 PolarHBondContact ND2-OE1 2.87Å; N68-T181 VanDerWaalsContact ND2-CB 3.33Å; N68-T181 WeakPolarHBondContact ND2-CB 3.39Å; N68-T181 VanDerWaalsContact ND2-CG2 3.32Å; N68-T181 WeakPolarHBondContact ND2-CG2 3.43Å; N68-T181 PolarHBondContact ND2-OG1 3.37Å
69F88.2Confident79.5Confident60 Ų6054.4 Ų54.426%0.26327%0.267SS..Hα-helixtrans-57.8-48175.6179-95.5000111.7A65 F66 G67 I71 I72 H73 T148 V151 T152 L155A65-F69 PolarHBondContact O-N 3.48Å; F66-F69 HydrophobicContact CE2-CD1 4.35Å; F66-F69 WeakPolarHBondContact O-CB 3.44Å; F66-F69 PolarHBondContact O-N 3.29Å; G67-F69 VanDerWaalsContact C-N 3.33Å; G67-F69 PolarHBondContact O-N 3.06Å; F69-I71 PolarHBondContact O-N 3.4Å; F69-I72 PolarHBondContact O-N 3.48Å; F69-H73 AromaticContact CD2-CD2 3.58Å; F69-H73 AromaticContact CE2-CD2 3.57Å; F69-H73 HydrophobicContact CZ-CB 4.45Å; F69-H73 WeakPolarHBondContact O-CB 3.37Å; F69-H73 PolarHBondContact O-CD2 2.87Å; F69-H73 PolarHBondContact O-N 3.19Å; F69-T148 HydrophobicContact CB-CG2 3.85Å; F69-T148 HydrophobicContact CG-CG2 4.31Å; F69-V151 HydrophobicContact CE2-CG1 4.15Å; F69-T152 WeakPolarHBondContact CB-OG1 3.34Å; F69-T152 WeakPolarHBondContact CD2-OG1 3.39Å; F69-L155 HydrophobicContact CE2-CD1 4.22Å
70L86.1Confident77.3Confident38 Ų3861.6 Ų61.620%0.19930%0.3CS..Hα-helixtrans-63.6-41179.6-71.7179.8000112.8F66 G67 N68 I72 G74 Y85F66-L70 HydrophobicContact CD1-CD1 3.9Å; F66-L70 HydrophobicContact CD1-CG 4.22Å; F66-L70 HydrophobicContact CE1-CD1 3.57Å; F66-L70 HydrophobicContact CE1-CD2 4.21Å; F66-L70 HydrophobicContact CE1-CG 3.91Å; F66-L70 HydrophobicContact CZ-CD1 4.24Å; F66-L70 HydrophobicContact CZ-CD2 4.03Å; F66-L70 HydrophobicContact CZ-CG 4.15Å; F66-L70 WeakPolarHBondContact O-CG 3.28Å; F66-L70 PolarHBondContact O-N 2.91Å; G67-L70 PolarHBondContact O-N 3.45Å; N68-L70 PolarHBondContact O-N 2.64Å; L70-I72 VanDerWaalsContact C-N 3.3Å; L70-I72 PolarHBondContact O-N 3.39Å; L70-G74 WeakPolarHBondContact O-CA 3.41Å; L70-G74 PolarHBondContact O-N 3.3Å; L70-Y85 HydrophobicContact CD1-CD2 4.12Å; L70-Y85 HydrophobicContact CD1-CE2 3.91Å
71I80.9Confident75.5Confident79 Ų7964.9 Ų64.941%0.40532%0.317SS..Hα-helixtrans-62.2-40.2-179.9-71.5165.9000111.1G67 N68 F69 E174G67-I71 VanDerWaalsContact O-CG1 3.31Å; G67-I71 WeakPolarHBondContact O-CG1 3.42Å; G67-I71 PolarHBondContact O-N 3.24Å; N68-I71 PolarHBondContact O-N 3.5Å; F69-I71 PolarHBondContact O-N 3.4Å; I71-E174 HydrophobicContact CG2-CG 3.89Å
72I79.3Confident74.4Confident16 Ų1667.3 Ų67.38%0.08234%0.342CS..Hα-helixtrans-84.2-39.9-172.6-66.4171.6000111.8N68 F69 L70 T152 L156 M178N68-I72 WeakPolarHBondContact O-CG1 3.46Å; N68-I72 PolarHBondContact O-N 2.99Å; F69-I72 PolarHBondContact O-N 3.48Å; L70-I72 VanDerWaalsContact C-N 3.3Å; L70-I72 PolarHBondContact O-N 3.39Å; I72-T152 HydrophobicContact CB-CG2 4.48Å; I72-T152 HydrophobicContact CD1-CG2 3.62Å; I72-L156 HydrophobicContact CG2-CB 4.48Å; I72-L156 HydrophobicContact CG2-CD1 4.29Å; I72-M178 HydrophobicContact CD1-CE 2.93Å; I72-M178 HydrophobicContact CG1-CE 4.43Å
73H78.1Confident73.6Confident48 Ų4868.9 Ų68.922%0.22236%0.364CS..Hα-helixtrans-100.2-20.3-174.7-64.3-54.3000114.3F69 K75 L155F69-H73 AromaticContact CD2-CD2 3.58Å; F69-H73 AromaticContact CE2-CD2 3.57Å; F69-H73 HydrophobicContact CZ-CB 4.45Å; F69-H73 WeakPolarHBondContact O-CB 3.37Å; F69-H73 PolarHBondContact O-CD2 2.87Å; F69-H73 PolarHBondContact O-N 3.19Å; H73-K75 PolarHBondContact O-N 3.03Å; H73-L155 WeakPolarHBondContact CE1-CB 3.27Å; H73-L155 VanDerWaalsContact NE2-CB 3.32Å; H73-L155 WeakPolarHBondContact NE2-CB 3.49Å; H73-L155 WeakPolarHBondContact NE2-CD1 3.18Å
74G72.1Confident73.2Confident15 Ų1573.4 Ų73.416%0.15539%0.385CS..  trans-71.269.1176.500000112.2L70 T76 F77 Q78L70-G74 WeakPolarHBondContact O-CA 3.41Å; L70-G74 PolarHBondContact O-N 3.3Å; G74-T76 PolarHBondContact O-N 2.78Å; G74-F77 PolarHBondContact O-N 3.23Å; G74-Q78 WeakPolarHBondContact O-CG 3.44Å
75K61.2Low72.9Confident158 Ų15874.3 Ų74.369%0.68739%0.387SS*.THydrogen-bonded Turntrans-52.5-28.8175-69.7-175.7-179.6178.40112.4H73H73-K75 PolarHBondContact O-N 3.03Å
76T54.2Low72.5Confident142 Ų14276.6 Ų76.687%0.87140%0.401SS*.THydrogen-bonded Turntrans-106.8-4.4-178.3-34.40000112.9G74G74-T76 PolarHBondContact O-N 2.78Å
77F51Low72.4Confident105 Ų10581.6 Ų81.646%0.46142%0.417SS..  trans-95.4-0.3-168.1-126.9-94.7000113.5G74 F79 L81G74-F77 PolarHBondContact O-N 3.23Å; F77-F79 PolarHBondContact O-N 3.42Å; F77-L81 HydrophobicContact CD1-CB 4.17Å; F77-L81 HydrophobicContact CE1-CB 3.84Å; F77-L81 HydrophobicContact CE1-CD1 4.33Å; F77-L81 HydrophobicContact CE1-CD2 3.76Å; F77-L81 HydrophobicContact CE1-CG 4.17Å; F77-L81 HydrophobicContact CZ-CD2 4.06Å
78Q52.5Low72.4Confident89 Ų8982.8 Ų82.842%0.41642%0.424SS..THydrogen-bonded Turntrans-72.4-11.3-153.1-75-155.9-44.300117.8G74G74-Q78 WeakPolarHBondContact O-CG 3.44Å
79F47.5Very low72.6Confident174 Ų17482.2 Ų82.276%0.76342%0.421SS*.THydrogen-bonded Turntrans-135.4-23.6-170.4-86.8-84.7000118.7F77F77-F79 PolarHBondContact O-N 3.42Å
80H49.7Very low72.7Confident180 Ų18084.9 Ų84.983%0.83343%0.433SS*.THydrogen-bonded Turntrans-108.1-5.2-172.9-91.716.8000116.3
81L56.1Low73.1Confident69 Ų6987.8 Ų87.836%0.36145%0.448SS..SBendtrans-111.34.6-176.9-97.7100.6000116.1F77 A83 H84 Y85F77-L81 HydrophobicContact CD1-CB 4.17Å; F77-L81 HydrophobicContact CE1-CB 3.84Å; F77-L81 HydrophobicContact CE1-CD1 4.33Å; F77-L81 HydrophobicContact CE1-CD2 3.76Å; F77-L81 HydrophobicContact CE1-CG 4.17Å; F77-L81 HydrophobicContact CZ-CD2 4.06Å; L81-A83 VanDerWaalsContact C-N 3.33Å; L81-A83 PolarHBondContact O-N 3.26Å; L81-H84 HydrophobicContact CD2-CB 4.08Å; L81-H84 HydrophobicContact CG-CB 3.97Å; L81-H84 PolarHBondContact O-N 3.3Å; L81-Y85 WeakPolarHBondContact O-CB 3.34Å; L81-Y85 PolarHBondContact O-N 2.96Å
82G70.3Confident73.7Confident53 Ų5387.9 Ų87.955%0.54645%0.448SS..Hα-helixtrans-54.5-49176.100000112.4V86G82-V86 WeakPolarHBondContact O-CB 3.44Å; G82-V86 WeakPolarHBondContact O-CG2 3.41Å; G82-V86 PolarHBondContact O-N 3.49Å; G82-V86 VanDerWaalsContact O-N 3.08Å
83A77Confident74.4Confident81 Ų8187.5 Ų87.567%0.66945%0.446SS*.Hα-helixtrans-68.6-41.8177.900000112.9L81 V86 R87L81-A83 VanDerWaalsContact C-N 3.33Å; L81-A83 PolarHBondContact O-N 3.26Å; A83-V86 PolarHBondContact O-N 3.31Å; A83-R87 WeakPolarHBondContact O-CB 3.14Å; A83-R87 PolarHBondContact O-N 3Å
84H84Confident75.1Confident114 Ų11487.4 Ų87.453%0.52845%0.454SS..Hα-helixtrans-65.6-45.9178.9-171.7-76000111.4L81 V86 R87 S88L81-H84 HydrophobicContact CD2-CB 4.08Å; L81-H84 HydrophobicContact CG-CB 3.97Å; L81-H84 PolarHBondContact O-N 3.3Å; H84-V86 PolarHBondContact O-N 2.84Å; H84-R87 PolarHBondContact O-N 3.01Å; H84-S88 PolarHBondContact CE1-OG 3.16Å; H84-S88 VanDerWaalsContact CE1-OG 3.27Å; H84-S88 PolarHBondContact ND1-OG 3Å; H84-S88 WeakPolarHBondContact O-CB 3.37Å; H84-S88 PolarHBondContact O-N 3.07Å; H84-S88 PolarHBondContact O-OG 3.33Å; H84-S88 VanDerWaalsContact O-OG 3.04Å
85Y84.8Confident76.3Confident43 Ų4388.2 Ų88.217%0.16946%0.462CS..Hα-helixtrans-56.5-50175.5-179.5-105.5000111M63 F66 G67 L70 L81 R87 S88 C89M63-Y85 HydrophobicContact CE-CE2 3.75Å; M63-Y85 PolarHBondContact O-OH 2.92Å; F66-Y85 HydrophobicContact CD1-CE2 4.04Å; F66-Y85 HydrophobicContact CE1-CE2 4.44Å; G67-Y85 PolarHBondContact N-OH 2.9Å; L70-Y85 HydrophobicContact CD1-CD2 4.12Å; L70-Y85 HydrophobicContact CD1-CE2 3.91Å; L81-Y85 WeakPolarHBondContact O-CB 3.34Å; L81-Y85 PolarHBondContact O-N 2.96Å; Y85-R87 VanDerWaalsContact C-N 3.35Å; Y85-R87 PolarHBondContact O-N 3.31Å; Y85-S88 PolarHBondContact O-N 3.41Å; Y85-C89 WeakPolarHBondContact CE1-SG 3.43Å; Y85-C89 VanDerWaalsContact CZ-SG 3.54Å; Y85-C89 WeakPolarHBondContact O-CB 3.32Å; Y85-C89 PolarHBondContact O-N 3.4Å; Y85-C89 PolarHBondContact O-SG 2.94Å
86V85.1Confident77.9Confident48 Ų4883.7 Ų83.729%0.29145%0.448SS..Hα-helixtrans-58.9-45.2178163.20000111.8M1 G82 A83 H84 C89 F90M1-V86 HydrophobicContact CB-CB 4.49Å; M1-V86 HydrophobicContact CB-CG1 3.47Å; M1-V86 VanDerWaalsContact CB-CG1 3.47Å; M1-V86 HydrophobicContact CB-CG2 4.4Å; M1-V86 HydrophobicContact CE-CG1 4.17Å; M1-V86 HydrophobicContact CG-CG1 3.9Å; M1-V86 HydrophobicContact SD-CG1 3.34Å; M1-V86 WeakPolarHBondContact SD-CG1 3.15Å; G82-V86 WeakPolarHBondContact O-CB 3.44Å; G82-V86 WeakPolarHBondContact O-CG2 3.41Å; G82-V86 PolarHBondContact O-N 3.49Å; G82-V86 VanDerWaalsContact O-N 3.08Å; A83-V86 PolarHBondContact O-N 3.31Å; H84-V86 PolarHBondContact O-N 2.84Å; V86-C89 WeakPolarHBondContact O-CB 3.45Å; V86-C89 PolarHBondContact O-N 3.47Å; V86-F90 PolarHBondContact O-N 3.44Å
87R88.8Confident79.8Confident177 Ų17778 Ų7867%0.66841%0.412SS*.Hα-helixtrans-64.3-45.2176.9-176.4177.4178.1173.5-0.3111.7A83 H84 Y85 C89 F90 I91A83-R87 WeakPolarHBondContact O-CB 3.14Å; A83-R87 PolarHBondContact O-N 3Å; H84-R87 PolarHBondContact O-N 3.01Å; Y85-R87 VanDerWaalsContact C-N 3.35Å; Y85-R87 PolarHBondContact O-N 3.31Å; R87-C89 PolarHBondContact O-N 2.87Å; R87-F90 PolarHBondContact O-N 3.43Å; R87-I91 HydrophobicContact CG-CD1 3.9Å; R87-I91 WeakPolarHBondContact O-CG1 3.44Å; R87-I91 PolarHBondContact O-N 3.44Å
88S88.3Confident81.9Confident35 Ų3578.1 Ų78.125%0.24542%0.417CS..Hα-helixtrans-61.4-42.3176.6-64.70000111.7H84 Y85 F90 I91 I92H84-S88 PolarHBondContact CE1-OG 3.16Å; H84-S88 VanDerWaalsContact CE1-OG 3.27Å; H84-S88 PolarHBondContact ND1-OG 3Å; H84-S88 WeakPolarHBondContact O-CB 3.37Å; H84-S88 PolarHBondContact O-N 3.07Å; H84-S88 PolarHBondContact O-OG 3.33Å; H84-S88 VanDerWaalsContact O-OG 3.04Å; Y85-S88 PolarHBondContact O-N 3.41Å; S88-F90 VanDerWaalsContact C-N 3.31Å; S88-F90 PolarHBondContact O-N 3.41Å; S88-I91 PolarHBondContact O-N 3.33Å; S88-I92 WeakPolarHBondContact O-CB 3.31Å; S88-I92 WeakPolarHBondContact O-CD1 3.14Å; S88-I92 WeakPolarHBondContact O-CG1 3.26Å; S88-I92 PolarHBondContact O-N 3.3Å
89C90.3Very high84Confident2 Ų277.8 Ų77.81%0.01442%0.421CS..Hα-helixtrans-55.5-48175.5-68.80000111.2C2 M63 Y85 V86 R87 I92 Q93C2-C89 PolarHBondContact SG-SG 3.49Å; M63-C89 HydrophobicContact CE-CB 4.3Å; M63-C89 WeakPolarHBondContact CE-SG 3.45Å; Y85-C89 WeakPolarHBondContact CE1-SG 3.43Å; Y85-C89 VanDerWaalsContact CZ-SG 3.54Å; Y85-C89 WeakPolarHBondContact O-CB 3.32Å; Y85-C89 PolarHBondContact O-N 3.4Å; Y85-C89 PolarHBondContact O-SG 2.94Å; V86-C89 WeakPolarHBondContact O-CB 3.45Å; V86-C89 PolarHBondContact O-N 3.47Å; R87-C89 PolarHBondContact O-N 2.87Å; C89-I92 PolarHBondContact O-N 3.11Å; C89-Q93 VanDerWaalsContact O-CB 3.31Å; C89-Q93 WeakPolarHBondContact O-CB 3.38Å; C89-Q93 WeakPolarHBondContact O-CG 3.35Å; C89-Q93 PolarHBondContact O-N 3.18Å
90F90.2Very high86.2Confident116 Ų11670.4 Ų70.451%0.50939%0.39SS..Hα-helixtrans-64.3-46.6-179.8-179.6-97.9000112.2M1 V86 R87 S88 I92 Q93 A94M1-F90 HydrophobicContact CE-CB 4Å; M1-F90 HydrophobicContact CE-CD2 4.18Å; M1-F90 HydrophobicContact CE-CG 4.13Å; V86-F90 PolarHBondContact O-N 3.44Å; R87-F90 PolarHBondContact O-N 3.43Å; S88-F90 VanDerWaalsContact C-N 3.31Å; S88-F90 PolarHBondContact O-N 3.41Å; F90-I92 VanDerWaalsContact C-N 3.35Å; F90-I92 PolarHBondContact O-N 3.11Å; F90-Q93 PolarHBondContact O-N 2.7Å; F90-A94 VanDerWaalsContact O-CB 3.26Å; F90-A94 WeakPolarHBondContact O-CB 3.3Å; F90-A94 PolarHBondContact O-N 3.48Å
91I93.6Very high88.4Confident100 Ų10064 Ų6451%0.51336%0.361SS..Hα-helixtrans-61.9-43.9179.3-66.8169.2000110.7R87 S88 G95R87-I91 HydrophobicContact CG-CD1 3.9Å; R87-I91 WeakPolarHBondContact O-CG1 3.44Å; R87-I91 PolarHBondContact O-N 3.44Å; S88-I91 PolarHBondContact O-N 3.33Å; I91-G95 PolarHBondContact O-N 2.95Å
92I93.9Very high90.2Very high81 Ų8164 Ų6442%0.41536%0.364SS..Hα-helixtrans-64.6-47.8178.4-68165.9000110.4S88 C89 F90 G95 V96S88-I92 WeakPolarHBondContact O-CB 3.31Å; S88-I92 WeakPolarHBondContact O-CD1 3.14Å; S88-I92 WeakPolarHBondContact O-CG1 3.26Å; S88-I92 PolarHBondContact O-N 3.3Å; C89-I92 PolarHBondContact O-N 3.11Å; F90-I92 VanDerWaalsContact C-N 3.35Å; F90-I92 PolarHBondContact O-N 3.11Å; I92-G95 PolarHBondContact O-N 2.98Å; I92-V96 HydrophobicContact CG2-CG2 4.4Å; I92-V96 WeakPolarHBondContact O-CG2 3.43Å; I92-V96 PolarHBondContact O-N 2.99Å
93Q93.7Very high91.4Very high8 Ų865.2 Ų65.24%0.03736%0.358CS..Hα-helixtrans-60.8-50.6179-75.7177.6-6.500111.8L56 L59 S60 C89 F90 G95 V96 V97L56-Q93 HydrophobicContact CD1-CB 3.88Å; L56-Q93 HydrophobicContact CD1-CG 4.16Å; L59-Q93 HydrophobicContact CB-CG 4.24Å; S60-Q93 VanDerWaalsContact CA-NE2 3.33Å; S60-Q93 PolarHBondContact OG-NE2 3.32Å; C89-Q93 VanDerWaalsContact O-CB 3.31Å; C89-Q93 WeakPolarHBondContact O-CB 3.38Å; C89-Q93 WeakPolarHBondContact O-CG 3.35Å; C89-Q93 PolarHBondContact O-N 3.18Å; F90-Q93 PolarHBondContact O-N 2.7Å; Q93-G95 VanDerWaalsContact C-N 3.32Å; Q93-G95 PolarHBondContact O-N 3.43Å; Q93-V96 PolarHBondContact O-N 2.96Å; Q93-V97 WeakPolarHBondContact O-CB 3.32Å; Q93-V97 VanDerWaalsContact O-CG2 3.25Å; Q93-V97 WeakPolarHBondContact O-CG2 3.33Å; Q93-V97 PolarHBondContact O-N 2.88Å
94A94.1Very high92.1Very high46 Ų4661.6 Ų61.638%0.3833%0.327SS..Hα-helixtrans-61.4-42.4178.300000111.4F90 L98F90-A94 VanDerWaalsContact O-CB 3.26Å; F90-A94 WeakPolarHBondContact O-CB 3.3Å; F90-A94 PolarHBondContact O-N 3.48Å; A94-L98 WeakPolarHBondContact O-CB 3.48Å; A94-L98 PolarHBondContact O-N 3.49Å
95G95.6Very high92.6Very high32 Ų3259 Ų5933%0.3332%0.317SS..Hα-helixtrans-61.8-50.2177.400000112.6I91 I92 Q93 L98 V99I91-G95 PolarHBondContact O-N 2.95Å; I92-G95 PolarHBondContact O-N 2.98Å; Q93-G95 VanDerWaalsContact C-N 3.32Å; Q93-G95 PolarHBondContact O-N 3.43Å; G95-L98 PolarHBondContact O-N 3.5Å; G95-V99 WeakPolarHBondContact O-CB 3.41Å; G95-V99 VanDerWaalsContact O-CG2 3.26Å; G95-V99 WeakPolarHBondContact O-CG2 3.43Å; G95-V99 PolarHBondContact O-N 3.27Å
96V94.8Very high93Very high63 Ų6360.2 Ų60.238%0.38233%0.329SS..Hα-helixtrans-66.2-41.6179.81760000111.5L59 I92 Q93 V99 N100L59-V96 HydrophobicContact CD1-CB 3.56Å; L59-V96 HydrophobicContact CD1-CG1 3.65Å; L59-V96 HydrophobicContact CD1-CG2 3.91Å; I92-V96 HydrophobicContact CG2-CG2 4.4Å; I92-V96 WeakPolarHBondContact O-CG2 3.43Å; I92-V96 PolarHBondContact O-N 2.99Å; Q93-V96 PolarHBondContact O-N 2.96Å; V96-V99 PolarHBondContact O-N 3.46Å; V96-N100 VanDerWaalsContact O-CB 3.26Å; V96-N100 WeakPolarHBondContact O-CB 3.29Å; V96-N100 PolarHBondContact O-N 2.98Å
97V95.2Very high93.4Very high21 Ų2159.8 Ų59.813%0.12732%0.324CS..Hα-helixtrans-62-44.6175.8167.70000110.9V52 P55 L56 Q93 N100 L101V52-V97 HydrophobicContact CB-CG1 4.31Å; V52-V97 HydrophobicContact CG1-CG1 3.86Å; V52-V97 HydrophobicContact CG2-CG1 4.14Å; P55-V97 HydrophobicContact CG-CG2 4.44Å; L56-V97 HydrophobicContact CB-CG2 3.92Å; L56-V97 HydrophobicContact CD1-CG2 4.12Å; Q93-V97 WeakPolarHBondContact O-CB 3.32Å; Q93-V97 VanDerWaalsContact O-CG2 3.25Å; Q93-V97 WeakPolarHBondContact O-CG2 3.33Å; Q93-V97 PolarHBondContact O-N 2.88Å; V97-N100 PolarHBondContact O-N 3.22Å; V97-L101 VanDerWaalsContact O-CB 3.27Å; V97-L101 WeakPolarHBondContact O-CB 3.19Å; V97-L101 PolarHBondContact O-N 2.81Å
98L95.6Very high93.5Very high108 Ų10851.5 Ų51.557%0.56529%0.293SS*.Hα-helixtrans-63.3-46.4178.7-177.663.5000111.2A94 G95 L101 T102A94-L98 WeakPolarHBondContact O-CB 3.48Å; A94-L98 PolarHBondContact O-N 3.49Å; G95-L98 PolarHBondContact O-N 3.5Å; L98-L101 PolarHBondContact O-N 3.48Å; L98-T102 HydrophobicContact CD1-CG2 4.36Å; L98-T102 WeakPolarHBondContact O-CG2 3.24Å; L98-T102 PolarHBondContact O-N 3.13Å; L98-T102 PolarHBondContact O-OG1 3.41Å; L98-T102 VanDerWaalsContact O-OG1 3.11Å
99V95.7Very high93.7Very high82 Ų8256 Ų5650%0.49731%0.308SS..Hα-helixtrans-62.5-43.5176.9170.80000111.2G95 V96 L101 T102 L103G95-V99 WeakPolarHBondContact O-CB 3.41Å; G95-V99 VanDerWaalsContact O-CG2 3.26Å; G95-V99 WeakPolarHBondContact O-CG2 3.43Å; G95-V99 PolarHBondContact O-N 3.27Å; V96-V99 PolarHBondContact O-N 3.46Å; V99-L101 VanDerWaalsContact C-N 3.35Å; V99-L101 PolarHBondContact O-N 3.25Å; V99-T102 WeakPolarHBondContact CA-OG1 3.2Å; V99-T102 PolarHBondContact O-N 3.06Å; V99-T102 PolarHBondContact O-OG1 3.26Å; V99-L103 HydrophobicContact CG1-CD1 3.82Å; V99-L103 HydrophobicContact CG1-CG 4.33Å; V99-L103 WeakPolarHBondContact O-CB 3.44Å; V99-L103 VanDerWaalsContact O-CG 3.22Å; V99-L103 WeakPolarHBondContact O-CG 3.42Å; V99-L103 PolarHBondContact O-N 3.29Å
100N94.6Very high93.8Very high19 Ų1961.9 Ų61.910%0.10234%0.339CS..Hα-helixtrans-64.5-41.6177.7-170.266.6000111.4A51 P55 V96 V97 N104 Y130A51-N100 PolarHBondContact O-ND2 2.87Å; P55-N100 HydrophobicContact CG-CB 4.49Å; V96-N100 VanDerWaalsContact O-CB 3.26Å; V96-N100 WeakPolarHBondContact O-CB 3.29Å; V96-N100 PolarHBondContact O-N 2.98Å; V97-N100 PolarHBondContact O-N 3.22Å; N100-N104 WeakPolarHBondContact O-CB 3.41Å; N100-N104 PolarHBondContact O-N 3.2Å; N100-Y130 PolarHBondContact O-OH 2.95Å; N100-Y130 PolarHBondContact OD1-OH 2.95Å
101L94.2Very high93.8Very high46 Ų4659.1 Ų59.124%0.24133%0.325CS..Hα-helixtrans-65.9-44.7178.2-177.662.2000111.8V52 V97 L98 V99 N104 L105V52-L101 HydrophobicContact CG2-CD1 4.47Å; V52-L101 HydrophobicContact CG2-CD2 4.5Å; V97-L101 VanDerWaalsContact O-CB 3.27Å; V97-L101 WeakPolarHBondContact O-CB 3.19Å; V97-L101 PolarHBondContact O-N 2.81Å; L98-L101 PolarHBondContact O-N 3.48Å; V99-L101 VanDerWaalsContact C-N 3.35Å; V99-L101 PolarHBondContact O-N 3.25Å; L101-N104 PolarHBondContact O-N 2.99Å; L101-L105 HydrophobicContact CD1-CD1 4.4Å; L101-L105 HydrophobicContact CD1-CG 4.48Å; L101-L105 HydrophobicContact CG-CD1 4.26Å; L101-L105 WeakPolarHBondContact O-CB 3.32Å; L101-L105 VanDerWaalsContact O-CG 3.31Å; L101-L105 WeakPolarHBondContact O-CG 3.5Å; L101-L105 PolarHBondContact O-N 3.29Å
102T94.7Very high93.5Very high68 Ų6856.2 Ų56.242%0.41731%0.313SS..Hα-helixtrans-64.7-45.7177.954.30000111.1L98 V99 N104 L105 T106L98-T102 HydrophobicContact CD1-CG2 4.36Å; L98-T102 WeakPolarHBondContact O-CG2 3.24Å; L98-T102 PolarHBondContact O-N 3.13Å; L98-T102 PolarHBondContact O-OG1 3.41Å; L98-T102 VanDerWaalsContact O-OG1 3.11Å; V99-T102 WeakPolarHBondContact CA-OG1 3.2Å; V99-T102 PolarHBondContact O-N 3.06Å; V99-T102 PolarHBondContact O-OG1 3.26Å; T102-N104 PolarHBondContact O-N 3.42Å; T102-L105 PolarHBondContact O-N 2.84Å; T102-T106 WeakPolarHBondContact O-CB 3.3Å; T102-T106 PolarHBondContact O-N 2.8Å; T102-T106 PolarHBondContact O-OG1 3.06Å
103L94.5Very high93.2Very high80 Ų8059.5 Ų59.542%0.41933%0.332SS..Hα-helixtrans-60.8-44.5175.7-71.2174.1000111.6V99 L105 T106 Q107 Y130V99-L103 HydrophobicContact CG1-CD1 3.82Å; V99-L103 HydrophobicContact CG1-CG 4.33Å; V99-L103 WeakPolarHBondContact O-CB 3.44Å; V99-L103 VanDerWaalsContact O-CG 3.22Å; V99-L103 WeakPolarHBondContact O-CG 3.42Å; V99-L103 PolarHBondContact O-N 3.29Å; L103-L105 PolarHBondContact O-N 2.95Å; L103-T106 PolarHBondContact O-N 2.89Å; L103-Q107 VanDerWaalsContact O-CG 3.26Å; L103-Q107 WeakPolarHBondContact O-CG 3.4Å; L103-Q107 PolarHBondContact O-N 3.22Å; L103-Y130 HydrophobicContact CB-CE2 3.7Å
104N92.9Very high92.9Very high4 Ų462 Ų622%0.02135%0.347CS..Hα-helixtrans-56.9-49.1176.5-173.6-94.8000111.4A51 N100 L101 T102 Q107 I108A51-N104 HydrophobicContact CB-CB 4.48Å; N100-N104 WeakPolarHBondContact O-CB 3.41Å; N100-N104 PolarHBondContact O-N 3.2Å; L101-N104 PolarHBondContact O-N 2.99Å; T102-N104 PolarHBondContact O-N 3.42Å; N104-Q107 PolarHBondContact O-N 3.15Å; N104-I108 VanDerWaalsContact O-CG1 3.29Å; N104-I108 WeakPolarHBondContact O-CG1 3.26Å; N104-I108 PolarHBondContact O-N 3.15Å; N104-I108 VanDerWaalsContact OD1-CD1 3.3Å; N104-I108 WeakPolarHBondContact OD1-CD1 3.46Å
105L93.2Very high92.4Very high59 Ų5964.2 Ų64.231%0.30936%0.358SS..Hα-helixtrans-62.1-46.6177.3-71172.3000111.7L101 T102 L103 Q107 I108 F109L101-L105 HydrophobicContact CD1-CD1 4.4Å; L101-L105 HydrophobicContact CD1-CG 4.48Å; L101-L105 HydrophobicContact CG-CD1 4.26Å; L101-L105 WeakPolarHBondContact O-CB 3.32Å; L101-L105 VanDerWaalsContact O-CG 3.31Å; L101-L105 WeakPolarHBondContact O-CG 3.5Å; L101-L105 PolarHBondContact O-N 3.29Å; T102-L105 PolarHBondContact O-N 2.84Å; L103-L105 PolarHBondContact O-N 2.95Å; L105-Q107 VanDerWaalsContact C-N 3.29Å; L105-Q107 PolarHBondContact O-N 3.29Å; L105-I108 WeakPolarHBondContact O-CB 3.05Å; L105-I108 PolarHBondContact O-N 2.9Å; L105-I108 VanDerWaalsContact O-N 3.13Å; L105-F109 HydrophobicContact CB-CE2 4.4Å; L105-F109 WeakPolarHBondContact O-CD2 3.47Å; L105-F109 PolarHBondContact O-N 3.42Å
106T93.5Very high91.9Very high70 Ų7063.3 Ų63.343%0.42935%0.345SS..Hα-helixtrans-57-43176.7-59.40000111.3T102 L103 F109 L110T102-T106 WeakPolarHBondContact O-CB 3.3Å; T102-T106 PolarHBondContact O-N 2.8Å; T102-T106 PolarHBondContact O-OG1 3.06Å; L103-T106 PolarHBondContact O-N 2.89Å; T106-F109 PolarHBondContact O-N 3.17Å; T106-L110 HydrophobicContact CG2-CD1 3.91Å; T106-L110 HydrophobicContact CG2-CG 4.34Å; T106-L110 WeakPolarHBondContact O-CB 3.44Å; T106-L110 VanDerWaalsContact O-CG 3.26Å; T106-L110 WeakPolarHBondContact O-CG 3.14Å; T106-L110 PolarHBondContact O-N 3.4Å
107Q93Very high91.2Very high38 Ų3862.4 Ų62.418%0.17834%0.338CS..Hα-helixtrans-64.1-40.2176.6-68.5-58.3-48.700112.6L103 N104 L105 L110 R111 V126 D127 Y130L103-Q107 VanDerWaalsContact O-CG 3.26Å; L103-Q107 WeakPolarHBondContact O-CG 3.4Å; L103-Q107 PolarHBondContact O-N 3.22Å; N104-Q107 PolarHBondContact O-N 3.15Å; L105-Q107 VanDerWaalsContact C-N 3.29Å; L105-Q107 PolarHBondContact O-N 3.29Å; Q107-L110 PolarHBondContact O-N 3.1Å; Q107-R111 PolarHBondContact O-N 3.45Å; Q107-R111 VanDerWaalsContact O-N 3.16Å; Q107-V126 HydrophobicContact CB-CB 4.08Å; Q107-V126 HydrophobicContact CB-CG1 4.06Å; Q107-D127 VanDerWaalsContact OE1-CB 3.32Å; Q107-Y130 HydrophobicContact CG-CD2 4Å; Q107-Y130 HydrophobicContact CG-CG 3.94Å
108I92Very high90.3Very high4 Ų462.2 Ų62.22%0.02134%0.337CS..Hα-helixtrans-60.7-45.7175.1-67.6164.1000110.7P37 V38 A41 N104 L105 R111 S112 V125 V126P37-I108 HydrophobicContact CB-CG2 4.29Å; V38-I108 HydrophobicContact CG2-CG2 4.17Å; A41-I108 HydrophobicContact CB-CD1 3.92Å; A41-I108 HydrophobicContact CB-CG2 3.91Å; N104-I108 VanDerWaalsContact O-CG1 3.29Å; N104-I108 WeakPolarHBondContact O-CG1 3.26Å; N104-I108 PolarHBondContact O-N 3.15Å; N104-I108 VanDerWaalsContact OD1-CD1 3.3Å; N104-I108 WeakPolarHBondContact OD1-CD1 3.46Å; L105-I108 WeakPolarHBondContact O-CB 3.05Å; L105-I108 PolarHBondContact O-N 2.9Å; L105-I108 VanDerWaalsContact O-N 3.13Å; I108-R111 PolarHBondContact O-N 3.35Å; I108-S112 PolarHBondContact O-N 3.2Å; I108-V125 HydrophobicContact CD1-CG1 4.27Å; I108-V125 HydrophobicContact CG1-CG1 3.77Å; I108-V126 HydrophobicContact CD1-CG1 4.45Å; I108-V126 HydrophobicContact CG1-CG1 3.74Å
109F92.6Very high89.4Confident128 Ų12861.8 Ų61.856%0.56133%0.328SS*.Hα-helixtrans-67.4-41.4-179.9-76.7-65.9000112.6V38 L105 T106 R111 S112V38-F109 HydrophobicContact CG2-CD1 4.29Å; L105-F109 HydrophobicContact CB-CE2 4.4Å; L105-F109 WeakPolarHBondContact O-CD2 3.47Å; L105-F109 PolarHBondContact O-N 3.42Å; T106-F109 PolarHBondContact O-N 3.17Å; F109-R111 VanDerWaalsContact C-N 3.25Å; F109-R111 PolarHBondContact O-N 3.35Å; F109-S112 WeakPolarHBondContact O-CB 3.39Å; F109-S112 PolarHBondContact O-N 3.11Å; F109-S112 VanDerWaalsContact O-N 3.15Å; F109-S112 PolarHBondContact O-OG 3.11Å
110L92.5Very high88.8Confident126 Ų12657.9 Ų57.966%0.6631%0.305SS*.Hα-helixtrans-62.2-33.4177.5-73.8171.1000112.4T106 Q107T106-L110 HydrophobicContact CG2-CD1 3.91Å; T106-L110 HydrophobicContact CG2-CG 4.34Å; T106-L110 WeakPolarHBondContact O-CB 3.44Å; T106-L110 VanDerWaalsContact O-CG 3.26Å; T106-L110 WeakPolarHBondContact O-CG 3.14Å; T106-L110 PolarHBondContact O-N 3.4Å; Q107-L110 PolarHBondContact O-N 3.1Å
111R90.1Very high88.2Confident59 Ų5959.3 Ų59.322%0.22331%0.31CS..THydrogen-bonded Turntrans-91.711.1177.9-65.1-168.168.7-169.6-4.3114.2P37 Q107 I108 F109 N113 V114 E124 V126P37-R111 HydrophobicContact CG-CB 4.17Å; P37-R111 WeakPolarHBondContact CG-O 3.39Å; Q107-R111 PolarHBondContact O-N 3.45Å; Q107-R111 VanDerWaalsContact O-N 3.16Å; I108-R111 PolarHBondContact O-N 3.35Å; F109-R111 VanDerWaalsContact C-N 3.25Å; F109-R111 PolarHBondContact O-N 3.35Å; R111-N113 PolarHBondContact O-N 3.24Å; R111-V114 PolarHBondContact O-N 3.09Å; R111-E124 PolarHBondContact NH1-O 3.46Å; R111-V126 VanDerWaalsContact NH1-C 3.32Å; R111-V126 PolarHBondContact NH1-O 3.49Å
112S87.7Confident87.7Confident38 Ų3858.2 Ų58.227%0.26630%0.304SS..THydrogen-bonded Turntrans-51.2-31.4-174.551.30000115.3T36 I108 F109T36-S112 WeakPolarHBondContact CB-O 3.39Å; T36-S112 WeakPolarHBondContact CG2-O 3.28Å; I108-S112 PolarHBondContact O-N 3.2Å; F109-S112 WeakPolarHBondContact O-CB 3.39Å; F109-S112 PolarHBondContact O-N 3.11Å; F109-S112 VanDerWaalsContact O-N 3.15Å; F109-S112 PolarHBondContact O-OG 3.11Å
113N87Confident87.1Confident150 Ų15059 Ų5980%0.80230%0.302SS*.THydrogen-bonded Turntrans-91.3-4.1-177.7-62.9-42.3000114.9R111R111-N113 PolarHBondContact O-N 3.24Å
114V86.8Confident86.6Confident60 Ų6057.3 Ų57.336%0.36429%0.291SS..SBendtrans-87.2122.4-177.7-177.50000109.5P37 R111 I116P37-V114 VanDerWaalsContact CD-O 3.26Å; P37-V114 WeakPolarHBondContact CD-O 3.33Å; R111-V114 PolarHBondContact O-N 3.09Å; V114-I116 PolarHBondContact O-N 3.35Å
115P83.9Confident86.3Confident93 Ų9357.2 Ų57.260%0.60429%0.291SS*.  trans-67.3129.6174.227.7-32.8000109.7
116I84.7Confident86.1Confident13 Ų1354.4 Ų54.47%0.06728%0.276CS..EExtended strand (participates in β ladder)trans-124.416417761.2163.1000110.4S34 T35 P37 C40 V114 E124 V125S34-I116 CarbonylContact C-O 3.38Å; S34-I116 WeakPolarHBondContact CA-O 3.42Å; T35-I116 HydrophobicContact CG2-CD1 4.5Å; T35-I116 HydrophobicContact CG2-CG1 4.04Å; T35-I116 PolarHBondContact N-O 2.86Å; T35-I116 WeakPolarHBondContact O-CG1 3.38Å; T35-I116 PolarHBondContact O-N 3.46Å; P37-I116 HydrophobicContact CB-CD1 4.32Å; P37-I116 HydrophobicContact CG-CD1 3.96Å; P37-I116 HydrophobicContact CG-CG1 4.23Å; P37-I116 HydrophobicContact CG-CG2 4.06Å; C40-I116 HydrophobicContact CB-CD1 4.33Å; C40-I116 VanDerWaalsContact SG-CD1 3.53Å; V114-I116 PolarHBondContact O-N 3.35Å; I116-E124 HydrophobicContact CB-CB 4.41Å; I116-E124 WeakPolarHBondContact CG2-O 3.46Å; I116-V125 HydrophobicContact CD1-CB 4.48Å; I116-V125 HydrophobicContact CD1-CG2 3.69Å
117N80.1Confident85.9Confident44 Ų4453.8 Ų53.824%0.23527%0.27CS..EExtended strand (participates in β ladder)trans-66.1147.7177.7-159.4-25.5000110.5R119 C120 E124N117-R119 PolarHBondContact ND2-NE 3.32Å; N117-R119 PolarHBondContact O-N 3.45Å; N117-C120 PolarHBondContact O-N 3.41Å; N117-E124 WeakPolarHBondContact CB-OE2 3.49Å
118T77.2Confident85.6Confident17 Ų1757.2 Ų57.210%0.10428%0.282CS..THydrogen-bonded Turntrans-69.24.417747.70000114.6N33 T35 C120N33-T118 HydrophobicContact CB-CG2 3.85Å; N33-T118 WeakPolarHBondContact O-CG2 3.26Å; N33-T118 PolarHBondContact O-N 2.91Å; N33-T118 PolarHBondContact O-OG1 3.04Å; T35-T118 HydrophobicContact CG2-CG2 3.85Å; T118-C120 VanDerWaalsContact C-N 3.31Å
119R76.5Confident85.5Confident99 Ų9964.2 Ų64.237%0.37431%0.313SS..THydrogen-bonded Turntrans-73.9-23171.4-58-175.5-164.9-175.711.9112.3L23 E27 N117 F121L23-R119 WeakPolarHBondContact CD2-O 3.2Å; E27-R119 IonicContact OE1-CZ 3Å; E27-R119 IonicContact OE1-NE 3.91Å; E27-R119 IonicContact OE1-NH1 2.85Å; E27-R119 PolarHBondContact OE1-NH1 3.35Å; N117-R119 PolarHBondContact ND2-NE 3.32Å; N117-R119 PolarHBondContact O-N 3.45Å; R119-F121 HydrophobicContact CB-CD2 3.7Å; R119-F121 HydrophobicContact CB-CE2 3.76Å; R119-F121 HydrophobicContact CG-CE2 4.4Å; R119-F121 PolarHBondContact O-N 3.48Å; R119-F121 VanDerWaalsContact O-N 3.13Å
120C83.3Confident85.4Confident1 Ų159.2 Ų59.21%0.00729%0.29CS..  trans52.434.1174.2-61.10000114C40 F44 N117 T118 V125C40-C120 HydrophobicContact CB-CB 3.57Å; C40-C120 WeakPolarHBondContact CB-SG 3.28Å; C40-C120 WeakPolarHBondContact SG-CB 3.36Å; C40-C120 CovalentContact SG-SG 2.03Å; C40-C120 PolarHBondContact SG-SG 2.94Å; F44-C120 HydrophobicContact CD2-CB 3.62Å; F44-C120 WeakPolarHBondContact CD2-SG 3.07Å; F44-C120 HydrophobicContact CE2-CB 4.02Å; F44-C120 WeakPolarHBondContact CE2-SG 3.43Å; F44-C120 HydrophobicContact CG-CB 4.35Å; N117-C120 PolarHBondContact O-N 3.41Å; T118-C120 VanDerWaalsContact C-N 3.31Å; C120-V125 HydrophobicContact CB-CG2 4.49Å
121F82.1Confident85.2Confident48 Ų4853.2 Ų53.221%0.21126%0.259CS..  trans-68.1148.3175-73.7-61.1000110.5R119 K123 E124 V125R119-F121 HydrophobicContact CB-CD2 3.7Å; R119-F121 HydrophobicContact CB-CE2 3.76Å; R119-F121 HydrophobicContact CG-CE2 4.4Å; R119-F121 PolarHBondContact O-N 3.48Å; R119-F121 VanDerWaalsContact O-N 3.13Å; F121-K123 HydrophobicContact CB-CG 4.15Å; F121-K123 PolarHBondContact O-N 3.21Å; F121-K123 VanDerWaalsContact O-N 3.09Å; F121-E124 PolarHBondContact O-N 3.32Å; F121-V125 WeakPolarHBondContact O-CG2 3.33Å; F121-V125 PolarHBondContact O-N 2.73Å; F121-V125 VanDerWaalsContact O-N 3.08Å
122Q82.8Confident85.2Confident24 Ų2451.7 Ų51.711%0.11226%0.256CS..Hα-helixtrans-54-34.8178.3-172.3176.3-22.300112.3L47 E124 V125 V126 N131L47-Q122 HydrophobicContact CD2-CB 3.97Å; Q122-E124 PolarHBondContact O-N 2.84Å; Q122-V125 PolarHBondContact O-N 2.98Å; Q122-V126 HydrophobicContact CG-CG2 4.21Å; Q122-V126 WeakPolarHBondContact O-CG2 3.42Å; Q122-V126 PolarHBondContact O-N 2.84Å; Q122-N131 PolarHBondContact O-ND2 3.25Å; Q122-N131 VanDerWaalsContact O-ND2 3.15Å
123K82.8Confident85.5Confident85 Ų8554.9 Ų54.937%0.3727%0.274SS..Hα-helixtrans-62.4-26.8176.670.8176.2174.6-179.80114.8F121 N131 D202F121-K123 HydrophobicContact CB-CG 4.15Å; F121-K123 PolarHBondContact O-N 3.21Å; F121-K123 VanDerWaalsContact O-N 3.09Å; K123-N131 WeakPolarHBondContact CA-ND2 3.44Å; K123-D202 IonicContact NZ-OD2 2.82Å; K123-D202 PolarHBondContact NZ-OD2 3.1Å
124E83.1Confident85.7Confident44 Ų4448.6 Ų48.621%0.20624%0.241CC..Hα-helixtrans-92.6-36.9-179.4-60.3176.6169.300111.5R111 I116 N117 F121 Q122R111-E124 PolarHBondContact NH1-O 3.46Å; I116-E124 HydrophobicContact CB-CB 4.41Å; I116-E124 WeakPolarHBondContact CG2-O 3.46Å; N117-E124 WeakPolarHBondContact CB-OE2 3.49Å; F121-E124 PolarHBondContact O-N 3.32Å; Q122-E124 PolarHBondContact O-N 2.84Å
125V86.9Confident86Confident1 Ų146.1 Ų46.11%0.00623%0.225CC..Hα-helixtrans-72.8-41.3-172.7171.50000112.7P37 C40 L47 I108 I116 C120 F121 Q122P37-V125 HydrophobicContact CB-CG1 4.16Å; C40-V125 HydrophobicContact CB-CG2 3.99Å; L47-V125 HydrophobicContact CD1-CG1 4.43Å; L47-V125 HydrophobicContact CD1-CG2 4.24Å; L47-V125 HydrophobicContact CD2-CG2 4.47Å; I108-V125 HydrophobicContact CD1-CG1 4.27Å; I108-V125 HydrophobicContact CG1-CG1 3.77Å; I116-V125 HydrophobicContact CD1-CB 4.48Å; I116-V125 HydrophobicContact CD1-CG2 3.69Å; C120-V125 HydrophobicContact CB-CG2 4.49Å; F121-V125 WeakPolarHBondContact O-CG2 3.33Å; F121-V125 PolarHBondContact O-N 2.73Å; F121-V125 VanDerWaalsContact O-N 3.08Å; Q122-V125 PolarHBondContact O-N 2.98Å
126V89.2Confident86.4Confident1 Ų143.7 Ų43.71%0.00621%0.209CC..SBendtrans-109.4161.8179.4-61.20000111.6Q107 I108 R111 Q122 Y128 Y130 N131Q107-V126 HydrophobicContact CB-CB 4.08Å; Q107-V126 HydrophobicContact CB-CG1 4.06Å; I108-V126 HydrophobicContact CD1-CG1 4.45Å; I108-V126 HydrophobicContact CG1-CG1 3.74Å; R111-V126 VanDerWaalsContact NH1-C 3.32Å; R111-V126 PolarHBondContact NH1-O 3.49Å; Q122-V126 HydrophobicContact CG-CG2 4.21Å; Q122-V126 WeakPolarHBondContact O-CG2 3.42Å; Q122-V126 PolarHBondContact O-N 2.84Å; V126-Y128 PolarHBondContact O-N 2.88Å; V126-Y130 HydrophobicContact CB-CD1 4.04Å; V126-Y130 HydrophobicContact CG2-CD1 3.61Å; V126-Y130 HydrophobicContact CG2-CE1 4.08Å; V126-N131 VanDerWaalsContact CG2-CG 3.47Å; V126-N131 WeakPolarHBondContact CG2-ND2 3.19Å; V126-N131 WeakPolarHBondContact CG2-OD1 3.36Å
127D89Confident86.8Confident57 Ų5744.9 Ų44.931%0.30522%0.224SC..  trans-55.1137.9178.9-168-30000110.8Q107 K129 Y130 N131Q107-D127 VanDerWaalsContact OE1-CB 3.32Å; D127-K129 PolarHBondContact O-N 3.42Å; D127-K129 PolarHBondContact OD1-N 2.94Å; D127-Y130 WeakPolarHBondContact O-CB 3.35Å; D127-Y130 PolarHBondContact O-N 2.93Å; D127-N131 PolarHBondContact O-N 2.94Å
128Y87.1Confident87.5Confident109 Ų10943.4 Ų43.443%0.42722%0.216SC..Hα-helixtrans-45.4-48.8169.4168.1-101.7000112.6V126 Y130 N131 V132 N203V126-Y128 PolarHBondContact O-N 2.88Å; Y128-Y130 VanDerWaalsContact C-N 3.31Å; Y128-Y130 PolarHBondContact O-N 3.1Å; Y128-N131 PolarHBondContact O-N 2.75Å; Y128-V132 HydrophobicContact CD2-CG2 4.24Å; Y128-V132 HydrophobicContact CE1-CG2 3.98Å; Y128-V132 HydrophobicContact CE2-CG2 3.69Å; Y128-V132 WeakPolarHBondContact O-CG2 3.4Å; Y128-V132 PolarHBondContact O-N 3.33Å; Y128-N203 HydrophobicContact CD2-CB 4.44Å; Y128-N203 HydrophobicContact CE2-CB 3.69Å; Y128-N203 WeakPolarHBondContact CE2-O 3.3Å; Y128-N203 VanDerWaalsContact CZ-O 3.32Å; Y128-N203 PolarHBondContact OH-O 3.22Å
129K89.2Confident88.3Confident151 Ų15143 Ų4366%0.65722%0.215SC*.Hα-helixtrans-61.6-41.9-177.1-67.6-178.3-179.6177.60111.6D127 V132 V133D127-K129 PolarHBondContact O-N 3.42Å; D127-K129 PolarHBondContact OD1-N 2.94Å; K129-V132 PolarHBondContact O-N 2.86Å; K129-V133 WeakPolarHBondContact O-CG2 3.45Å; K129-V133 PolarHBondContact O-N 2.6Å; K129-V133 VanDerWaalsContact O-N 3.1Å
130Y91Very high89.2Confident23 Ų2343.1 Ų43.19%0.0922%0.222CC..Hα-helixtrans-62.8-46.6176.8172.3-93.3000111.3N100 L103 Q107 V126 D127 Y128 V132 V133 V134N100-Y130 PolarHBondContact O-OH 2.95Å; N100-Y130 PolarHBondContact OD1-OH 2.95Å; L103-Y130 HydrophobicContact CB-CE2 3.7Å; Q107-Y130 HydrophobicContact CG-CD2 4Å; Q107-Y130 HydrophobicContact CG-CG 3.94Å; V126-Y130 HydrophobicContact CB-CD1 4.04Å; V126-Y130 HydrophobicContact CG2-CD1 3.61Å; V126-Y130 HydrophobicContact CG2-CE1 4.08Å; D127-Y130 WeakPolarHBondContact O-CB 3.35Å; D127-Y130 PolarHBondContact O-N 2.93Å; Y128-Y130 VanDerWaalsContact C-N 3.31Å; Y128-Y130 PolarHBondContact O-N 3.1Å; Y130-V132 VanDerWaalsContact C-N 3.34Å; Y130-V132 PolarHBondContact O-N 3.24Å; Y130-V133 PolarHBondContact O-N 3.08Å; Y130-V134 HydrophobicContact CD1-CG2 4.22Å; Y130-V134 HydrophobicContact CD2-CG2 4.22Å; Y130-V134 HydrophobicContact CE1-CG2 3.74Å; Y130-V134 HydrophobicContact CE2-CG2 3.74Å; Y130-V134 HydrophobicContact CG-CG2 4.45Å; Y130-V134 VanDerWaalsContact CZ-CG2 3.49Å; Y130-V134 WeakPolarHBondContact O-CG2 3.47Å; Y130-V134 PolarHBondContact O-N 3.07Å
131N89.3Confident89.7Confident0 Ų044 Ų440%023%0.228CC..Hα-helixtrans-59.3-43.9177.5-81.3-42000112.3Q122 K123 V126 D127 Y128 V133 V134 F135Q122-N131 PolarHBondContact O-ND2 3.25Å; Q122-N131 VanDerWaalsContact O-ND2 3.15Å; K123-N131 WeakPolarHBondContact CA-ND2 3.44Å; V126-N131 VanDerWaalsContact CG2-CG 3.47Å; V126-N131 WeakPolarHBondContact CG2-ND2 3.19Å; V126-N131 WeakPolarHBondContact CG2-OD1 3.36Å; D127-N131 PolarHBondContact O-N 2.94Å; Y128-N131 PolarHBondContact O-N 2.75Å; N131-V133 PolarHBondContact O-N 2.85Å; N131-V134 PolarHBondContact O-N 3.41Å; N131-F135 HydrophobicContact CB-CD2 4.2Å; N131-F135 HydrophobicContact CB-CE2 4.1Å; N131-F135 WeakPolarHBondContact O-CB 3.39Å; N131-F135 WeakPolarHBondContact O-CD2 3.43Å; N131-F135 PolarHBondContact O-N 3.47Å
132V90.5Very high90.3Very high28 Ų2842 Ų4217%0.1722%0.221CC..Hα-helixtrans-58.6-48.6176.5172.10000110.8Y128 K129 Y130 V134 T136 F200 N203Y128-V132 HydrophobicContact CD2-CG2 4.24Å; Y128-V132 HydrophobicContact CE1-CG2 3.98Å; Y128-V132 HydrophobicContact CE2-CG2 3.69Å; Y128-V132 WeakPolarHBondContact O-CG2 3.4Å; Y128-V132 PolarHBondContact O-N 3.33Å; K129-V132 PolarHBondContact O-N 2.86Å; Y130-V132 VanDerWaalsContact C-N 3.34Å; Y130-V132 PolarHBondContact O-N 3.24Å; V132-V134 PolarHBondContact O-N 3.39Å; V132-T136 WeakPolarHBondContact O-CB 3.14Å; V132-T136 PolarHBondContact O-N 2.98Å; V132-T136 PolarHBondContact O-OG1 2.93Å; V132-F200 HydrophobicContact CG1-CD2 4.2Å; V132-F200 HydrophobicContact CG1-CE2 4.05Å; V132-N203 HydrophobicContact CG2-CB 3.77Å
133V92.1Very high90.9Very high104 Ų10446 Ų4663%0.6324%0.236SC*.Hα-helixtrans-61.4-46.9-179.8171.90000111.3K129 Y130 N131 G137K129-V133 WeakPolarHBondContact O-CG2 3.45Å; K129-V133 PolarHBondContact O-N 2.6Å; K129-V133 VanDerWaalsContact O-N 3.1Å; Y130-V133 PolarHBondContact O-N 3.08Å; N131-V133 PolarHBondContact O-N 2.85Å; V133-G137 PolarHBondContact O-N 2.89Å
134V92.5Very high91.6Very high18 Ų1846.2 Ų46.211%0.10924%0.241CC..Hα-helixtrans-63.6-52.1-179.4171.80000111.2Y130 N131 V132 T136 G137 L138Y130-V134 HydrophobicContact CD1-CG2 4.22Å; Y130-V134 HydrophobicContact CD2-CG2 4.22Å; Y130-V134 HydrophobicContact CE1-CG2 3.74Å; Y130-V134 HydrophobicContact CE2-CG2 3.74Å; Y130-V134 HydrophobicContact CG-CG2 4.45Å; Y130-V134 VanDerWaalsContact CZ-CG2 3.49Å; Y130-V134 WeakPolarHBondContact O-CG2 3.47Å; Y130-V134 PolarHBondContact O-N 3.07Å; N131-V134 PolarHBondContact O-N 3.41Å; V132-V134 PolarHBondContact O-N 3.39Å; V134-T136 VanDerWaalsContact C-N 3.31Å; V134-T136 PolarHBondContact O-N 2.73Å; V134-G137 PolarHBondContact O-N 2.94Å; V134-L138 HydrophobicContact CG1-CD1 3.89Å; V134-L138 HydrophobicContact CG1-CG 4.34Å; V134-L138 VanDerWaalsContact O-CG 3.29Å; V134-L138 WeakPolarHBondContact O-CG 3.34Å; V134-L138 PolarHBondContact O-N 3.41Å
135F92Very high92.2Very high8 Ų844.3 Ų44.34%0.03523%0.232CC..Hα-helixtrans-67.4-33-178.1-68.2-55.1000112.5E54 N131 L138 A139 N196 K199E54-F135 WeakPolarHBondContact OE2-CE1 3.25Å; N131-F135 HydrophobicContact CB-CD2 4.2Å; N131-F135 HydrophobicContact CB-CE2 4.1Å; N131-F135 WeakPolarHBondContact O-CB 3.39Å; N131-F135 WeakPolarHBondContact O-CD2 3.43Å; N131-F135 PolarHBondContact O-N 3.47Å; F135-L138 HydrophobicContact CD1-CD1 4.2Å; F135-A139 VanDerWaalsContact O-CB 3.24Å; F135-A139 WeakPolarHBondContact O-CB 3.47Å; F135-A139 PolarHBondContact O-N 3.41Å; F135-N196 HydrophobicContact CD1-CB 4.5Å; F135-K199 HydrophobicContact CD1-CB 4.28Å; F135-K199 HydrophobicContact CD1-CD 3.72Å; F135-K199 HydrophobicContact CD2-CB 4.06Å; F135-K199 HydrophobicContact CD2-CD 4.35Å; F135-K199 HydrophobicContact CE1-CD 3.36Å; F135-K199 HydrophobicContact CE2-CB 4.39Å; F135-K199 HydrophobicContact CE2-CD 4.03Å; F135-K199 HydrophobicContact CG-CB 4.03Å; F135-K199 HydrophobicContact CG-CD 4.24Å; F135-K199 HydrophobicContact CZ-CD 3.54Å
136T92.7Very high92.6Very high43 Ų4346.4 Ų46.426%0.26425%0.245SC..Hα-helixtrans-63.9-47.7171.7-560000110.7V132 V134 L138 A139 L140 F200V132-T136 WeakPolarHBondContact O-CB 3.14Å; V132-T136 PolarHBondContact O-N 2.98Å; V132-T136 PolarHBondContact O-OG1 2.93Å; V134-T136 VanDerWaalsContact C-N 3.31Å; V134-T136 PolarHBondContact O-N 2.73Å; T136-L138 PolarHBondContact O-N 3.46Å; T136-A139 PolarHBondContact O-N 3.24Å; T136-L140 HydrophobicContact CG2-CD1 4Å; T136-L140 HydrophobicContact CG2-CG 4.31Å; T136-L140 WeakPolarHBondContact O-CB 3.31Å; T136-L140 VanDerWaalsContact O-CG 3.28Å; T136-L140 WeakPolarHBondContact O-CG 3.18Å; T136-L140 PolarHBondContact O-N 2.88Å; T136-F200 WeakPolarHBondContact OG1-CD2 3.34Å; T136-F200 WeakPolarHBondContact OG1-CE2 3.46Å
137G94.1Very high92.8Very high38 Ų3851.2 Ų51.239%0.39227%0.27SS..Hα-helixtrans-60-43.8177.600000112.6V133 V134 C141V133-G137 PolarHBondContact O-N 2.89Å; V134-G137 PolarHBondContact O-N 2.94Å; G137-C141 VanDerWaalsContact O-CB 3.31Å; G137-C141 WeakPolarHBondContact O-CB 3.43Å; G137-C141 PolarHBondContact O-N 2.93Å
138L94.4Very high93.1Very high13 Ų1349.6 Ų49.67%0.06826%0.262CS..Hα-helixtrans-65.4-42176.2-66.8173.2000112.3E54 P55 A58 V134 F135 T136 C141 G142 N196E54-L138 HydrophobicContact CB-CD1 3.94Å; P55-L138 HydrophobicContact CB-CD2 4.17Å; A58-L138 HydrophobicContact CB-CD2 3.83Å; V134-L138 HydrophobicContact CG1-CD1 3.89Å; V134-L138 HydrophobicContact CG1-CG 4.34Å; V134-L138 VanDerWaalsContact O-CG 3.29Å; V134-L138 WeakPolarHBondContact O-CG 3.34Å; V134-L138 PolarHBondContact O-N 3.41Å; F135-L138 HydrophobicContact CD1-CD1 4.2Å; T136-L138 PolarHBondContact O-N 3.46Å; L138-C141 PolarHBondContact O-N 2.91Å; L138-G142 PolarHBondContact O-N 3.01Å; L138-N196 HydrophobicContact CB-CB 4.48Å; L138-N196 WeakPolarHBondContact CB-ND2 3.27Å
139A93.6Very high93.3Very high9 Ų944.7 Ų44.77%0.07424%0.243CC..Hα-helixtrans-63.7-48.417700000110.9F135 T136 C141 G142 Y143 N196F135-A139 VanDerWaalsContact O-CB 3.24Å; F135-A139 WeakPolarHBondContact O-CB 3.47Å; F135-A139 PolarHBondContact O-N 3.41Å; T136-A139 PolarHBondContact O-N 3.24Å; A139-C141 VanDerWaalsContact C-N 3.34Å; A139-C141 PolarHBondContact O-N 2.94Å; A139-G142 WeakPolarHBondContact O-CA 3.18Å; A139-G142 PolarHBondContact O-N 3.49Å; A139-G142 VanDerWaalsContact O-N 3.07Å; A139-Y143 HydrophobicContact CB-CE2 4.33Å; A139-Y143 WeakPolarHBondContact O-CD2 3.14Å; A139-Y143 PolarHBondContact O-N 3.4Å; A139-N196 HydrophobicContact CB-CB 4.4Å
140L94.9Very high93.5Very high100 Ų10040.9 Ų40.952%0.52423%0.232SC..Hα-helixtrans-57.4-45.3175.8-73175.1000111.7T136 G142 Y143 L144T136-L140 HydrophobicContact CG2-CD1 4Å; T136-L140 HydrophobicContact CG2-CG 4.31Å; T136-L140 WeakPolarHBondContact O-CB 3.31Å; T136-L140 VanDerWaalsContact O-CG 3.28Å; T136-L140 WeakPolarHBondContact O-CG 3.18Å; T136-L140 PolarHBondContact O-N 2.88Å; L140-G142 VanDerWaalsContact C-N 3.29Å; L140-G142 PolarHBondContact O-N 2.76Å; L140-Y143 PolarHBondContact O-N 3.16Å; L140-L144 WeakPolarHBondContact O-CB 3.33Å; L140-L144 VanDerWaalsContact O-CG 3.28Å; L140-L144 WeakPolarHBondContact O-CG 3.44Å; L140-L144 PolarHBondContact O-N 3.49Å
141C95.2Very high93.6Very high19 Ų1942.3 Ų42.313%0.12824%0.243CC..Hα-helixtrans-58.9-41.4175.3-172.30000111.7A58 G137 L138 A139 L144 T145A58-C141 HydrophobicContact CB-CB 4.39Å; G137-C141 VanDerWaalsContact O-CB 3.31Å; G137-C141 WeakPolarHBondContact O-CB 3.43Å; G137-C141 PolarHBondContact O-N 2.93Å; L138-C141 PolarHBondContact O-N 2.91Å; A139-C141 VanDerWaalsContact C-N 3.34Å; A139-C141 PolarHBondContact O-N 2.94Å; C141-L144 PolarHBondContact O-N 2.96Å; C141-T145 WeakPolarHBondContact O-CB 3.31Å; C141-T145 PolarHBondContact O-N 3.27Å; C141-T145 PolarHBondContact O-OG1 3.41Å
142G94.5Very high93.7Very high7 Ų742.3 Ų42.37%0.07224%0.243CC..Hα-helixtrans-61-47.9173.300000113.5L138 A139 L140 T145 V146 T193L138-G142 PolarHBondContact O-N 3.01Å; A139-G142 WeakPolarHBondContact O-CA 3.18Å; A139-G142 PolarHBondContact O-N 3.49Å; A139-G142 VanDerWaalsContact O-N 3.07Å; L140-G142 VanDerWaalsContact C-N 3.29Å; L140-G142 PolarHBondContact O-N 2.76Å; G142-T145 WeakPolarHBondContact O-CB 3.22Å; G142-T145 PolarHBondContact O-N 2.84Å; G142-V146 PolarHBondContact O-N 3.46Å; G142-V146 VanDerWaalsContact O-N 3.13Å; G142-T193 WeakPolarHBondContact CA-OG1 3.31Å
143Y95.7Very high93.6Very high109 Ų10944.6 Ų44.643%0.42725%0.251SS..Hα-helixtrans-63.5-42.3176.6-73.3-67.9000112.4A139 L140 T145 V146 L147 F189 T193 T197A139-Y143 HydrophobicContact CB-CE2 4.33Å; A139-Y143 WeakPolarHBondContact O-CD2 3.14Å; A139-Y143 PolarHBondContact O-N 3.4Å; L140-Y143 PolarHBondContact O-N 3.16Å; Y143-T145 VanDerWaalsContact C-N 3.28Å; Y143-T145 PolarHBondContact O-N 2.81Å; Y143-V146 PolarHBondContact O-N 3.09Å; Y143-L147 WeakPolarHBondContact O-CB 3.36Å; Y143-L147 PolarHBondContact O-N 3.2Å; Y143-F189 AromaticContact CD1-CE2 3.95Å; Y143-F189 HydrophobicContact CD1-CE2 3.95Å; Y143-F189 HydrophobicContact CD1-CZ 4.45Å; Y143-F189 AromaticContact CE1-CE2 3.79Å; Y143-F189 HydrophobicContact CE1-CE2 3.79Å; Y143-F189 AromaticContact CE1-CZ 3.92Å; Y143-F189 HydrophobicContact CE1-CZ 3.92Å; Y143-T193 HydrophobicContact CD2-CG2 4.28Å; Y143-T193 HydrophobicContact CE2-CG2 4.14Å; Y143-T197 PolarHBondContact OH-OG1 3.24Å
144L96.1Very high93.5Very high88 Ų8844.1 Ų44.146%0.46124%0.244SC..Hα-helixtrans-62.8-35.6175.9-71.8175.2000112F62 L140 C141 L147 T148F62-L144 HydrophobicContact CD2-CB 4.25Å; F62-L144 HydrophobicContact CE2-CB 3.94Å; L140-L144 WeakPolarHBondContact O-CB 3.33Å; L140-L144 VanDerWaalsContact O-CG 3.28Å; L140-L144 WeakPolarHBondContact O-CG 3.44Å; L140-L144 PolarHBondContact O-N 3.49Å; C141-L144 PolarHBondContact O-N 2.96Å; L144-L147 PolarHBondContact O-N 2.8Å; L144-T148 VanDerWaalsContact O-CB 3.3Å; L144-T148 WeakPolarHBondContact O-CB 3.37Å; L144-T148 PolarHBondContact O-N 3.42Å; L144-T148 PolarHBondContact O-OG1 3.26Å
145T95.5Very high93.3Very high4 Ų445.9 Ų45.93%0.02525%0.253CS..Hα-helixtrans-60.9-51.9174.2-59.20000110.9T61 F62 A65 C141 G142 Y143 L147 T148 E149 V185T61-T145 HydrophobicContact CG2-CG2 3.71Å; F62-T145 VanDerWaalsContact CA-OG1 3.3Å; F62-T145 WeakPolarHBondContact CA-OG1 3.28Å; F62-T145 WeakPolarHBondContact CB-OG1 3.5Å; A65-T145 HydrophobicContact CB-CG2 3.87Å; C141-T145 WeakPolarHBondContact O-CB 3.31Å; C141-T145 PolarHBondContact O-N 3.27Å; C141-T145 PolarHBondContact O-OG1 3.41Å; G142-T145 WeakPolarHBondContact O-CB 3.22Å; G142-T145 PolarHBondContact O-N 2.84Å; Y143-T145 VanDerWaalsContact C-N 3.28Å; Y143-T145 PolarHBondContact O-N 2.81Å; T145-L147 PolarHBondContact O-N 2.85Å; T145-T148 PolarHBondContact O-N 3.23Å; T145-E149 PolarHBondContact O-N 2.82Å; T145-V185 HydrophobicContact CG2-CG1 4.09Å; T145-V185 HydrophobicContact CG2-CG2 4.05Å
146V95.1Very high92.9Very high45 Ų4546.3 Ų46.327%0.27326%0.255SS..Hα-helixtrans-61.5-45.3178.1174.90000110.9G142 Y143 T148 E149 V150 V185 F189G142-V146 PolarHBondContact O-N 3.46Å; G142-V146 VanDerWaalsContact O-N 3.13Å; Y143-V146 PolarHBondContact O-N 3.09Å; V146-T148 VanDerWaalsContact C-N 3.34Å; V146-T148 PolarHBondContact O-N 3.05Å; V146-E149 PolarHBondContact O-N 3.31Å; V146-V150 HydrophobicContact CG1-CG2 4.15Å; V146-V150 WeakPolarHBondContact O-CB 3.28Å; V146-V150 VanDerWaalsContact O-CG2 3.28Å; V146-V150 WeakPolarHBondContact O-CG2 3.23Å; V146-V150 PolarHBondContact O-N 3.47Å; V146-V185 HydrophobicContact CG2-CG1 3.92Å; V146-F189 HydrophobicContact CG2-CB 4.14Å; V146-F189 HydrophobicContact CG2-CD2 3.46Å; V146-F189 VanDerWaalsContact CG2-CD2 3.46Å; V146-F189 HydrophobicContact CG2-CE2 4.09Å; V146-F189 HydrophobicContact CG2-CG 3.97Å
147L95.4Very high92.5Very high102 Ų10252.1 Ų52.153%0.53427%0.273SS..Hα-helixtrans-58.9-46.2178.4-178.563.5000111.3Y143 L144 T145 E149 V150 V151Y143-L147 WeakPolarHBondContact O-CB 3.36Å; Y143-L147 PolarHBondContact O-N 3.2Å; L144-L147 PolarHBondContact O-N 2.8Å; T145-L147 PolarHBondContact O-N 2.85Å; L147-E149 PolarHBondContact O-N 3.49Å; L147-V150 PolarHBondContact O-N 3.04Å; L147-V151 HydrophobicContact CD1-CG2 4.22Å; L147-V151 HydrophobicContact CG-CG2 4.48Å; L147-V151 WeakPolarHBondContact O-CB 3.21Å; L147-V151 VanDerWaalsContact O-CG2 3.23Å; L147-V151 WeakPolarHBondContact O-CG2 3.49Å; L147-V151 PolarHBondContact O-N 2.95Å
148T93.8Very high92Very high23 Ų2356.5 Ų56.514%0.14129%0.287CS..Hα-helixtrans-61.8-44.3179.2-570000111.1A65 F69 L144 T145 V146 T152A65-T148 HydrophobicContact CB-CG2 4.47Å; F69-T148 HydrophobicContact CB-CG2 3.85Å; F69-T148 HydrophobicContact CG-CG2 4.31Å; L144-T148 VanDerWaalsContact O-CB 3.3Å; L144-T148 WeakPolarHBondContact O-CB 3.37Å; L144-T148 PolarHBondContact O-N 3.42Å; L144-T148 PolarHBondContact O-OG1 3.26Å; T145-T148 PolarHBondContact O-N 3.23Å; V146-T148 VanDerWaalsContact C-N 3.34Å; V146-T148 PolarHBondContact O-N 3.05Å; T148-T152 WeakPolarHBondContact O-CB 3.33Å; T148-T152 PolarHBondContact O-N 3.48Å; T148-T152 PolarHBondContact O-OG1 3.46Å
149E92.1Very high91.4Very high7 Ų758.3 Ų58.33%0.03330%0.296CS..Hα-helixtrans-65.1-44.4176.2-81.5-66.6163.500112.9A65 N68 T145 V146 L147 V151 T152 F153 T181 V185A65-E149 VanDerWaalsContact CA-OE1 3.26Å; A65-E149 WeakPolarHBondContact CA-OE1 3.46Å; A65-E149 HydrophobicContact CB-CG 3.68Å; N68-E149 PolarHBondContact ND2-OE1 2.87Å; T145-E149 PolarHBondContact O-N 2.82Å; V146-E149 PolarHBondContact O-N 3.31Å; L147-E149 PolarHBondContact O-N 3.49Å; E149-V151 PolarHBondContact O-N 3.47Å; E149-T152 PolarHBondContact O-N 3.32Å; E149-F153 WeakPolarHBondContact O-CB 3.38Å; E149-F153 PolarHBondContact O-N 2.89Å; E149-T181 WeakPolarHBondContact OE1-CG2 3.38Å; E149-V185 HydrophobicContact CG-CB 4.45Å; E149-V185 HydrophobicContact CG-CG1 4.31Å; E149-V185 HydrophobicContact CG-CG2 3.94Å
150V93.5Very high90.3Very high71 Ų7164.7 Ų64.743%0.4332%0.322SS..Hα-helixtrans-61.4-46.5177.7170.30000110.5V146 L147 T152 F153 L154V146-V150 HydrophobicContact CG1-CG2 4.15Å; V146-V150 WeakPolarHBondContact O-CB 3.28Å; V146-V150 VanDerWaalsContact O-CG2 3.28Å; V146-V150 WeakPolarHBondContact O-CG2 3.23Å; V146-V150 PolarHBondContact O-N 3.47Å; L147-V150 PolarHBondContact O-N 3.04Å; V150-T152 PolarHBondContact O-N 2.74Å; V150-F153 PolarHBondContact O-N 3Å; V150-L154 HydrophobicContact CG1-CD1 3.9Å; V150-L154 HydrophobicContact CG1-CG 4.32Å; V150-L154 WeakPolarHBondContact O-CB 3.42Å; V150-L154 VanDerWaalsContact O-CG 3.27Å; V150-L154 WeakPolarHBondContact O-CG 3.43Å; V150-L154 PolarHBondContact O-N 2.9Å
151V92.7Very high89Confident53 Ų5364.7 Ų64.732%0.32133%0.331SS..Hα-helixtrans-60.3-46.2176.1169.80000110.7F69 L147 E149 F153 L154 L155F69-V151 HydrophobicContact CE2-CG1 4.15Å; L147-V151 HydrophobicContact CD1-CG2 4.22Å; L147-V151 HydrophobicContact CG-CG2 4.48Å; L147-V151 WeakPolarHBondContact O-CB 3.21Å; L147-V151 VanDerWaalsContact O-CG2 3.23Å; L147-V151 WeakPolarHBondContact O-CG2 3.49Å; L147-V151 PolarHBondContact O-N 2.95Å; E149-V151 PolarHBondContact O-N 3.47Å; V151-F153 VanDerWaalsContact C-N 3.33Å; V151-F153 PolarHBondContact O-N 3.49Å; V151-L154 PolarHBondContact O-N 3.5Å; V151-L155 HydrophobicContact CG1-CD1 3.65Å; V151-L155 HydrophobicContact CG1-CG 4.21Å; V151-L155 WeakPolarHBondContact O-CB 3.48Å; V151-L155 VanDerWaalsContact O-CG 3.27Å; V151-L155 WeakPolarHBondContact O-CG 3.24Å; V151-L155 PolarHBondContact O-N 2.98Å
152T90.6Very high87.9Confident0 Ų069.3 Ų69.30%035%0.354CS..Hα-helixtrans-58.6-45.7177.5-55.60000111.3F69 I72 T148 E149 V150 L156 M178F69-T152 WeakPolarHBondContact CB-OG1 3.34Å; F69-T152 WeakPolarHBondContact CD2-OG1 3.39Å; I72-T152 HydrophobicContact CB-CG2 4.48Å; I72-T152 HydrophobicContact CD1-CG2 3.62Å; T148-T152 WeakPolarHBondContact O-CB 3.33Å; T148-T152 PolarHBondContact O-N 3.48Å; T148-T152 PolarHBondContact O-OG1 3.46Å; E149-T152 PolarHBondContact O-N 3.32Å; V150-T152 PolarHBondContact O-N 2.74Å; T152-L156 VanDerWaalsContact O-CB 3.27Å; T152-L156 WeakPolarHBondContact O-CB 3.31Å; T152-L156 PolarHBondContact O-N 3.27Å; T152-M178 HydrophobicContact CG2-CE 3.61Å
153F89.7Confident86.7Confident76 Ų7670.5 Ų70.533%0.33336%0.357SS..Hα-helixtrans-64.2-45.2178.4178.5-99.5000112.5E149 V150 V151 L156 R157 M178 I182E149-F153 WeakPolarHBondContact O-CB 3.38Å; E149-F153 PolarHBondContact O-N 2.89Å; V150-F153 PolarHBondContact O-N 3Å; V151-F153 VanDerWaalsContact C-N 3.33Å; V151-F153 PolarHBondContact O-N 3.49Å; F153-L156 PolarHBondContact O-N 3.31Å; F153-R157 HydrophobicContact CE1-CG 4.15Å; F153-R157 HydrophobicContact CZ-CG 4.22Å; F153-R157 WeakPolarHBondContact O-CG 3.42Å; F153-R157 PolarHBondContact O-N 2.81Å; F153-M178 HydrophobicContact CB-SD 4.39Å; F153-M178 HydrophobicContact CD2-SD 4.09Å; F153-I182 HydrophobicContact CD2-CD1 3.77Å; F153-I182 HydrophobicContact CE2-CD1 4.36Å; F153-I182 HydrophobicContact CG-CD1 4.37Å
154L90.1Very high85.4Confident93 Ų9369.9 Ų69.949%0.48736%0.364SS..Hα-helixtrans-63.3-46.9178.4-72175.3000111.4V150 V151 L156 R157 L158V150-L154 HydrophobicContact CG1-CD1 3.9Å; V150-L154 HydrophobicContact CG1-CG 4.32Å; V150-L154 WeakPolarHBondContact O-CB 3.42Å; V150-L154 VanDerWaalsContact O-CG 3.27Å; V150-L154 WeakPolarHBondContact O-CG 3.43Å; V150-L154 PolarHBondContact O-N 2.9Å; V151-L154 PolarHBondContact O-N 3.5Å; L154-L156 VanDerWaalsContact C-N 3.33Å; L154-L156 PolarHBondContact O-N 2.83Å; L154-R157 WeakPolarHBondContact O-CB 3.21Å; L154-R157 PolarHBondContact O-N 3.19Å; L154-R157 VanDerWaalsContact O-N 3.16Å; L154-L158 WeakPolarHBondContact O-CG 3.28Å; L154-L158 PolarHBondContact O-N 2.74Å
155L86.8Confident84.2Confident56 Ų5669.3 Ų69.329%0.29337%0.372SS..Hα-helixtrans-67.4-33.6179.3-67.6172.9000112.5F69 H73 V151 R157 L158 N159F69-L155 HydrophobicContact CE2-CD1 4.22Å; H73-L155 WeakPolarHBondContact CE1-CB 3.27Å; H73-L155 VanDerWaalsContact NE2-CB 3.32Å; H73-L155 WeakPolarHBondContact NE2-CB 3.49Å; H73-L155 WeakPolarHBondContact NE2-CD1 3.18Å; V151-L155 HydrophobicContact CG1-CD1 3.65Å; V151-L155 HydrophobicContact CG1-CG 4.21Å; V151-L155 WeakPolarHBondContact O-CB 3.48Å; V151-L155 VanDerWaalsContact O-CG 3.27Å; V151-L155 WeakPolarHBondContact O-CG 3.24Å; V151-L155 PolarHBondContact O-N 2.98Å; L155-R157 VanDerWaalsContact C-N 3.33Å; L155-L158 PolarHBondContact O-N 3.26Å; L155-N159 WeakPolarHBondContact O-CB 3.31Å; L155-N159 PolarHBondContact O-N 3.46Å; L155-N159 PolarHBondContact O-ND2 3.07Å
156L84.6Confident82.7Confident16 Ų1673.7 Ų73.78%0.08440%0.395CS..Hα-helixtrans-62.7-41171.6176.365.6000111.4I72 T152 F153 L154 K160 I171 V175 M178I72-L156 HydrophobicContact CG2-CB 4.48Å; I72-L156 HydrophobicContact CG2-CD1 4.29Å; T152-L156 VanDerWaalsContact O-CB 3.27Å; T152-L156 WeakPolarHBondContact O-CB 3.31Å; T152-L156 PolarHBondContact O-N 3.27Å; F153-L156 PolarHBondContact O-N 3.31Å; L154-L156 VanDerWaalsContact C-N 3.33Å; L154-L156 PolarHBondContact O-N 2.83Å; L156-K160 PolarHBondContact O-N 3.04Å; L156-I171 HydrophobicContact CD1-CG2 3.82Å; L156-V175 HydrophobicContact CD1-CG2 4.36Å; L156-V175 HydrophobicContact CD2-CG2 3.76Å; L156-M178 HydrophobicContact CB-CE 4.42Å; L156-M178 HydrophobicContact CD2-CE 3.47Å; L156-M178 VanDerWaalsContact CD2-CE 3.47Å; L156-M178 HydrophobicContact CD2-SD 3.67Å
157R84.5Confident81.4Confident165 Ų16574.6 Ų74.662%0.62339%0.393SS*.Hα-helixtrans-64.4-44.8176.2-75.4-73.7-173.4164.62.9112F153 L154 L155F153-R157 HydrophobicContact CE1-CG 4.15Å; F153-R157 HydrophobicContact CZ-CG 4.22Å; F153-R157 WeakPolarHBondContact O-CG 3.42Å; F153-R157 PolarHBondContact O-N 2.81Å; L154-R157 WeakPolarHBondContact O-CB 3.21Å; L154-R157 PolarHBondContact O-N 3.19Å; L154-R157 VanDerWaalsContact O-N 3.16Å; L155-R157 VanDerWaalsContact C-N 3.33Å
158L84.2Confident80.3Confident131 Ų13172.4 Ų72.469%0.68638%0.382SS*.Hα-helixtrans-67.4-35.4-178.9-68.4173.1000112.7L154 L155L154-L158 WeakPolarHBondContact O-CG 3.28Å; L154-L158 PolarHBondContact O-N 2.74Å; L155-L158 PolarHBondContact O-N 3.26Å
159N79.9Confident79.3Confident50 Ų5075.8 Ų75.827%0.26740%0.399SS..Hα-helixtrans-91.80.1-175.7-70.5-56.9000114.6L155 S161 N162 Y163L155-N159 WeakPolarHBondContact O-CB 3.31Å; L155-N159 PolarHBondContact O-N 3.46Å; L155-N159 PolarHBondContact O-ND2 3.07Å; N159-S161 PolarHBondContact O-N 3.42Å; N159-N162 PolarHBondContact O-N 2.83Å; N159-Y163 VanDerWaalsContact C-CE2 3.43Å; N159-Y163 HydrophobicContact CB-CE2 3.81Å; N159-Y163 WeakPolarHBondContact CB-OH 3.47Å; N159-Y163 WeakPolarHBondContact O-CD2 3.4Å; N159-Y163 WeakPolarHBondContact O-CE2 3.34Å
160K72.1Confident78.3Confident143 Ų14379.5 Ų79.562%0.62242%0.416SS*.G310 helixtrans-52.2-33.5-172.3-171.2-176.5174.4-167.40113.7L156L156-K160 PolarHBondContact O-N 3.04Å
161S66.7Low77.2Confident101 Ų10177.4 Ų77.471%0.70640%0.402SS*.G310 helixtrans-77.5-18.8-179.557.90000114.8N159N159-S161 PolarHBondContact O-N 3.42Å
162N72.4Confident76.5Confident116 Ų11682.7 Ų82.762%0.6242%0.416SS*.G310 helixtrans-96.19.2-167.5-64-23.8000113.6N159N159-N162 PolarHBondContact O-N 2.83Å
163Y68.7Low75.7Confident31 Ų3192.1 Ų92.112%0.12245%0.452CS..  trans-99.1126.3-174.4-63-68.9000111.8N159 R167 I171N159-Y163 VanDerWaalsContact C-CE2 3.43Å; N159-Y163 HydrophobicContact CB-CE2 3.81Å; N159-Y163 WeakPolarHBondContact CB-OH 3.47Å; N159-Y163 WeakPolarHBondContact O-CD2 3.4Å; N159-Y163 WeakPolarHBondContact O-CE2 3.34Å; Y163-R167 HydrophobicContact CD1-CB 4.31Å; Y163-I171 HydrophobicContact CD1-CD1 3.16Å; Y163-I171 HydrophobicContact CD2-CD1 3.48Å; Y163-I171 VanDerWaalsContact CD2-CD1 3.48Å; Y163-I171 HydrophobicContact CE1-CD1 3.34Å; Y163-I171 HydrophobicContact CE2-CD1 3.65Å; Y163-I171 HydrophobicContact CG-CD1 3.22Å
164T69.6Low75Confident96 Ų9691.6 Ų91.659%0.58945%0.45SS*.  trans-55.3152.4169.5-41.40000111.3I166 R167 L168T164-I166 VanDerWaalsContact C-N 3.3Å; T164-I166 PolarHBondContact O-N 3.44Å; T164-I166 VanDerWaalsContact O-N 3.16Å; T164-R167 CarbonylContact O-C 3.53Å; T164-R167 WeakPolarHBondContact O-CA 3.4Å; T164-R167 WeakPolarHBondContact O-CB 3.41Å; T164-R167 PolarHBondContact O-N 2.94Å; T164-L168 PolarHBondContact O-N 2.88Å
165A69.6Low74.4Confident76 Ų7689.2 Ų89.263%0.62844%0.44SS*.Hα-helixtrans-48.8-44.4-177.500000114.3R167 L168 L169A165-R167 PolarHBondContact O-N 3.2Å; A165-L168 WeakPolarHBondContact O-CB 3.4Å; A165-L168 PolarHBondContact O-N 3.2Å; A165-L169 PolarHBondContact O-N 3.49Å
166I63.9Low74Confident97 Ų9789 Ų8950%0.49745%0.446SS..Hα-helixtrans-62.5-44.4176.1-60173.9000111.2T164 L168 L169 Q170T164-I166 VanDerWaalsContact C-N 3.3Å; T164-I166 PolarHBondContact O-N 3.44Å; T164-I166 VanDerWaalsContact O-N 3.16Å; I166-L168 VanDerWaalsContact C-N 3.27Å; I166-L168 PolarHBondContact O-N 3.44Å; I166-L169 PolarHBondContact O-N 3.27Å; I166-Q170 PolarHBondContact O-N 3.42Å
167R68.4Low73.6Confident63 Ų6391.5 Ų91.524%0.23846%0.462CS..Hα-helixtrans-65.4-32.9176.4-65-171.573.8-176.24.5111.4Y163 T164 A165 L169 Q170 I171Y163-R167 HydrophobicContact CD1-CB 4.31Å; T164-R167 CarbonylContact O-C 3.53Å; T164-R167 WeakPolarHBondContact O-CA 3.4Å; T164-R167 WeakPolarHBondContact O-CB 3.41Å; T164-R167 PolarHBondContact O-N 2.94Å; A165-R167 PolarHBondContact O-N 3.2Å; R167-L169 PolarHBondContact O-N 3.46Å; R167-Q170 PolarHBondContact O-N 2.63Å; R167-I171 HydrophobicContact CB-CD1 4.32Å; R167-I171 VanDerWaalsContact O-CB 3.26Å; R167-I171 WeakPolarHBondContact O-CB 3.32Å; R167-I171 VanDerWaalsContact O-CD1 3.27Å; R167-I171 WeakPolarHBondContact O-CD1 3.29Å; R167-I171 WeakPolarHBondContact O-CG1 3.14Å; R167-I171 PolarHBondContact O-N 3.28Å
168L72.1Confident73.5Confident57 Ų5783.8 Ų83.830%0.29843%0.433SS..Hα-helixtrans-62.8-40.7177.7-168.368.6000111.8T164 A165 I166 I171 R172T164-L168 PolarHBondContact O-N 2.88Å; A165-L168 WeakPolarHBondContact O-CB 3.4Å; A165-L168 PolarHBondContact O-N 3.2Å; I166-L168 VanDerWaalsContact C-N 3.27Å; I166-L168 PolarHBondContact O-N 3.44Å; L168-I171 PolarHBondContact O-N 3.4Å; L168-R172 WeakPolarHBondContact O-CG 3.47Å; L168-R172 PolarHBondContact O-N 2.98Å
169L72.5Confident73.4Confident94 Ų9484.4 Ų84.449%0.49243%0.43SS..Hα-helixtrans-65.2-46.8176.8-78.3169.6000112.4A165 I166 R167 I171 R172 R173A165-L169 PolarHBondContact O-N 3.49Å; I166-L169 PolarHBondContact O-N 3.27Å; R167-L169 PolarHBondContact O-N 3.46Å; L169-I171 VanDerWaalsContact C-N 3.32Å; L169-I171 PolarHBondContact O-N 2.94Å; L169-R172 PolarHBondContact O-N 2.9Å; L169-R173 PolarHBondContact O-N 2.92Å
170Q71.3Confident73.7Confident84 Ų8486.4 Ų86.439%0.39344%0.437SS..Hα-helixtrans-59.1-46.8174.7-70.3179.8-18.300110.5I166 R167 R172 R173 E174I166-Q170 PolarHBondContact O-N 3.42Å; R167-Q170 PolarHBondContact O-N 2.63Å; Q170-R172 VanDerWaalsContact C-N 3.33Å; Q170-R172 PolarHBondContact O-N 3.37Å; Q170-R173 PolarHBondContact O-N 2.89Å; Q170-R173 VanDerWaalsContact O-N 3.15Å; Q170-E174 WeakPolarHBondContact O-CG 3.36Å; Q170-E174 PolarHBondContact O-N 2.93Å
171I70.3Confident74.4Confident27 Ų2780.1 Ų80.114%0.13841%0.411CS..Hα-helixtrans-63.1-37.4179.9-70.5165000111.8L156 Y163 R167 L168 L169 R173 E174 V175L156-I171 HydrophobicContact CD1-CG2 3.82Å; Y163-I171 HydrophobicContact CD1-CD1 3.16Å; Y163-I171 HydrophobicContact CD2-CD1 3.48Å; Y163-I171 VanDerWaalsContact CD2-CD1 3.48Å; Y163-I171 HydrophobicContact CE1-CD1 3.34Å; Y163-I171 HydrophobicContact CE2-CD1 3.65Å; Y163-I171 HydrophobicContact CG-CD1 3.22Å; R167-I171 HydrophobicContact CB-CD1 4.32Å; R167-I171 VanDerWaalsContact O-CB 3.26Å; R167-I171 WeakPolarHBondContact O-CB 3.32Å; R167-I171 VanDerWaalsContact O-CD1 3.27Å; R167-I171 WeakPolarHBondContact O-CD1 3.29Å; R167-I171 WeakPolarHBondContact O-CG1 3.14Å; R167-I171 PolarHBondContact O-N 3.28Å; L168-I171 PolarHBondContact O-N 3.4Å; L169-I171 VanDerWaalsContact C-N 3.32Å; L169-I171 PolarHBondContact O-N 2.94Å; I171-R173 VanDerWaalsContact C-N 3.29Å; I171-R173 PolarHBondContact O-N 3.44Å; I171-E174 PolarHBondContact O-N 3.43Å; I171-V175 HydrophobicContact CG2-CG2 3.79Å; I171-V175 WeakPolarHBondContact O-CB 3.46Å; I171-V175 WeakPolarHBondContact O-CG2 3.37Å; I171-V175 PolarHBondContact O-N 3.29Å
172R78.2Confident75.5Confident165 Ų16577.5 Ų77.562%0.62339%0.389SS*.Hα-helixtrans-58.2-40.6175.8-79.4177.2-175.6-1772112.1L168 L169 Q170 A176L168-R172 WeakPolarHBondContact O-CG 3.47Å; L168-R172 PolarHBondContact O-N 2.98Å; L169-R172 PolarHBondContact O-N 2.9Å; Q170-R172 VanDerWaalsContact C-N 3.33Å; Q170-R172 PolarHBondContact O-N 3.37Å; R172-A176 PolarHBondContact O-N 3.43Å
173R75Confident76.3Confident198 Ų19874 Ų7475%0.74737%0.372SS*.Hα-helixtrans-68.1-45.1175.4-66.1-177.6-179.4177.31.6111.1L169 Q170 I171 V175 A176 V177L169-R173 PolarHBondContact O-N 2.92Å; Q170-R173 PolarHBondContact O-N 2.89Å; Q170-R173 VanDerWaalsContact O-N 3.15Å; I171-R173 VanDerWaalsContact C-N 3.29Å; I171-R173 PolarHBondContact O-N 3.44Å; R173-V175 VanDerWaalsContact C-N 3.35Å; R173-V175 PolarHBondContact O-N 3.29Å; R173-A176 WeakPolarHBondContact O-CB 3.3Å; R173-A176 PolarHBondContact O-N 2.83Å; R173-A176 VanDerWaalsContact O-N 3.12Å; R173-V177 PolarHBondContact O-N 2.76Å; R173-V177 VanDerWaalsContact O-N 3.14Å
174E74.4Confident77.2Confident64 Ų6473.7 Ų73.730%0.29937%0.372SS..Hα-helixtrans-64.8-35.5178.3-64.1-55.2150.200112.9I71 Q170 I171 A176 V177 M178I71-E174 HydrophobicContact CG2-CG 3.89Å; Q170-E174 WeakPolarHBondContact O-CG 3.36Å; Q170-E174 PolarHBondContact O-N 2.93Å; I171-E174 PolarHBondContact O-N 3.43Å; E174-A176 VanDerWaalsContact C-N 3.29Å; E174-A176 PolarHBondContact O-N 3.01Å; E174-V177 PolarHBondContact O-N 3.01Å; E174-M178 WeakPolarHBondContact O-CB 3.33Å; E174-M178 PolarHBondContact O-N 3.26Å
175V77.2Confident78.2Confident44 Ų4469.5 Ų69.527%0.26735%0.346SS..Hα-helixtrans-62-40173.3174.60000110.5L156 I171 R173 V177 M178 K179L156-V175 HydrophobicContact CD1-CG2 4.36Å; L156-V175 HydrophobicContact CD2-CG2 3.76Å; I171-V175 HydrophobicContact CG2-CG2 3.79Å; I171-V175 WeakPolarHBondContact O-CB 3.46Å; I171-V175 WeakPolarHBondContact O-CG2 3.37Å; I171-V175 PolarHBondContact O-N 3.29Å; R173-V175 VanDerWaalsContact C-N 3.35Å; R173-V175 PolarHBondContact O-N 3.29Å; V175-V177 VanDerWaalsContact C-N 3.32Å; V175-M178 PolarHBondContact O-N 3.31Å; V175-K179 WeakPolarHBondContact O-CG 3.36Å; V175-K179 PolarHBondContact O-N 2.98Å
176A78.1Confident79.2Confident51 Ų5170.2 Ų70.242%0.42134%0.338SS..Hα-helixtrans-65.6-37.3177.900000111.7R172 R173 E174 Q180R172-A176 PolarHBondContact O-N 3.43Å; R173-A176 WeakPolarHBondContact O-CB 3.3Å; R173-A176 PolarHBondContact O-N 2.83Å; R173-A176 VanDerWaalsContact O-N 3.12Å; E174-A176 VanDerWaalsContact C-N 3.29Å; E174-A176 PolarHBondContact O-N 3.01Å; A176-Q180 WeakPolarHBondContact O-CG 3.34Å
177V77Confident80.5Confident69 Ų6967.9 Ų67.942%0.41833%0.325SS..Hα-helixtrans-68.9-48.4173.8177.10000110.9R173 E174 V175 K179 Q180 T181R173-V177 PolarHBondContact O-N 2.76Å; R173-V177 VanDerWaalsContact O-N 3.14Å; E174-V177 PolarHBondContact O-N 3.01Å; V175-V177 VanDerWaalsContact C-N 3.32Å; V177-K179 VanDerWaalsContact C-N 3.32Å; V177-K179 PolarHBondContact O-N 2.89Å; V177-Q180 WeakPolarHBondContact O-CA 3.49Å; V177-Q180 WeakPolarHBondContact O-CB 3.24Å; V177-Q180 WeakPolarHBondContact O-CG 3.35Å; V177-Q180 PolarHBondContact O-N 3.27Å; V177-T181 PolarHBondContact O-N 3.28Å; V177-T181 VanDerWaalsContact O-N 3.07Å; V177-T181 PolarHBondContact O-OG1 2.91Å
178M80.9Confident81.5Confident3 Ų365.2 Ų65.22%0.01532%0.315CS..Hα-helixtrans-56.6-43.2178.2-180-165.4-68.500112.1I72 T152 F153 L156 E174 V175 Q180 T181 I182I72-M178 HydrophobicContact CD1-CE 2.93Å; I72-M178 HydrophobicContact CG1-CE 4.43Å; T152-M178 HydrophobicContact CG2-CE 3.61Å; F153-M178 HydrophobicContact CB-SD 4.39Å; F153-M178 HydrophobicContact CD2-SD 4.09Å; L156-M178 HydrophobicContact CB-CE 4.42Å; L156-M178 HydrophobicContact CD2-CE 3.47Å; L156-M178 VanDerWaalsContact CD2-CE 3.47Å; L156-M178 HydrophobicContact CD2-SD 3.67Å; E174-M178 WeakPolarHBondContact O-CB 3.33Å; E174-M178 PolarHBondContact O-N 3.26Å; V175-M178 PolarHBondContact O-N 3.31Å; M178-Q180 PolarHBondContact O-N 3.23Å; M178-Q180 VanDerWaalsContact O-N 3.16Å; M178-T181 CarbonylContact O-C 3.58Å; M178-T181 PolarHBondContact O-N 2.83Å; M178-I182 HydrophobicContact CG-CD1 3.92Å; M178-I182 HydrophobicContact CG-CG1 4.21Å; M178-I182 WeakPolarHBondContact O-CG1 3.39Å; M178-I182 PolarHBondContact O-N 2.87Å; M178-I182 HydrophobicContact SD-CD1 4.19Å
179K83.8Confident82.4Confident143 Ų14365.1 Ų65.162%0.62231%0.313SS*.Hα-helixtrans-54.8-35.6175.5-78.6-179.9179.6-175.90112V175 V177 V183V175-K179 WeakPolarHBondContact O-CG 3.36Å; V175-K179 PolarHBondContact O-N 2.98Å; V177-K179 VanDerWaalsContact C-N 3.32Å; V177-K179 PolarHBondContact O-N 2.89Å; K179-V183 WeakPolarHBondContact O-CG2 3.2Å; K179-V183 PolarHBondContact O-N 3.32Å
180Q85.4Confident83.3Confident92 Ų9263.9 Ų63.943%0.4331%0.306SS..Hα-helixtrans-73.4-40.7176.7-32.9-1621.600111.3A176 V177 M178 V183 L184 K233A176-Q180 WeakPolarHBondContact O-CG 3.34Å; V177-Q180 WeakPolarHBondContact O-CA 3.49Å; V177-Q180 WeakPolarHBondContact O-CB 3.24Å; V177-Q180 WeakPolarHBondContact O-CG 3.35Å; V177-Q180 PolarHBondContact O-N 3.27Å; M178-Q180 PolarHBondContact O-N 3.23Å; M178-Q180 VanDerWaalsContact O-N 3.16Å; Q180-V183 PolarHBondContact O-N 2.89Å; Q180-L184 PolarHBondContact O-N 3.36Å; Q180-K233 VanDerWaalsContact OE1-NZ 3.1Å
181T86Confident84.1Confident11 Ų1160 Ų607%0.06729%0.289CS..Hα-helixtrans-63.8-39.8177.2-51.40000112.1I64 N68 E149 V177 M178 V183 L184 V185I64-T181 HydrophobicContact CG2-CG2 3.61Å; N68-T181 VanDerWaalsContact ND2-CB 3.33Å; N68-T181 WeakPolarHBondContact ND2-CB 3.39Å; N68-T181 VanDerWaalsContact ND2-CG2 3.32Å; N68-T181 WeakPolarHBondContact ND2-CG2 3.43Å; N68-T181 PolarHBondContact ND2-OG1 3.37Å; E149-T181 WeakPolarHBondContact OE1-CG2 3.38Å; V177-T181 PolarHBondContact O-N 3.28Å; V177-T181 VanDerWaalsContact O-N 3.07Å; V177-T181 PolarHBondContact O-OG1 2.91Å; M178-T181 CarbonylContact O-C 3.58Å; M178-T181 PolarHBondContact O-N 2.83Å; T181-V183 VanDerWaalsContact C-N 3.32Å; T181-V183 PolarHBondContact O-N 3.06Å; T181-L184 WeakPolarHBondContact O-CB 3.4Å; T181-L184 PolarHBondContact O-N 3.35Å; T181-V185 HydrophobicContact CG2-CG2 4.02Å; T181-V185 WeakPolarHBondContact O-CB 3.37Å; T181-V185 VanDerWaalsContact O-CG2 3.24Å; T181-V185 WeakPolarHBondContact O-CG2 3.26Å; T181-V185 PolarHBondContact O-N 3.3Å
182I89.6Confident85Confident46 Ų4659.1 Ų59.124%0.23628%0.284CS..Hα-helixtrans-58.2-46.3175.6-69.9168.4000110.5F153 M178 L184 V185 I186F153-I182 HydrophobicContact CD2-CD1 3.77Å; F153-I182 HydrophobicContact CE2-CD1 4.36Å; F153-I182 HydrophobicContact CG-CD1 4.37Å; M178-I182 HydrophobicContact CG-CD1 3.92Å; M178-I182 HydrophobicContact CG-CG1 4.21Å; M178-I182 WeakPolarHBondContact O-CG1 3.39Å; M178-I182 PolarHBondContact O-N 2.87Å; M178-I182 HydrophobicContact SD-CD1 4.19Å; I182-L184 PolarHBondContact O-N 2.67Å; I182-V185 PolarHBondContact O-N 3.23Å; I182-I186 HydrophobicContact CG2-CD1 3.83Å; I182-I186 VanDerWaalsContact O-CG1 3.27Å; I182-I186 WeakPolarHBondContact O-CG1 3.32Å; I182-I186 PolarHBondContact O-N 3.42Å
183V89.4Confident85.7Confident44 Ų4451.4 Ų51.427%0.26726%0.255SS..Hα-helixtrans-60.1-47.7176.4174.70000110.5K179 Q180 T181 V185 I186 F187K179-V183 WeakPolarHBondContact O-CG2 3.2Å; K179-V183 PolarHBondContact O-N 3.32Å; Q180-V183 PolarHBondContact O-N 2.89Å; T181-V183 VanDerWaalsContact C-N 3.32Å; T181-V183 PolarHBondContact O-N 3.06Å; V183-V185 VanDerWaalsContact C-N 3.34Å; V183-V185 PolarHBondContact O-N 2.9Å; V183-I186 PolarHBondContact O-N 3.44Å; V183-F187 HydrophobicContact CG1-CD2 3.69Å; V183-F187 HydrophobicContact CG1-CE2 3.58Å; V183-F187 WeakPolarHBondContact O-CD2 3.26Å; V183-F187 PolarHBondContact O-N 2.86Å; V183-F187 VanDerWaalsContact O-N 3.09Å
184L88.8Confident86.4Confident24 Ų2444.5 Ų44.513%0.12623%0.234CC..Hα-helixtrans-56-48176.3-178.2158.4000111.6Y6 T61 Q180 T181 I182 I186 F187 V188 F226Y6-L184 HydrophobicContact CE1-CD1 4.26Å; Y6-L184 HydrophobicContact CE2-CD1 4.18Å; Y6-L184 HydrophobicContact CE2-CD2 3.95Å; Y6-L184 HydrophobicContact CE2-CG 4.25Å; T61-L184 HydrophobicContact CG2-CD2 3.68Å; Q180-L184 PolarHBondContact O-N 3.36Å; T181-L184 WeakPolarHBondContact O-CB 3.4Å; T181-L184 PolarHBondContact O-N 3.35Å; I182-L184 PolarHBondContact O-N 2.67Å; L184-I186 PolarHBondContact O-N 2.85Å; L184-F187 PolarHBondContact O-N 3.17Å; L184-V188 HydrophobicContact CD2-CG2 3.85Å; L184-V188 HydrophobicContact CG-CG2 4.43Å; L184-V188 WeakPolarHBondContact O-CB 3.34Å; L184-V188 VanDerWaalsContact O-CG2 3.32Å; L184-V188 WeakPolarHBondContact O-CG2 3.37Å; L184-V188 PolarHBondContact O-N 3.28Å; L184-F226 HydrophobicContact CB-CE2 3.85Å; L184-F226 HydrophobicContact CB-CZ 4.14Å; L184-F226 HydrophobicContact CD1-CE2 4.45Å; L184-F226 HydrophobicContact CD1-CZ 3.89Å; L184-F226 HydrophobicContact CG-CE2 4.02Å; L184-F226 HydrophobicContact CG-CZ 3.84Å
185V90.8Very high87.1Confident8 Ų841.9 Ų41.95%0.04822%0.223CC..Hα-helixtrans-65.5-38.6-177.2167.70000111.5T61 T145 V146 E149 T181 I182 V183 F189T61-V185 HydrophobicContact CG2-CG2 3.88Å; T145-V185 HydrophobicContact CG2-CG1 4.09Å; T145-V185 HydrophobicContact CG2-CG2 4.05Å; V146-V185 HydrophobicContact CG2-CG1 3.92Å; E149-V185 HydrophobicContact CG-CB 4.45Å; E149-V185 HydrophobicContact CG-CG1 4.31Å; E149-V185 HydrophobicContact CG-CG2 3.94Å; T181-V185 HydrophobicContact CG2-CG2 4.02Å; T181-V185 WeakPolarHBondContact O-CB 3.37Å; T181-V185 VanDerWaalsContact O-CG2 3.24Å; T181-V185 WeakPolarHBondContact O-CG2 3.26Å; T181-V185 PolarHBondContact O-N 3.3Å; I182-V185 PolarHBondContact O-N 3.23Å; V183-V185 VanDerWaalsContact C-N 3.34Å; V183-V185 PolarHBondContact O-N 2.9Å; V185-F189 WeakPolarHBondContact O-CB 3.44Å; V185-F189 PolarHBondContact O-N 3.19Å
186I91Very high87.7Confident90 Ų9039.9 Ų39.946%0.46221%0.211SC..Hα-helixtrans-61.4-48.2173.6-68.8165.1000110.6I182 V183 L184 F189 I190I182-I186 HydrophobicContact CG2-CD1 3.83Å; I182-I186 VanDerWaalsContact O-CG1 3.27Å; I182-I186 WeakPolarHBondContact O-CG1 3.32Å; I182-I186 PolarHBondContact O-N 3.42Å; V183-I186 PolarHBondContact O-N 3.44Å; L184-I186 PolarHBondContact O-N 2.85Å; I186-F189 PolarHBondContact O-N 3.2Å; I186-I190 HydrophobicContact CG2-CD1 4.13Å; I186-I190 WeakPolarHBondContact O-CG1 3.29Å; I186-I190 PolarHBondContact O-N 3Å; I186-I190 VanDerWaalsContact O-N 3.11Å
187F90.4Very high88.3Confident48 Ų4838.9 Ų38.921%0.21120%0.2CC..Hα-helixtrans-64.7-44.2179.3-81.7-70.5000112.2V183 L184 F189 I190 A191 A222 F225 F226V183-F187 HydrophobicContact CG1-CD2 3.69Å; V183-F187 HydrophobicContact CG1-CE2 3.58Å; V183-F187 WeakPolarHBondContact O-CD2 3.26Å; V183-F187 PolarHBondContact O-N 2.86Å; V183-F187 VanDerWaalsContact O-N 3.09Å; L184-F187 PolarHBondContact O-N 3.17Å; F187-F189 VanDerWaalsContact C-N 3.32Å; F187-F189 PolarHBondContact O-N 3.32Å; F187-I190 PolarHBondContact O-N 3.48Å; F187-A191 WeakPolarHBondContact O-CB 3.07Å; F187-A191 PolarHBondContact O-N 3.47Å; F187-A222 HydrophobicContact CD1-CB 4.33Å; F187-A222 WeakPolarHBondContact CD1-O 3.2Å; F187-F225 HydrophobicContact CE1-CB 3.74Å; F187-F225 HydrophobicContact CZ-CB 4.23Å; F187-F226 HydrophobicContact CB-CB 3.98Å; F187-F226 HydrophobicContact CB-CD2 3.96Å; F187-F226 HydrophobicContact CB-CG 4.19Å; F187-F226 HydrophobicContact CD1-CB 4.11Å; F187-F226 HydrophobicContact CD2-CB 4.18Å; F187-F226 AromaticContact CD2-CD2 3.7Å; F187-F226 HydrophobicContact CD2-CD2 3.7Å; F187-F226 HydrophobicContact CD2-CG 4.41Å; F187-F226 HydrophobicContact CE2-CD2 4.48Å; F187-F226 HydrophobicContact CG-CB 3.84Å; F187-F226 HydrophobicContact CG-CD2 4Å; F187-F226 HydrophobicContact CG-CG 4.33Å
188V90.2Very high88.9Confident7 Ų736.6 Ų36.64%0.04218%0.184CC..Hα-helixtrans-62.7-39.9176.1171.40000111Y6 T61 L184 I190 A191 Q192Y6-V188 HydrophobicContact CE2-CG2 3.94Å; T61-V188 HydrophobicContact CG2-CB 4.29Å; T61-V188 HydrophobicContact CG2-CG1 4.09Å; T61-V188 HydrophobicContact CG2-CG2 4.32Å; L184-V188 HydrophobicContact CD2-CG2 3.85Å; L184-V188 HydrophobicContact CG-CG2 4.43Å; L184-V188 WeakPolarHBondContact O-CB 3.34Å; L184-V188 VanDerWaalsContact O-CG2 3.32Å; L184-V188 WeakPolarHBondContact O-CG2 3.37Å; L184-V188 PolarHBondContact O-N 3.28Å; V188-I190 PolarHBondContact O-N 2.88Å; V188-A191 PolarHBondContact O-N 3.3Å; V188-Q192 HydrophobicContact CG1-CB 4.36Å; V188-Q192 WeakPolarHBondContact O-CA 3.31Å; V188-Q192 VanDerWaalsContact O-CB 3.27Å; V188-Q192 WeakPolarHBondContact O-CB 3.45Å; V188-Q192 PolarHBondContact O-N 3.07Å
189F90.8Very high89.2Confident55 Ų5539.5 Ų39.524%0.24120%0.196CC..Iπ-helixtrans-59.8-47.1177.5-178.5-97.6000111.6Y143 V146 V185 I186 F187 T193 V194Y143-F189 AromaticContact CD1-CE2 3.95Å; Y143-F189 HydrophobicContact CD1-CE2 3.95Å; Y143-F189 HydrophobicContact CD1-CZ 4.45Å; Y143-F189 AromaticContact CE1-CE2 3.79Å; Y143-F189 HydrophobicContact CE1-CE2 3.79Å; Y143-F189 AromaticContact CE1-CZ 3.92Å; Y143-F189 HydrophobicContact CE1-CZ 3.92Å; V146-F189 HydrophobicContact CG2-CB 4.14Å; V146-F189 HydrophobicContact CG2-CD2 3.46Å; V146-F189 VanDerWaalsContact CG2-CD2 3.46Å; V146-F189 HydrophobicContact CG2-CE2 4.09Å; V146-F189 HydrophobicContact CG2-CG 3.97Å; V185-F189 WeakPolarHBondContact O-CB 3.44Å; V185-F189 PolarHBondContact O-N 3.19Å; I186-F189 PolarHBondContact O-N 3.2Å; F187-F189 VanDerWaalsContact C-N 3.32Å; F187-F189 PolarHBondContact O-N 3.32Å; F189-T193 VanDerWaalsContact CD2-CB 3.45Å; F189-T193 HydrophobicContact CD2-CG2 3.63Å; F189-T193 HydrophobicContact CE2-CG2 3.49Å; F189-T193 VanDerWaalsContact CE2-CG2 3.49Å; F189-T193 HydrophobicContact CZ-CG2 4.43Å; F189-T193 WeakPolarHBondContact O-CA 3.47Å; F189-T193 WeakPolarHBondContact O-CB 3.25Å; F189-T193 PolarHBondContact O-N 3.43Å; F189-V194 HydrophobicContact CD1-CG2 4.21Å; F189-V194 HydrophobicContact CE1-CG2 3.92Å; F189-V194 HydrophobicContact CZ-CG2 4.5Å; F189-V194 PolarHBondContact O-N 2.96Å
190I90.3Very high89.3Confident68 Ų6835.8 Ų35.835%0.34918%0.18SC..Iπ-helixtrans-67.2-40.8176.5-63.1168.1000111.1I186 F187 V188 P195 A222I186-I190 HydrophobicContact CG2-CD1 4.13Å; I186-I190 WeakPolarHBondContact O-CG1 3.29Å; I186-I190 PolarHBondContact O-N 3Å; I186-I190 VanDerWaalsContact O-N 3.11Å; F187-I190 PolarHBondContact O-N 3.48Å; V188-I190 PolarHBondContact O-N 2.88Å; I190-P195 VanDerWaalsContact O-CD 3.25Å; I190-P195 WeakPolarHBondContact O-CD 3.46Å; I190-A222 HydrophobicContact CB-CB 4.32Å; I190-A222 HydrophobicContact CG2-CB 3.93Å
191A88.4Confident89.3Confident4 Ų434.6 Ų34.63%0.03318%0.176CC..Iπ-helixtrans-80.9-20-172.800000114.4F187 V188 P195 S219 A222 Y223F187-A191 WeakPolarHBondContact O-CB 3.07Å; F187-A191 PolarHBondContact O-N 3.47Å; V188-A191 PolarHBondContact O-N 3.3Å; A191-P195 WeakPolarHBondContact O-CG 3.45Å; A191-S219 WeakPolarHBondContact O-CB 3.49Å; A191-A222 HydrophobicContact CB-CB 3.77Å; A191-Y223 HydrophobicContact CB-CD1 3.89Å; A191-Y223 HydrophobicContact CB-CD2 3.93Å; A191-Y223 HydrophobicContact CB-CE1 3.62Å; A191-Y223 HydrophobicContact CB-CE2 3.64Å; A191-Y223 HydrophobicContact CB-CG 4.04Å; A191-Y223 VanDerWaalsContact CB-CZ 3.48Å; A191-Y223 PolarHBondContact O-OH 3.26Å
192Q89.9Confident89.2Confident8 Ų835 Ų354%0.03718%0.178CC..Iπ-helixtrans-133.1-54.2-173.4-172.917927.200112.8E54 L57 V188 V194 P195 N196E54-Q192 PolarHBondContact O-NE2 3.2Å; L57-Q192 HydrophobicContact CD2-CB 4.45Å; V188-Q192 HydrophobicContact CG1-CB 4.36Å; V188-Q192 WeakPolarHBondContact O-CA 3.31Å; V188-Q192 VanDerWaalsContact O-CB 3.27Å; V188-Q192 WeakPolarHBondContact O-CB 3.45Å; V188-Q192 PolarHBondContact O-N 3.07Å; Q192-V194 PolarHBondContact O-N 3.27Å; Q192-P195 WeakPolarHBondContact O-CD 3.2Å; Q192-N196 WeakPolarHBondContact CG-ND2 3.48Å; Q192-N196 WeakPolarHBondContact O-CB 3.42Å; Q192-N196 PolarHBondContact O-N 2.79Å; Q192-N196 PolarHBondContact O-ND2 3.11Å
193T91.7Very high88.8Confident3 Ų333.9 Ų33.92%0.01817%0.173CC..Iπ-helixtrans-66.8-41.6-173.9-49.80000112G142 Y143 F189 N196 T197G142-T193 WeakPolarHBondContact CA-OG1 3.31Å; Y143-T193 HydrophobicContact CD2-CG2 4.28Å; Y143-T193 HydrophobicContact CE2-CG2 4.14Å; F189-T193 VanDerWaalsContact CD2-CB 3.45Å; F189-T193 HydrophobicContact CD2-CG2 3.63Å; F189-T193 HydrophobicContact CE2-CG2 3.49Å; F189-T193 VanDerWaalsContact CE2-CG2 3.49Å; F189-T193 HydrophobicContact CZ-CG2 4.43Å; F189-T193 WeakPolarHBondContact O-CA 3.47Å; F189-T193 WeakPolarHBondContact O-CB 3.25Å; F189-T193 PolarHBondContact O-N 3.43Å; T193-N196 PolarHBondContact O-N 3.13Å; T193-T197 WeakPolarHBondContact O-CB 3.43Å; T193-T197 PolarHBondContact O-N 3.45Å; T193-T197 PolarHBondContact O-OG1 3.4Å
194V90.3Very high88.5Confident52 Ų5236.4 Ų36.432%0.31518%0.184SC..Hα-helixtrans-62.1-51.9174.7171.10000111F189 Q192 N196 T197 Y198F189-V194 HydrophobicContact CD1-CG2 4.21Å; F189-V194 HydrophobicContact CE1-CG2 3.92Å; F189-V194 HydrophobicContact CZ-CG2 4.5Å; F189-V194 PolarHBondContact O-N 2.96Å; Q192-V194 PolarHBondContact O-N 3.27Å; V194-N196 VanDerWaalsContact C-N 3.34Å; V194-N196 PolarHBondContact O-N 2.94Å; V194-T197 PolarHBondContact O-N 3.3Å; V194-Y198 PolarHBondContact O-N 2.88Å
195P90.1Very high88.1Confident10 Ų1038.3 Ų38.37%0.06521%0.21CC..Hα-helixtrans-56.6-41173.1-25.728.3000115.3I190 A191 Q192 T197 Y198 K199 V215I190-P195 VanDerWaalsContact O-CD 3.25Å; I190-P195 WeakPolarHBondContact O-CD 3.46Å; A191-P195 WeakPolarHBondContact O-CG 3.45Å; Q192-P195 WeakPolarHBondContact O-CD 3.2Å; P195-T197 VanDerWaalsContact C-N 3.34Å; P195-Y198 PolarHBondContact O-N 2.72Å; P195-K199 WeakPolarHBondContact O-CG 3.35Å; P195-K199 PolarHBondContact O-N 2.91Å; P195-V215 HydrophobicContact CB-CG1 3.44Å; P195-V215 VanDerWaalsContact CB-CG1 3.44Å; P195-V215 HydrophobicContact CG-CG1 3.61Å
196N89.6Confident87.6Confident2 Ų246 Ų461%0.01124%0.239CC..Hα-helixtrans-68.4-36.5179.2-70.8-19000111.9F135 L138 A139 Q192 T193 V194 K199 F200F135-N196 HydrophobicContact CD1-CB 4.5Å; L138-N196 HydrophobicContact CB-CB 4.48Å; L138-N196 WeakPolarHBondContact CB-ND2 3.27Å; A139-N196 HydrophobicContact CB-CB 4.4Å; Q192-N196 WeakPolarHBondContact CG-ND2 3.48Å; Q192-N196 WeakPolarHBondContact O-CB 3.42Å; Q192-N196 PolarHBondContact O-N 2.79Å; Q192-N196 PolarHBondContact O-ND2 3.11Å; T193-N196 PolarHBondContact O-N 3.13Å; V194-N196 VanDerWaalsContact C-N 3.34Å; V194-N196 PolarHBondContact O-N 2.94Å; N196-K199 PolarHBondContact O-N 2.89Å; N196-F200 WeakPolarHBondContact O-CB 3.42Å; N196-F200 PolarHBondContact O-N 3.46Å
197T90.4Very high87Confident30 Ų3046.8 Ų46.818%0.18424%0.24CC..Hα-helixtrans-63.8-43.6172.1-54.50000110.5Y143 T193 V194 P195 F200 I201Y143-T197 PolarHBondContact OH-OG1 3.24Å; T193-T197 WeakPolarHBondContact O-CB 3.43Å; T193-T197 PolarHBondContact O-N 3.45Å; T193-T197 PolarHBondContact O-OG1 3.4Å; V194-T197 PolarHBondContact O-N 3.3Å; P195-T197 VanDerWaalsContact C-N 3.34Å; T197-F200 WeakPolarHBondContact O-CB 3.21Å; T197-F200 PolarHBondContact O-N 3.49Å; T197-I201 HydrophobicContact CG2-CD1 4.14Å; T197-I201 WeakPolarHBondContact O-CG1 3.26Å; T197-I201 PolarHBondContact O-N 3.03Å
198Y89.7Confident86.6Confident20 Ų2046.2 Ų46.28%0.07824%0.243CC..Hα-helixtrans-62.1-46.8174.8174.3-103.5000112.1V194 P195 F200 I201 D202 S208 W211 D212 V215V194-Y198 PolarHBondContact O-N 2.88Å; P195-Y198 PolarHBondContact O-N 2.72Å; Y198-F200 PolarHBondContact O-N 2.9Å; Y198-I201 CarbonylContact O-C 3.57Å; Y198-I201 WeakPolarHBondContact O-CA 3.32Å; Y198-I201 PolarHBondContact O-N 2.87Å; Y198-D202 HydrophobicContact CE1-CB 4.48Å; Y198-D202 PolarHBondContact O-N 2.79Å; Y198-S208 PolarHBondContact OH-O 2.9Å; Y198-W211 HydrophobicContact CD2-CB 4Å; Y198-W211 HydrophobicContact CE2-CB 3.33Å; Y198-W211 HydrophobicContact CE2-CG 4.25Å; Y198-D212 HydrophobicContact CE1-CB 3.95Å; Y198-D212 PolarHBondContact OH-N 3.38Å; Y198-V215 HydrophobicContact CD1-CB 4.4Å; Y198-V215 HydrophobicContact CD1-CG1 4.34Å; Y198-V215 HydrophobicContact CD1-CG2 4.17Å; Y198-V215 HydrophobicContact CD2-CG2 4.44Å; Y198-V215 HydrophobicContact CG-CG2 3.91Å
199K86.6Confident86.1Confident65 Ų6549.9 Ų49.928%0.28327%0.265SS..Hα-helixtrans-59.2-36.2176.6-72.1176.5-174.8174.40112.1E54 F135 P195 N196 N203E54-K199 IonicContact OE1-NZ 3.48Å; E54-K199 PolarHBondContact OE1-NZ 3.37Å; F135-K199 HydrophobicContact CD1-CB 4.28Å; F135-K199 HydrophobicContact CD1-CD 3.72Å; F135-K199 HydrophobicContact CD2-CB 4.06Å; F135-K199 HydrophobicContact CD2-CD 4.35Å; F135-K199 HydrophobicContact CE1-CD 3.36Å; F135-K199 HydrophobicContact CE2-CB 4.39Å; F135-K199 HydrophobicContact CE2-CD 4.03Å; F135-K199 HydrophobicContact CG-CB 4.03Å; F135-K199 HydrophobicContact CG-CD 4.24Å; F135-K199 HydrophobicContact CZ-CD 3.54Å; P195-K199 WeakPolarHBondContact O-CG 3.35Å; P195-K199 PolarHBondContact O-N 2.91Å; N196-K199 PolarHBondContact O-N 2.89Å; K199-N203 WeakPolarHBondContact O-CB 3.32Å; K199-N203 PolarHBondContact O-N 3.24Å; K199-N203 PolarHBondContact O-ND2 3.48Å; K199-N203 VanDerWaalsContact O-ND2 3.16Å
200F85.6Confident85.7Confident65 Ų6554.1 Ų54.129%0.28528%0.283SS..Hα-helixtrans-63.5-45.9171.9168.8-102000111.7V132 T136 N196 T197 Y198 N203 L204V132-F200 HydrophobicContact CG1-CD2 4.2Å; V132-F200 HydrophobicContact CG1-CE2 4.05Å; T136-F200 WeakPolarHBondContact OG1-CD2 3.34Å; T136-F200 WeakPolarHBondContact OG1-CE2 3.46Å; N196-F200 WeakPolarHBondContact O-CB 3.42Å; N196-F200 PolarHBondContact O-N 3.46Å; T197-F200 WeakPolarHBondContact O-CB 3.21Å; T197-F200 PolarHBondContact O-N 3.49Å; Y198-F200 PolarHBondContact O-N 2.9Å; F200-N203 WeakPolarHBondContact O-CB 3.48Å; F200-N203 PolarHBondContact O-N 2.86Å; F200-L204 HydrophobicContact CD1-CD1 4.4Å; F200-L204 HydrophobicContact CE1-CD1 3.76Å; F200-L204 HydrophobicContact CZ-CD1 3.89Å; F200-L204 HydrophobicContact CZ-CG 4.41Å; F200-L204 PolarHBondContact O-N 3.33Å
201I86.7Confident85.3Confident67 Ų6757.2 Ų57.234%0.34429%0.291SS..Hα-helixtrans-65.5-39176.9-66165.8000111.8T197 Y198 N203 L204 Y206T197-I201 HydrophobicContact CG2-CD1 4.14Å; T197-I201 WeakPolarHBondContact O-CG1 3.26Å; T197-I201 PolarHBondContact O-N 3.03Å; Y198-I201 CarbonylContact O-C 3.57Å; Y198-I201 WeakPolarHBondContact O-CA 3.32Å; Y198-I201 PolarHBondContact O-N 2.87Å; I201-N203 VanDerWaalsContact C-N 3.29Å; I201-N203 PolarHBondContact O-N 3.38Å; I201-L204 WeakPolarHBondContact O-CA 3.44Å; I201-L204 WeakPolarHBondContact O-CB 3.31Å; I201-L204 PolarHBondContact O-N 3.28Å; I201-Y206 HydrophobicContact CG2-CD2 4.37Å; I201-Y206 HydrophobicContact CG2-CG 4.4Å
202D83.8Confident85Confident20 Ų2060.1 Ų60.111%0.10731%0.305CS..Hα-helixtrans-58.8-43.3174.3-171.548.4000110.5K123 Y198 L204 G205 H207K123-D202 IonicContact NZ-OD2 2.82Å; K123-D202 PolarHBondContact NZ-OD2 3.1Å; Y198-D202 HydrophobicContact CE1-CB 4.48Å; Y198-D202 PolarHBondContact O-N 2.79Å; D202-L204 PolarHBondContact O-N 3.49Å; D202-G205 PolarHBondContact O-N 2.93Å; D202-H207 VanDerWaalsContact OD1-CA 3.26Å; D202-H207 WeakPolarHBondContact OD1-CA 3.33Å; D202-H207 VanDerWaalsContact OD1-CB 3.32Å; D202-H207 WeakPolarHBondContact OD1-CB 3.22Å; D202-H207 IonicContact OD1-CD2 3.89Å; D202-H207 PolarHBondContact OD1-CD2 3.44Å; D202-H207 IonicContact OD1-CG 3.05Å; D202-H207 IonicContact OD2-CD2 3.54Å
203N81.1Confident84.6Confident22 Ų2267.9 Ų67.912%0.11834%0.335CS..Hα-helixtrans-64.2-18.7173.4-73.7-26.6000113.2Y128 V132 K199 F200 I201 G205Y128-N203 HydrophobicContact CD2-CB 4.44Å; Y128-N203 HydrophobicContact CE2-CB 3.69Å; Y128-N203 WeakPolarHBondContact CE2-O 3.3Å; Y128-N203 VanDerWaalsContact CZ-O 3.32Å; Y128-N203 PolarHBondContact OH-O 3.22Å; V132-N203 HydrophobicContact CG2-CB 3.77Å; K199-N203 WeakPolarHBondContact O-CB 3.32Å; K199-N203 PolarHBondContact O-N 3.24Å; K199-N203 PolarHBondContact O-ND2 3.48Å; K199-N203 VanDerWaalsContact O-ND2 3.16Å; F200-N203 WeakPolarHBondContact O-CB 3.48Å; F200-N203 PolarHBondContact O-N 2.86Å; I201-N203 VanDerWaalsContact C-N 3.29Å; I201-N203 PolarHBondContact O-N 3.38Å; N203-G205 PolarHBondContact O-N 3.41Å
204L82.3Confident84.3Confident96 Ų9673 Ų7350%0.50336%0.356SS..THydrogen-bonded Turntrans-83.21.2172.4-63.4176.4000113.2F200 I201 D202 Y206F200-L204 HydrophobicContact CD1-CD1 4.4Å; F200-L204 HydrophobicContact CE1-CD1 3.76Å; F200-L204 HydrophobicContact CZ-CD1 3.89Å; F200-L204 HydrophobicContact CZ-CG 4.41Å; F200-L204 PolarHBondContact O-N 3.33Å; I201-L204 WeakPolarHBondContact O-CA 3.44Å; I201-L204 WeakPolarHBondContact O-CB 3.31Å; I201-L204 PolarHBondContact O-N 3.28Å; D202-L204 PolarHBondContact O-N 3.49Å; L204-Y206 HydrophobicContact CB-CD2 4.3Å
205G80.4Confident84.1Confident65 Ų6571 Ų7167%0.6735%0.345SS*.THydrogen-bonded Turntrans1011.6177.100000114.5D202 N203 H207D202-G205 PolarHBondContact O-N 2.93Å; N203-G205 PolarHBondContact O-N 3.41Å; G205-H207 PolarHBondContact O-N 2.96Å
206Y81Confident83.7Confident170 Ų17071.5 Ų71.567%0.66735%0.349SS*.  trans-90.673.1177.2-67.1-85.3000110.9I201 L204I201-Y206 HydrophobicContact CG2-CD2 4.37Å; I201-Y206 HydrophobicContact CG2-CG 4.4Å; L204-Y206 HydrophobicContact CB-CD2 4.3Å
207H77Confident83.5Confident105 Ų10576 Ų7649%0.48638%0.376SS..  trans-87.1124.7178.4-175.2-84.5000111.6D202 G205D202-H207 VanDerWaalsContact OD1-CA 3.26Å; D202-H207 WeakPolarHBondContact OD1-CA 3.33Å; D202-H207 VanDerWaalsContact OD1-CB 3.32Å; D202-H207 WeakPolarHBondContact OD1-CB 3.22Å; D202-H207 IonicContact OD1-CD2 3.89Å; D202-H207 PolarHBondContact OD1-CD2 3.44Å; D202-H207 IonicContact OD1-CG 3.05Å; D202-H207 IonicContact OD2-CD2 3.54Å; G205-H207 PolarHBondContact O-N 2.96Å
208S82.1Confident83.3Confident37 Ų3775.9 Ų75.926%0.25938%0.376SS..  trans-140.5120173.353.70000111.2Y198 F210 W211 D212Y198-S208 PolarHBondContact OH-O 2.9Å; S208-F210 PolarHBondContact O-N 3.46Å; S208-W211 PolarHBondContact O-N 3.21Å; S208-W211 VanDerWaalsContact O-N 3.11Å; S208-W211 VanDerWaalsContact OG-CB 3.31Å; S208-W211 WeakPolarHBondContact OG-CB 3.48Å; S208-D212 PolarHBondContact O-N 2.98Å; S208-D212 VanDerWaalsContact O-N 3.07Å
209V79.4Confident83.2Confident83 Ų8375.8 Ų75.850%0.50338%0.378SS..Hα-helixtrans-58.8-34.7-177.8-179.80000111.5R213V209-R213 WeakPolarHBondContact O-CG 3.31Å; V209-R213 PolarHBondContact O-N 3.07Å; V209-R213 VanDerWaalsContact O-N 3.13Å
210F82.4Confident83.1Confident145 Ų14575.5 Ų75.564%0.63638%0.379SS*.Hα-helixtrans-60.3-49.9176.1176.8-98000111.9S208 R213 F214S208-F210 PolarHBondContact O-N 3.46Å; F210-R213 PolarHBondContact O-N 3.16Å; F210-F214 VanDerWaalsContact O-CB 3.31Å; F210-F214 WeakPolarHBondContact O-CB 3.4Å; F210-F214 PolarHBondContact O-N 2.96Å
211W82.5Confident83.2Confident133 Ų13374.1 Ų74.150%0.50438%0.38SS..Hα-helixtrans-69.7-38.5-178.2-76.799.1000112.1Y198 S208 R213 F214 V215Y198-W211 HydrophobicContact CD2-CB 4Å; Y198-W211 HydrophobicContact CE2-CB 3.33Å; Y198-W211 HydrophobicContact CE2-CG 4.25Å; S208-W211 PolarHBondContact O-N 3.21Å; S208-W211 VanDerWaalsContact O-N 3.11Å; S208-W211 VanDerWaalsContact OG-CB 3.31Å; S208-W211 WeakPolarHBondContact OG-CB 3.48Å; W211-R213 VanDerWaalsContact C-N 3.34Å; W211-R213 PolarHBondContact O-N 3.46Å; W211-F214 HydrophobicContact CE3-CD1 4.07Å; W211-F214 HydrophobicContact CZ3-CD1 4.04Å; W211-F214 HydrophobicContact CZ3-CE1 4.26Å; W211-F214 PolarHBondContact O-N 3.47Å; W211-V215 VanDerWaalsContact O-CB 3.24Å; W211-V215 WeakPolarHBondContact O-CB 3.37Å; W211-V215 WeakPolarHBondContact O-CG2 3.44Å; W211-V215 PolarHBondContact O-N 3.4Å
212D81.3Confident83.3Confident64 Ų6471.2 Ų71.234%0.34237%0.366SS..Hα-helixtrans-58.3-46.6175.2-176.262.4000111.8Y198 S208 S216Y198-D212 HydrophobicContact CE1-CB 3.95Å; Y198-D212 PolarHBondContact OH-N 3.38Å; S208-D212 PolarHBondContact O-N 2.98Å; S208-D212 VanDerWaalsContact O-N 3.07Å; D212-S216 WeakPolarHBondContact O-CB 3.23Å; D212-S216 PolarHBondContact O-N 3.22Å
213R83.2Confident83.2Confident172 Ų17272 Ų7265%0.64937%0.367SS*.Hα-helixtrans-65.3-44.8175.3-71.8-178178.7-173.50.3112.2V209 F210 W211 V215 S216 V217V209-R213 WeakPolarHBondContact O-CG 3.31Å; V209-R213 PolarHBondContact O-N 3.07Å; V209-R213 VanDerWaalsContact O-N 3.13Å; F210-R213 PolarHBondContact O-N 3.16Å; W211-R213 VanDerWaalsContact C-N 3.34Å; W211-R213 PolarHBondContact O-N 3.46Å; R213-V215 PolarHBondContact O-N 3.05Å; R213-S216 PolarHBondContact O-N 3Å; R213-V217 WeakPolarHBondContact O-CB 3.26Å; R213-V217 VanDerWaalsContact O-CG2 3.32Å; R213-V217 WeakPolarHBondContact O-CG2 3.29Å; R213-V217 PolarHBondContact O-N 3.42Å
214F85.1Confident83.4Confident109 Ų10973.8 Ų73.848%0.47838%0.382SS..Hα-helixtrans-58.9-49.5179.4178.6-98.8000111.3F210 W211 S216 V217 S218F210-F214 VanDerWaalsContact O-CB 3.31Å; F210-F214 WeakPolarHBondContact O-CB 3.4Å; F210-F214 PolarHBondContact O-N 2.96Å; W211-F214 HydrophobicContact CE3-CD1 4.07Å; W211-F214 HydrophobicContact CZ3-CD1 4.04Å; W211-F214 HydrophobicContact CZ3-CE1 4.26Å; W211-F214 PolarHBondContact O-N 3.47Å; F214-S216 VanDerWaalsContact C-N 3.34Å; F214-S216 PolarHBondContact O-N 3.27Å; F214-V217 PolarHBondContact O-N 2.98Å; F214-S218 VanDerWaalsContact O-CB 3.31Å; F214-S218 WeakPolarHBondContact O-CB 3.19Å; F214-S218 PolarHBondContact O-N 2.88Å; F214-S218 PolarHBondContact O-OG 2.84Å
215V86Confident83.8Confident11 Ų1175.3 Ų75.37%0.06739%0.385CS..Hα-helixtrans-62.6-40.2178167.90000111.6P195 Y198 W211 R213 S218 S219P195-V215 HydrophobicContact CB-CG1 3.44Å; P195-V215 VanDerWaalsContact CB-CG1 3.44Å; P195-V215 HydrophobicContact CG-CG1 3.61Å; Y198-V215 HydrophobicContact CD1-CB 4.4Å; Y198-V215 HydrophobicContact CD1-CG1 4.34Å; Y198-V215 HydrophobicContact CD1-CG2 4.17Å; Y198-V215 HydrophobicContact CD2-CG2 4.44Å; Y198-V215 HydrophobicContact CG-CG2 3.91Å; W211-V215 VanDerWaalsContact O-CB 3.24Å; W211-V215 WeakPolarHBondContact O-CB 3.37Å; W211-V215 WeakPolarHBondContact O-CG2 3.44Å; W211-V215 PolarHBondContact O-N 3.4Å; R213-V215 PolarHBondContact O-N 3.05Å; V215-S218 WeakPolarHBondContact CA-OG 3.32Å; V215-S218 PolarHBondContact O-OG 3.28Å; V215-S218 VanDerWaalsContact O-OG 3.05Å; V215-S219 WeakPolarHBondContact O-CB 3.26Å; V215-S219 PolarHBondContact O-N 2.9Å; V215-S219 PolarHBondContact O-OG 3.27Å
216S81.1Confident84Confident21 Ų2173.4 Ų73.415%0.14736%0.358CS..Hα-helixtrans-66-42.4175.5-177.20000112.5R24 D212 R213 F214 S219 I220R24-S216 PolarHBondContact NH1-OG 2.85Å; D212-S216 WeakPolarHBondContact O-CB 3.23Å; D212-S216 PolarHBondContact O-N 3.22Å; R213-S216 PolarHBondContact O-N 3Å; F214-S216 VanDerWaalsContact C-N 3.34Å; F214-S216 PolarHBondContact O-N 3.27Å; S216-S219 PolarHBondContact O-OG 2.97Å; S216-I220 WeakPolarHBondContact O-CD1 3.41Å; S216-I220 VanDerWaalsContact O-CG1 3.26Å; S216-I220 WeakPolarHBondContact O-CG1 3.03Å; S216-I220 PolarHBondContact O-N 3.25Å
217V86Confident84.2Confident97 Ų9767.5 Ų67.559%0.58834%0.344SS*.Hα-helixtrans-70.9-42.1179.6171.90000110.3R213 F214 S219 I220 A221R213-V217 WeakPolarHBondContact O-CB 3.26Å; R213-V217 VanDerWaalsContact O-CG2 3.32Å; R213-V217 WeakPolarHBondContact O-CG2 3.29Å; R213-V217 PolarHBondContact O-N 3.42Å; F214-V217 PolarHBondContact O-N 2.98Å; V217-S219 VanDerWaalsContact C-N 3.32Å; V217-S219 PolarHBondContact O-N 3.45Å; V217-I220 PolarHBondContact O-N 3.29Å; V217-A221 VanDerWaalsContact O-CB 3.28Å; V217-A221 WeakPolarHBondContact O-CB 3.27Å; V217-A221 PolarHBondContact O-N 3.45Å
218S86.9Confident84.7Confident26 Ų2667.2 Ų67.218%0.18235%0.346CS..Hα-helixtrans-63.4-38.7179.670.90000111.9F214 V215 A222F214-S218 VanDerWaalsContact O-CB 3.31Å; F214-S218 WeakPolarHBondContact O-CB 3.19Å; F214-S218 PolarHBondContact O-N 2.88Å; F214-S218 PolarHBondContact O-OG 2.84Å; V215-S218 WeakPolarHBondContact CA-OG 3.32Å; V215-S218 PolarHBondContact O-OG 3.28Å; V215-S218 VanDerWaalsContact O-OG 3.05Å; S218-A222 WeakPolarHBondContact O-CB 3.2Å; S218-A222 PolarHBondContact O-N 3.44Å
219S85.7Confident84.9Confident18 Ų1869 Ų6913%0.12635%0.35CS..Hα-helixtrans-67.8-45.717751.80000112.7A191 V215 S216 V217 A221 A222 Y223A191-S219 WeakPolarHBondContact O-CB 3.49Å; V215-S219 WeakPolarHBondContact O-CB 3.26Å; V215-S219 PolarHBondContact O-N 2.9Å; V215-S219 PolarHBondContact O-OG 3.27Å; S216-S219 PolarHBondContact O-OG 2.97Å; V217-S219 VanDerWaalsContact C-N 3.32Å; V217-S219 PolarHBondContact O-N 3.45Å; S219-A221 VanDerWaalsContact C-N 3.33Å; S219-A221 PolarHBondContact O-N 3.46Å; S219-A222 PolarHBondContact O-N 3.44Å; S219-Y223 WeakPolarHBondContact O-CD2 3.37Å; S219-Y223 PolarHBondContact O-N 3.31Å
220I85.7Confident85.1Confident60 Ų6067.8 Ų67.831%0.30834%0.343SS..Hα-helixtrans-60.6-45.3175.2-65.9165.8000110.5V17 S216 V217 Y223 S224V17-I220 HydrophobicContact CG1-CG1 4.49Å; S216-I220 WeakPolarHBondContact O-CD1 3.41Å; S216-I220 VanDerWaalsContact O-CG1 3.26Å; S216-I220 WeakPolarHBondContact O-CG1 3.03Å; S216-I220 PolarHBondContact O-N 3.25Å; V217-I220 PolarHBondContact O-N 3.29Å; I220-Y223 PolarHBondContact O-N 2.89Å; I220-S224 WeakPolarHBondContact O-CB 3.23Å; I220-S224 PolarHBondContact O-N 3.45Å; I220-S224 PolarHBondContact O-OG 3.41Å
221A87.6Confident85.4Confident35 Ų3565.5 Ų65.529%0.28934%0.336SS..Hα-helixtrans-60.5-47.9177.200000111V217 S219 Y223 S224 F225V217-A221 VanDerWaalsContact O-CB 3.28Å; V217-A221 WeakPolarHBondContact O-CB 3.27Å; V217-A221 PolarHBondContact O-N 3.45Å; S219-A221 VanDerWaalsContact C-N 3.33Å; S219-A221 PolarHBondContact O-N 3.46Å; A221-Y223 PolarHBondContact O-N 3.16Å; A221-S224 PolarHBondContact O-N 3.32Å; A221-F225 HydrophobicContact CB-CD2 4.26Å; A221-F225 HydrophobicContact CB-CE2 4.16Å; A221-F225 WeakPolarHBondContact O-CB 3.28Å; A221-F225 WeakPolarHBondContact O-CD2 3.39Å; A221-F225 PolarHBondContact O-N 2.79Å
222A88Confident85.7Confident6 Ų663.5 Ų63.55%0.0534%0.338CS..Hα-helixtrans-60.4-45.7179.900000112.6F187 I190 A191 S218 S219 S224 F225 F226F187-A222 HydrophobicContact CD1-CB 4.33Å; F187-A222 WeakPolarHBondContact CD1-O 3.2Å; I190-A222 HydrophobicContact CB-CB 4.32Å; I190-A222 HydrophobicContact CG2-CB 3.93Å; A191-A222 HydrophobicContact CB-CB 3.77Å; S218-A222 WeakPolarHBondContact O-CB 3.2Å; S218-A222 PolarHBondContact O-N 3.44Å; S219-A222 PolarHBondContact O-N 3.44Å; A222-S224 VanDerWaalsContact C-N 3.34Å; A222-S224 PolarHBondContact O-N 2.93Å; A222-F225 PolarHBondContact O-N 3.26Å; A222-F226 WeakPolarHBondContact O-CB 3.31Å; A222-F226 PolarHBondContact O-N 3.05Å
223Y83.6Confident85.9Confident37 Ų3763.2 Ų63.215%0.14533%0.334CS..Hα-helixtrans-62.8-40.8174.8-73.1-55.4000112.4M10 I13 L57 A191 S219 I220 A221 F226 A227M10-Y223 HydrophobicContact CE-CD1 3.61Å; M10-Y223 HydrophobicContact CE-CE1 4.06Å; M10-Y223 HydrophobicContact CE-CG 4.43Å; M10-Y223 HydrophobicContact SD-CD1 3.96Å; M10-Y223 HydrophobicContact SD-CE1 3.77Å; I13-Y223 HydrophobicContact CG2-CE2 4.29Å; L57-Y223 HydrophobicContact CD2-CE1 4.12Å; L57-Y223 VanDerWaalsContact CD2-OH 3.3Å; L57-Y223 WeakPolarHBondContact CD2-OH 3.11Å; A191-Y223 HydrophobicContact CB-CD1 3.89Å; A191-Y223 HydrophobicContact CB-CD2 3.93Å; A191-Y223 HydrophobicContact CB-CE1 3.62Å; A191-Y223 HydrophobicContact CB-CE2 3.64Å; A191-Y223 HydrophobicContact CB-CG 4.04Å; A191-Y223 VanDerWaalsContact CB-CZ 3.48Å; A191-Y223 PolarHBondContact O-OH 3.26Å; S219-Y223 WeakPolarHBondContact O-CD2 3.37Å; S219-Y223 PolarHBondContact O-N 3.31Å; I220-Y223 PolarHBondContact O-N 2.89Å; A221-Y223 PolarHBondContact O-N 3.16Å; Y223-F226 PolarHBondContact O-N 3Å; Y223-A227 WeakPolarHBondContact O-CB 3.38Å; Y223-A227 PolarHBondContact O-N 2.67Å
224S85.1Confident86Confident60 Ų6059.2 Ų59.242%0.4233%0.329SS..Hα-helixtrans-65.4-46.4179.2-56.20000111.6I220 A221 A222 F226 A227 L228I220-S224 WeakPolarHBondContact O-CB 3.23Å; I220-S224 PolarHBondContact O-N 3.45Å; I220-S224 PolarHBondContact O-OG 3.41Å; A221-S224 PolarHBondContact O-N 3.32Å; A222-S224 VanDerWaalsContact C-N 3.34Å; A222-S224 PolarHBondContact O-N 2.93Å; S224-F226 VanDerWaalsContact C-N 3.34Å; S224-F226 PolarHBondContact O-N 3.32Å; S224-A227 PolarHBondContact O-N 3.44Å; S224-L228 WeakPolarHBondContact O-CG 3.29Å; S224-L228 PolarHBondContact O-N 2.9Å
225F89.1Confident86.2Confident128 Ų12858.6 Ų58.656%0.56133%0.33SS*.Hα-helixtrans-63.1-40.3175.9-77.7-60.8000112F187 A221 A222 L228 H229F187-F225 HydrophobicContact CE1-CB 3.74Å; F187-F225 HydrophobicContact CZ-CB 4.23Å; A221-F225 HydrophobicContact CB-CD2 4.26Å; A221-F225 HydrophobicContact CB-CE2 4.16Å; A221-F225 WeakPolarHBondContact O-CB 3.28Å; A221-F225 WeakPolarHBondContact O-CD2 3.39Å; A221-F225 PolarHBondContact O-N 2.79Å; A222-F225 PolarHBondContact O-N 3.26Å; F225-L228 PolarHBondContact O-N 3.45Å; F225-H229 VanDerWaalsContact O-CB 3.26Å; F225-H229 WeakPolarHBondContact O-CB 3Å; F225-H229 PolarHBondContact O-N 3.43Å
226F85.4Confident86.3Confident24 Ų2466.2 Ų66.211%0.10536%0.358CS..Hα-helixtrans-63.5-43176179.2-104.8000112.3Y6 L184 F187 A222 Y223 S224 H229 T230Y6-F226 HydrophobicContact CE1-CE1 4.13Å; Y6-F226 WeakPolarHBondContact OH-CE1 3.42Å; L184-F226 HydrophobicContact CB-CE2 3.85Å; L184-F226 HydrophobicContact CB-CZ 4.14Å; L184-F226 HydrophobicContact CD1-CE2 4.45Å; L184-F226 HydrophobicContact CD1-CZ 3.89Å; L184-F226 HydrophobicContact CG-CE2 4.02Å; L184-F226 HydrophobicContact CG-CZ 3.84Å; F187-F226 HydrophobicContact CB-CB 3.98Å; F187-F226 HydrophobicContact CB-CD2 3.96Å; F187-F226 HydrophobicContact CB-CG 4.19Å; F187-F226 HydrophobicContact CD1-CB 4.11Å; F187-F226 HydrophobicContact CD2-CB 4.18Å; F187-F226 AromaticContact CD2-CD2 3.7Å; F187-F226 HydrophobicContact CD2-CD2 3.7Å; F187-F226 HydrophobicContact CD2-CG 4.41Å; F187-F226 HydrophobicContact CE2-CD2 4.48Å; F187-F226 HydrophobicContact CG-CB 3.84Å; F187-F226 HydrophobicContact CG-CD2 4Å; F187-F226 HydrophobicContact CG-CG 4.33Å; A222-F226 WeakPolarHBondContact O-CB 3.31Å; A222-F226 PolarHBondContact O-N 3.05Å; Y223-F226 PolarHBondContact O-N 3Å; S224-F226 VanDerWaalsContact C-N 3.34Å; S224-F226 PolarHBondContact O-N 3.32Å; F226-H229 PolarHBondContact O-N 2.96Å; F226-T230 WeakPolarHBondContact O-CB 3.42Å; F226-T230 PolarHBondContact O-N 3.41Å; F226-T230 PolarHBondContact O-OG1 3.19Å
227A84.1Confident86.5Confident46 Ų4668.7 Ų68.738%0.3837%0.369SS..Hα-helixtrans-61.6-48.3175.600000111.3Y223 S224 H229 T230 I231Y223-A227 WeakPolarHBondContact O-CB 3.38Å; Y223-A227 PolarHBondContact O-N 2.67Å; S224-A227 PolarHBondContact O-N 3.44Å; A227-H229 PolarHBondContact O-N 2.98Å; A227-T230 PolarHBondContact O-N 3.19Å; A227-I231 WeakPolarHBondContact O-CG1 3.24Å; A227-I231 PolarHBondContact O-N 2.9Å
228L87.9Confident86.3Confident100 Ų10071.6 Ų71.652%0.52437%0.37SS..Hα-helixtrans-59.2-47.9176.2-73.8173.1000112S224 F225 T230 I231 V232S224-L228 WeakPolarHBondContact O-CG 3.29Å; S224-L228 PolarHBondContact O-N 2.9Å; F225-L228 PolarHBondContact O-N 3.45Å; L228-T230 VanDerWaalsContact C-N 3.26Å; L228-T230 PolarHBondContact O-N 3.07Å; L228-I231 PolarHBondContact O-N 3.35Å; L228-V232 WeakPolarHBondContact O-CB 3.48Å; L228-V232 VanDerWaalsContact O-CG2 3.3Å; L228-V232 WeakPolarHBondContact O-CG2 3.36Å; L228-V232 PolarHBondContact O-N 3.45Å
229H87Confident86.3Confident75 Ų7574.7 Ų74.735%0.34738%0.384SS..Hα-helixtrans-56.5-42.4176.8169.5-94.5000111.5F225 F226 A227 K233F225-H229 VanDerWaalsContact O-CB 3.26Å; F225-H229 WeakPolarHBondContact O-CB 3Å; F225-H229 PolarHBondContact O-N 3.43Å; F226-H229 PolarHBondContact O-N 2.96Å; A227-H229 PolarHBondContact O-N 2.98Å; H229-K233 WeakPolarHBondContact O-CB 3.26Å; H229-K233 PolarHBondContact O-N 2.84Å
230T84Confident85.9Confident57 Ų5781.1 Ų81.135%0.3541%0.406SS..Hα-helixtrans-67.5-42.5179-56.40000112F226 A227 L228 T234F226-T230 WeakPolarHBondContact O-CB 3.42Å; F226-T230 PolarHBondContact O-N 3.41Å; F226-T230 PolarHBondContact O-OG1 3.19Å; A227-T230 PolarHBondContact O-N 3.19Å; L228-T230 VanDerWaalsContact C-N 3.26Å; L228-T230 PolarHBondContact O-N 3.07Å; T230-T234 WeakPolarHBondContact O-CB 3.22Å; T230-T234 PolarHBondContact O-N 3.37Å; T230-T234 PolarHBondContact O-OG1 2.88Å
231I87.2Confident85.5Confident97 Ų9782.7 Ų82.750%0.49742%0.418SS..Hα-helixtrans-64.2-52.2177.8-68.1165.4000110.3A227 L228 K233 T234 L235A227-I231 WeakPolarHBondContact O-CG1 3.24Å; A227-I231 PolarHBondContact O-N 2.9Å; L228-I231 PolarHBondContact O-N 3.35Å; I231-K233 VanDerWaalsContact C-N 3.28Å; I231-K233 PolarHBondContact O-N 2.87Å; I231-T234 PolarHBondContact O-N 3.32Å; I231-T234 VanDerWaalsContact O-N 3.1Å; I231-L235 HydrophobicContact CG2-CD1 3.97Å; I231-L235 HydrophobicContact CG2-CG 4.42Å; I231-L235 WeakPolarHBondContact O-CG 3.34Å; I231-L235 PolarHBondContact O-N 2.97Å
232V90.3Very high84.9Confident91 Ų9185 Ų8555%0.55242%0.423SS*.Hα-helixtrans-57-44.9179.6170.80000110.5L228 T234 L235 W236L228-V232 WeakPolarHBondContact O-CB 3.48Å; L228-V232 VanDerWaalsContact O-CG2 3.3Å; L228-V232 WeakPolarHBondContact O-CG2 3.36Å; L228-V232 PolarHBondContact O-N 3.45Å; V232-T234 PolarHBondContact O-N 3.18Å; V232-L235 PolarHBondContact O-N 2.75Å; V232-W236 VanDerWaalsContact O-CB 3.32Å; V232-W236 WeakPolarHBondContact O-CB 3.47Å; V232-W236 PolarHBondContact O-N 3.4Å
233K85.7Confident84.2Confident57 Ų5789.3 Ų89.325%0.24845%0.448CS..Hα-helixtrans-64.2-39.7177.8-175.5176.8-176.1176.70113Q180 H229 I231 W236 N237Q180-K233 VanDerWaalsContact OE1-NZ 3.1Å; H229-K233 WeakPolarHBondContact O-CB 3.26Å; H229-K233 PolarHBondContact O-N 2.84Å; I231-K233 VanDerWaalsContact C-N 3.28Å; I231-K233 PolarHBondContact O-N 2.87Å; K233-W236 PolarHBondContact O-N 3.35Å; K233-N237 WeakPolarHBondContact O-CB 3.18Å; K233-N237 VanDerWaalsContact O-CG 3.3Å; K233-N237 PolarHBondContact O-N 3.08Å
234T85.1Confident83.5Confident88 Ų8893.5 Ų93.554%0.5447%0.469SS..Hα-helixtrans-65.2-45177.8-57.30000110.8T230 I231 V232 N237 R238T230-T234 WeakPolarHBondContact O-CB 3.22Å; T230-T234 PolarHBondContact O-N 3.37Å; T230-T234 PolarHBondContact O-OG1 2.88Å; I231-T234 PolarHBondContact O-N 3.32Å; I231-T234 VanDerWaalsContact O-N 3.1Å; V232-T234 PolarHBondContact O-N 3.18Å; T234-N237 PolarHBondContact O-N 3.09Å; T234-R238 WeakPolarHBondContact O-CB 3.29Å; T234-R238 PolarHBondContact O-N 2.99Å
235L88.6Confident82.6Confident97 Ų9797 Ų9751%0.50848%0.479SS..Hα-helixtrans-62.2-43.8175.1-67.6174.2000111.6I231 V232 N237 R238 N239I231-L235 HydrophobicContact CG2-CD1 3.97Å; I231-L235 HydrophobicContact CG2-CG 4.42Å; I231-L235 WeakPolarHBondContact O-CG 3.34Å; I231-L235 PolarHBondContact O-N 2.97Å; V232-L235 PolarHBondContact O-N 2.75Å; L235-N237 PolarHBondContact O-N 3.44Å; L235-R238 PolarHBondContact O-N 3.15Å; L235-N239 PolarHBondContact O-N 3.03Å; L235-N239 PolarHBondContact O-OD1 3.29Å
236W88.4Confident81.7Confident171 Ų17195.5 Ų95.565%0.64848%0.476SS*.Hα-helixtrans-61.1-46.1177.4-175.4-87.8000112.6V232 K233 R238 N239 R240V232-W236 VanDerWaalsContact O-CB 3.32Å; V232-W236 WeakPolarHBondContact O-CB 3.47Å; V232-W236 PolarHBondContact O-N 3.4Å; K233-W236 PolarHBondContact O-N 3.35Å; W236-R238 VanDerWaalsContact C-N 3.33Å; W236-R238 PolarHBondContact O-N 3.2Å; W236-N239 PolarHBondContact O-N 2.8Å; W236-R240 PolarHBondContact O-N 2.97Å
237N84.7Confident80.8Confident72 Ų7296.7 Ų96.739%0.38549%0.488SS..Hα-helixtrans-64.8-38.4178-75.3-13.6000111.8K233 T234 L235 R240 V241K233-N237 WeakPolarHBondContact O-CB 3.18Å; K233-N237 VanDerWaalsContact O-CG 3.3Å; K233-N237 PolarHBondContact O-N 3.08Å; T234-N237 PolarHBondContact O-N 3.09Å; L235-N237 PolarHBondContact O-N 3.44Å; N237-R240 PolarHBondContact O-N 3.5Å; N237-V241 WeakPolarHBondContact O-CG2 3.34Å; N237-V241 PolarHBondContact O-N 2.82Å; N237-V241 VanDerWaalsContact O-N 3.11Å
238R83.2Confident79.9Confident159 Ų15996.5 Ų96.560%0.649%0.49SS*.Hα-helixtrans-62.7-49175.3-178178.4170.1169.9-1.1111.5T234 L235 W236 R240 V241 E242T234-R238 WeakPolarHBondContact O-CB 3.29Å; T234-R238 PolarHBondContact O-N 2.99Å; L235-R238 PolarHBondContact O-N 3.15Å; W236-R238 VanDerWaalsContact C-N 3.33Å; W236-R238 PolarHBondContact O-N 3.2Å; R238-R240 VanDerWaalsContact C-N 3.28Å; R238-R240 PolarHBondContact O-N 2.89Å; R238-V241 PolarHBondContact O-N 3.27Å; R238-V241 VanDerWaalsContact O-N 3.11Å; R238-E242 IonicContact CZ-OE1 3.7Å; R238-E242 IonicContact NE-OE1 2.94Å; R238-E242 PolarHBondContact NE-OE1 3.47Å; R238-E242 IonicContact NH2-OE1 3.66Å; R238-E242 PolarHBondContact O-N 3.31Å
239N85.1Confident78.7Confident91 Ų9197.1 Ų97.149%0.48749%0.489SS..Hα-helixtrans-60.3-38.5177.7-71.38.6000111.8L235 W236 V241 E242 V243L235-N239 PolarHBondContact O-N 3.03Å; L235-N239 PolarHBondContact O-OD1 3.29Å; W236-N239 PolarHBondContact O-N 2.8Å; N239-V241 PolarHBondContact O-N 3.23Å; N239-E242 PolarHBondContact O-N 3.19Å; N239-V243 VanDerWaalsContact O-CG2 3.27Å; N239-V243 WeakPolarHBondContact O-CG2 3.5Å; N239-V243 PolarHBondContact O-N 2.76Å
240R78.9Confident77.3Confident153 Ų15398.7 Ų98.758%0.57750%0.499SS*.Hα-helixtrans-63.1-41.4175.7-177.7-174.3-89.8-172.6-7.7112.1W236 N237 R238 V243 Q244W236-R240 PolarHBondContact O-N 2.97Å; N237-R240 PolarHBondContact O-N 3.5Å; R238-R240 VanDerWaalsContact C-N 3.28Å; R238-R240 PolarHBondContact O-N 2.89Å; R240-V243 PolarHBondContact O-N 2.89Å; R240-Q244 WeakPolarHBondContact O-CB 3.31Å; R240-Q244 WeakPolarHBondContact O-CG 3.34Å; R240-Q244 PolarHBondContact O-N 3.31Å
241V77.1Confident76Confident93 Ų93101.1 Ų101.156%0.56451%0.51SS*.Hα-helixtrans-67-41.2178.2173.20000110.9N237 R238 N239 Q244 H245N237-V241 WeakPolarHBondContact O-CG2 3.34Å; N237-V241 PolarHBondContact O-N 2.82Å; N237-V241 VanDerWaalsContact O-N 3.11Å; R238-V241 PolarHBondContact O-N 3.27Å; R238-V241 VanDerWaalsContact O-N 3.11Å; N239-V241 PolarHBondContact O-N 3.23Å; V241-Q244 PolarHBondContact O-N 3.36Å; V241-H245 WeakPolarHBondContact O-CB 3.45Å; V241-H245 PolarHBondContact O-N 3.2Å
242E75.1Confident74.8Confident83 Ų83103.7 Ų103.739%0.38852%0.517SS..Hα-helixtrans-61.3-46.1175.4-71.2172.8-174.900110.9R238 N239 Q244 H245 D246R238-E242 IonicContact CZ-OE1 3.7Å; R238-E242 IonicContact NE-OE1 2.94Å; R238-E242 PolarHBondContact NE-OE1 3.47Å; R238-E242 IonicContact NH2-OE1 3.66Å; R238-E242 PolarHBondContact O-N 3.31Å; N239-E242 PolarHBondContact O-N 3.19Å; E242-Q244 PolarHBondContact O-N 3.19Å; E242-H245 PolarHBondContact O-N 3.24Å; E242-D246 PolarHBondContact O-N 3.21Å
243V73Confident73.1Confident96 Ų96102 Ų10258%0.58250%0.504SS*.Hα-helixtrans-63.7-37.3175.6173.80000112.5N239 R240 S247N239-V243 VanDerWaalsContact O-CG2 3.27Å; N239-V243 WeakPolarHBondContact O-CG2 3.5Å; N239-V243 PolarHBondContact O-N 2.76Å; R240-V243 PolarHBondContact O-N 2.89Å; V243-S247 WeakPolarHBondContact O-CB 3.39Å; V243-S247 PolarHBondContact O-N 3.43Å; V243-S247 PolarHBondContact O-OG 3.04Å
244Q68.8Low71.5Confident126 Ų126105.3 Ų105.359%0.58952%0.521SS*.Hα-helixtrans-69.3-36.3174.8-79.8-171-49.400112.6R240 V241 E242 S247 G248R240-Q244 WeakPolarHBondContact O-CB 3.31Å; R240-Q244 WeakPolarHBondContact O-CG 3.34Å; R240-Q244 PolarHBondContact O-N 3.31Å; V241-Q244 PolarHBondContact O-N 3.36Å; E242-Q244 PolarHBondContact O-N 3.19Å; Q244-S247 WeakPolarHBondContact CA-OG 3.41Å; Q244-S247 PolarHBondContact O-OG 2.99Å; Q244-G248 PolarHBondContact O-N 3.11Å
245H66.2Low69.9Low134 Ų134104.4 Ų104.462%0.6252%0.516SS*.Hα-helixtrans-66.5-43.1174.9-170.4-83.1000110.9V241 E242 G248 F249V241-H245 WeakPolarHBondContact O-CB 3.45Å; V241-H245 PolarHBondContact O-N 3.2Å; E242-H245 PolarHBondContact O-N 3.24Å; H245-G248 PolarHBondContact O-N 3.48Å; H245-F249 VanDerWaalsContact O-CB 3.31Å; H245-F249 WeakPolarHBondContact O-CB 3.3Å; H245-F249 PolarHBondContact O-N 3.48Å
246D70Confident68.2Low95 Ų95105.9 Ų105.951%0.50852%0.52SS..Hα-helixtrans-68.2-42.7178.2-73.9-14.3000112.5E242 F249 L250E242-D246 PolarHBondContact O-N 3.21Å; D246-F249 PolarHBondContact O-N 3.49Å; D246-L250 WeakPolarHBondContact O-CB 3.07Å; D246-L250 WeakPolarHBondContact O-CG 3.29Å; D246-L250 PolarHBondContact O-N 2.95Å
247S67.1Low66.3Low50 Ų50102.5 Ų102.535%0.3551%0.514SS..Hα-helixtrans-68.6-37.1175.152.80000112.7V243 Q244 F249 L250 N251V243-S247 WeakPolarHBondContact O-CB 3.39Å; V243-S247 PolarHBondContact O-N 3.43Å; V243-S247 PolarHBondContact O-OG 3.04Å; Q244-S247 WeakPolarHBondContact CA-OG 3.41Å; Q244-S247 PolarHBondContact O-OG 2.99Å; S247-F249 VanDerWaalsContact C-N 3.33Å; S247-L250 PolarHBondContact O-N 2.89Å; S247-N251 VanDerWaalsContact O-CB 3.28Å; S247-N251 WeakPolarHBondContact O-CB 3.27Å; S247-N251 VanDerWaalsContact O-CG 3.26Å; S247-N251 PolarHBondContact O-N 3.14Å
248G64Low64.8Low41 Ų41103.8 Ų103.842%0.42352%0.524SS..Hα-helixtrans-64.1-37.9172.100000112.5Q244 H245 K252Q244-G248 PolarHBondContact O-N 3.11Å; H245-G248 PolarHBondContact O-N 3.48Å; G248-K252 WeakPolarHBondContact O-CB 3.46Å; G248-K252 PolarHBondContact O-N 3.44Å; G248-K252 VanDerWaalsContact O-N 3.13Å
249F62.8Low63Low114 Ų114103 Ų10350%0.553%0.527SS..Hα-helixtrans-69.9-43.7174.9-170.8-112000112.1H245 D246 S247 K252 M253H245-F249 VanDerWaalsContact O-CB 3.31Å; H245-F249 WeakPolarHBondContact O-CB 3.3Å; H245-F249 PolarHBondContact O-N 3.48Å; D246-F249 PolarHBondContact O-N 3.49Å; S247-F249 VanDerWaalsContact C-N 3.33Å; F249-K252 PolarHBondContact O-N 3.03Å; F249-M253 HydrophobicContact CD1-CE 3.25Å; F249-M253 HydrophobicContact CD1-SD 4.15Å; F249-M253 HydrophobicContact CE1-CE 3.11Å; F249-M253 HydrophobicContact CE1-CG 4.32Å; F249-M253 HydrophobicContact CE1-SD 3.49Å; F249-M253 WeakPolarHBondContact CE1-SD 3.22Å; F249-M253 HydrophobicContact CG-CE 4.2Å; F249-M253 HydrophobicContact CZ-CE 3.99Å; F249-M253 HydrophobicContact CZ-CG 4.31Å; F249-M253 HydrophobicContact CZ-SD 3.76Å; F249-M253 PolarHBondContact O-N 2.87Å
250L57.6Low61Low107 Ų107100.9 Ų100.956%0.5652%0.522SS*.Hα-helixtrans-62-45.7174.3-84.1157.1000112.1D246 S247 K252 M253 Q254D246-L250 WeakPolarHBondContact O-CB 3.07Å; D246-L250 WeakPolarHBondContact O-CG 3.29Å; D246-L250 PolarHBondContact O-N 2.95Å; S247-L250 PolarHBondContact O-N 2.89Å; L250-K252 PolarHBondContact O-N 3.3Å; L250-M253 HydrophobicContact CD2-CE 4.46Å; L250-M253 PolarHBondContact O-N 3.46Å; L250-Q254 WeakPolarHBondContact O-CB 3.08Å; L250-Q254 PolarHBondContact O-N 3.4Å
251N57.2Low59.3Low109 Ų10998.6 Ų98.658%0.58353%0.525SS*.Hα-helixtrans-64.7-26176.7-76.4-12.4000112.6S247 P255S247-N251 VanDerWaalsContact O-CB 3.28Å; S247-N251 WeakPolarHBondContact O-CB 3.27Å; S247-N251 VanDerWaalsContact O-CG 3.26Å; S247-N251 PolarHBondContact O-N 3.14Å; N251-P255 WeakPolarHBondContact O-CD 3.26Å
252K62.3Low57.6Low151 Ų15198.8 Ų98.866%0.65753%0.53SS*.Hα-helixtrans-82.1-32.4174.6-158.1174.6-175.7-1780112.5G248 F249 L250 P255G248-K252 WeakPolarHBondContact O-CB 3.46Å; G248-K252 PolarHBondContact O-N 3.44Å; G248-K252 VanDerWaalsContact O-N 3.13Å; F249-K252 PolarHBondContact O-N 3.03Å; L250-K252 PolarHBondContact O-N 3.3Å; K252-P255 WeakPolarHBondContact O-CD 3.21Å; K252-P255 WeakPolarHBondContact O-CG 3.35Å
253M53.7Low56.2Low56 Ų5696.8 Ų96.828%0.27653%0.526SS..Hα-helixtrans-77.1-30.5174.5-78.7-168.3-63.600113.4F249 L250 E256 I257F249-M253 HydrophobicContact CD1-CE 3.25Å; F249-M253 HydrophobicContact CD1-SD 4.15Å; F249-M253 HydrophobicContact CE1-CE 3.11Å; F249-M253 HydrophobicContact CE1-CG 4.32Å; F249-M253 HydrophobicContact CE1-SD 3.49Å; F249-M253 WeakPolarHBondContact CE1-SD 3.22Å; F249-M253 HydrophobicContact CG-CE 4.2Å; F249-M253 HydrophobicContact CZ-CE 3.99Å; F249-M253 HydrophobicContact CZ-CG 4.31Å; F249-M253 HydrophobicContact CZ-SD 3.76Å; F249-M253 PolarHBondContact O-N 2.87Å; L250-M253 HydrophobicContact CD2-CE 4.46Å; L250-M253 PolarHBondContact O-N 3.46Å; M253-E256 CarbonylContact O-C 3.53Å; M253-E256 PolarHBondContact O-N 3.45Å; M253-E256 VanDerWaalsContact O-N 3.1Å; M253-I257 HydrophobicContact CB-CD1 4.4Å; M253-I257 WeakPolarHBondContact O-CG1 3.47Å; M253-I257 PolarHBondContact O-N 2.91Å
254Q52.2Low54.4Low126 Ų12696.6 Ų96.659%0.58953%0.529SS*.Hα-helixtrans-57.7-44.7-179.2-157.3173-13.700113.6L250 V258L250-Q254 WeakPolarHBondContact O-CB 3.08Å; L250-Q254 PolarHBondContact O-N 3.4Å; Q254-V258 VanDerWaalsContact O-CG2 3.24Å; Q254-V258 WeakPolarHBondContact O-CG2 3.49Å; Q254-V258 PolarHBondContact O-N 2.98Å
255P52.9Low52.7Low69 Ų6995.5 Ų95.545%0.44854%0.535SS..Hα-helixtrans-69.4-32.1172.826-33.3000112.9N251 K252 H259N251-P255 WeakPolarHBondContact O-CD 3.26Å; K252-P255 WeakPolarHBondContact O-CD 3.21Å; K252-P255 WeakPolarHBondContact O-CG 3.35Å; P255-H259 WeakPolarHBondContact O-CB 3.45Å; P255-H259 PolarHBondContact O-N 3.3Å
256E52Low51.2Low128 Ų12895.1 Ų95.160%0.59854%0.537SS*.Hα-helixtrans-68.5-38.2176.2-72.2-172.4173.100112.2M253 H259 A260M253-E256 CarbonylContact O-C 3.53Å; M253-E256 PolarHBondContact O-N 3.45Å; M253-E256 VanDerWaalsContact O-N 3.1Å; E256-H259 PolarHBondContact O-N 2.78Å; E256-A260 WeakPolarHBondContact O-CB 3.34Å; E256-A260 PolarHBondContact O-N 3.44Å
257I49.1Very low49.7Very low100 Ų10099.7 Ų99.751%0.51355%0.552SS.*Hα-helixtrans-71.7-40175.9-65.9169.3000110.6M253 H259 A260 V261M253-I257 HydrophobicContact CB-CD1 4.4Å; M253-I257 WeakPolarHBondContact O-CG1 3.47Å; M253-I257 PolarHBondContact O-N 2.91Å; I257-H259 VanDerWaalsContact C-N 3.3Å; I257-H259 PolarHBondContact O-N 3.3Å; I257-A260 PolarHBondContact O-N 3.27Å; I257-V261 HydrophobicContact CG2-CG2 4.07Å; I257-V261 WeakPolarHBondContact O-CB 3.26Å; I257-V261 WeakPolarHBondContact O-CG2 3.41Å; I257-V261 PolarHBondContact O-N 2.9Å
258V52.6Low48Very low98 Ų98101 Ų10159%0.59456%0.558SS**Hα-helixtrans-63.3-39.6175.3172.50000110.7Q254 S262Q254-V258 VanDerWaalsContact O-CG2 3.24Å; Q254-V258 WeakPolarHBondContact O-CG2 3.49Å; Q254-V258 PolarHBondContact O-N 2.98Å; V258-S262 WeakPolarHBondContact O-CB 3.05Å; V258-S262 PolarHBondContact O-N 3.34Å; V258-S262 VanDerWaalsContact O-N 3.14Å
259H46.1Very low46.3Very low142 Ų142110.3 Ų110.366%0.65758%0.582SS**Hα-helixtrans-67.5-40171.5-99.6-76.7000112.8P255 E256 I257 S262 S263P255-H259 WeakPolarHBondContact O-CB 3.45Å; P255-H259 PolarHBondContact O-N 3.3Å; E256-H259 PolarHBondContact O-N 2.78Å; I257-H259 VanDerWaalsContact C-N 3.3Å; I257-H259 PolarHBondContact O-N 3.3Å; H259-S262 PolarHBondContact O-N 3.2Å; H259-S263 VanDerWaalsContact O-CB 3.23Å; H259-S263 WeakPolarHBondContact O-CB 3.31Å; H259-S263 PolarHBondContact O-N 2.9Å; H259-S263 PolarHBondContact O-OG 3.31Å; H259-S263 VanDerWaalsContact O-OG 3.12Å
260A42.4Very low44.8Very low48 Ų48113.6 Ų113.640%0.39760%0.599SS.*Hα-helixtrans-71.1-32.4-179.700000113.1E256 I257 S263 S264E256-A260 WeakPolarHBondContact O-CB 3.34Å; E256-A260 PolarHBondContact O-N 3.44Å; I257-A260 PolarHBondContact O-N 3.27Å; A260-S263 PolarHBondContact O-N 3.09Å; A260-S264 WeakPolarHBondContact O-CA 3.32Å; A260-S264 WeakPolarHBondContact O-CB 3.35Å; A260-S264 PolarHBondContact O-N 3.16Å; A260-S264 PolarHBondContact O-OG 3.48Å
261V43Very low43.5Very low104 Ų104118 Ų11863%0.6361%0.614SS**Hα-helixtrans-75.6-31.2174.2176.20000110.9I257 S264I257-V261 HydrophobicContact CG2-CG2 4.07Å; I257-V261 WeakPolarHBondContact O-CB 3.26Å; I257-V261 WeakPolarHBondContact O-CG2 3.41Å; I257-V261 PolarHBondContact O-N 2.9Å; V261-S264 WeakPolarHBondContact CA-OG 3.11Å; V261-S264 PolarHBondContact O-OG 3.08Å
262S42Very low42.3Very low97 Ų97118.9 Ų118.968%0.67862%0.617SS**Hα-helixtrans-73.6-25.8169.6-179.90000113.3V258 H259V258-S262 WeakPolarHBondContact O-CB 3.05Å; V258-S262 PolarHBondContact O-N 3.34Å; V258-S262 VanDerWaalsContact O-N 3.14Å; H259-S262 PolarHBondContact O-N 3.2Å
263S44.3Very low40.8Very low41 Ų41120.9 Ų120.929%0.28763%0.626SS.*Hα-helixtrans-107.1-4.7-175.880.50000114.4H259 A260 S265 L266H259-S263 VanDerWaalsContact O-CB 3.23Å; H259-S263 WeakPolarHBondContact O-CB 3.31Å; H259-S263 PolarHBondContact O-N 2.9Å; H259-S263 PolarHBondContact O-OG 3.31Å; H259-S263 VanDerWaalsContact O-OG 3.12Å; A260-S263 PolarHBondContact O-N 3.09Å; S263-S265 PolarHBondContact O-N 3.13Å; S263-S265 VanDerWaalsContact O-N 3.11Å; S263-L266 CarbonylContact O-C 3.6Å; S263-L266 PolarHBondContact O-N 3.26Å
264S36Very low39.7Very low93 Ų93125.7 Ų125.765%0.6565%0.651SS**THydrogen-bonded Turntrans-68.6-6.5178.224.80000112.5A260 V261A260-S264 WeakPolarHBondContact O-CA 3.32Å; A260-S264 WeakPolarHBondContact O-CB 3.35Å; A260-S264 PolarHBondContact O-N 3.16Å; A260-S264 PolarHBondContact O-OG 3.48Å; V261-S264 WeakPolarHBondContact CA-OG 3.11Å; V261-S264 PolarHBondContact O-OG 3.08Å
265S32.5Very low38.5Very low102 Ų102126.6 Ų126.671%0.71367%0.665SS**THydrogen-bonded Turntrans-76.6-18.8163.5-51.10000114.1S263S263-S265 PolarHBondContact O-N 3.13Å; S263-S265 VanDerWaalsContact O-N 3.11Å
266L35.2Very low37.5Very low126 Ų126132.6 Ų132.666%0.6668%0.684SS**SBendtrans-154.7106.8176.9-87.5110.3000113.7S263S263-L266 CarbonylContact O-C 3.6Å; S263-L266 PolarHBondContact O-N 3.26Å
267K38Very low36.7Very low191 Ų191134.9 Ų134.983%0.8370%0.695SS**  trans79.843.1144.6-57.2179.4173.9178.90119.4
268V31.7Very low35.7Very low77 Ų77137.4 Ų137.447%0.46772%0.715SS.*  trans-111.749.9161.4-166.50000111.7I272V268-I272 HydrophobicContact CG1-CD1 3.53Å; V268-I272 HydrophobicContact CG1-CG1 3.99Å
269Y29.3Very low34.6Very low237 Ų237135.6 Ų135.693%0.92972%0.716SS**SBendtrans-112.1-3.9163.8-99-77.9000114.3
270E31.2Very low33.9Very low183 Ų183134.2 Ų134.286%0.85572%0.718SS**SBendtrans-117-10.1-171.5-140.8176177.300115.7
271K29.5Very low33.8Very low201 Ų201137 Ų13787%0.87473%0.734SS**SBendtrans-115.4-1-177.6-87.7-174.2176.6-178.70117.1F273K271-F273 VanDerWaalsContact C-N 3.34Å; K271-F273 PolarHBondContact O-N 3.01Å
272I31.9Very low33.4Very low127 Ų127137 Ų13765%0.65173%0.734SS**SBendtrans-81.2-7.7177.2-70.2-179.2000113.2V268V268-I272 HydrophobicContact CG1-CD1 3.53Å; V268-I272 HydrophobicContact CG1-CG1 3.99Å
273F31.7Very low33Very low192 Ų192138.2 Ų138.284%0.84273%0.729SS**SBendtrans-96-3.8-169.8-121.2-90.5000118.2K271K271-F273 VanDerWaalsContact C-N 3.34Å; K271-F273 PolarHBondContact O-N 3.01Å
274I29.6Very low32.8Very low158 Ų158139.6 Ų139.681%0.8174%0.743SS**SBendtrans-114.9-5.5-170.3-57.5-175.6000115.3
275V27.9Very low32.8Very low145 Ų145143 Ų14388%0.87974%0.743SS**SBendtrans-12357.8172.8-1650000110.6
276K31.7Very low32.8Very low194 Ų194144.5 Ų144.584%0.84374%0.738SS**  trans-118.118.6169.2-150.7178.9-178.7177.10113.3
277Q34.1Very low32.8Very low177 Ų177146.7 Ų146.783%0.82774%0.738SS**  trans-139.295.3177-95.2179.9-3200110
278T29.2Very low32.7Very low152 Ų152146.5 Ų146.593%0.93373%0.732SS**  trans165131.4136.5400000109.4
279G29.6Very low32.9Very low60 Ų60146.1 Ų146.162%0.61973%0.73SS**  trans127.873.517300000113.3
280T30.9Very low33.2Very low113 Ų113138.4 Ų138.469%0.69371%0.711SS**  trans-60.1145.2169.543.80000110.8V282 E283T280-V282 PolarHBondContact O-N 3.08Å; T280-E283 PolarHBondContact O-N 3.29Å
281S41.4Very low33.4Very low106 Ų106136.2 Ų136.274%0.74170%0.7SS**THydrogen-bonded Turntrans-38-18.6-179.6174.40000117.8
282V34.5Very low33.5Very low104 Ų104134.2 Ų134.263%0.6369%0.694SS**Hα-helixtrans-76-34.2-177.3-174.90000112.8T280 Y285 H286T280-V282 PolarHBondContact O-N 3.08Å; V282-Y285 PolarHBondContact O-N 2.98Å; V282-H286 PolarHBondContact O-N 3.16Å; V282-H286 VanDerWaalsContact O-N 3.09Å
283E33.7Very low33.6Very low123 Ų123134 Ų13458%0.57570%0.699SS**Hα-helixtrans-70.8-31.3177.1-79.4-171.915400112.6T280 Y285 H286 R287T280-E283 PolarHBondContact O-N 3.29Å; E283-Y285 VanDerWaalsContact C-N 3.3Å; E283-Y285 PolarHBondContact O-N 3.34Å; E283-H286 PolarHBondContact O-N 3.15Å; E283-R287 VanDerWaalsContact O-CB 3.29Å; E283-R287 WeakPolarHBondContact O-CB 3.48Å; E283-R287 PolarHBondContact O-N 3.48Å
284A39.3Very low33.9Very low71 Ų71130.3 Ų130.359%0.58769%0.687SS**Hα-helixtrans-64.2-37.5174.400000111.4W288A284-W288 WeakPolarHBondContact O-CB 3.47Å; A284-W288 PolarHBondContact O-N 3.34Å; A284-W288 VanDerWaalsContact O-N 3.1Å
285Y35.4Very low34.1Very low163 Ų163127.4 Ų127.464%0.63967%0.673SS**Hα-helixtrans-71-40.2176.3-163.7-98.4000112V282 E283 W288 T289V282-Y285 PolarHBondContact O-N 2.98Å; E283-Y285 VanDerWaalsContact C-N 3.3Å; E283-Y285 PolarHBondContact O-N 3.34Å; Y285-W288 PolarHBondContact O-N 2.94Å; Y285-T289 HydrophobicContact CD1-CG2 4.36Å; Y285-T289 HydrophobicContact CE1-CG2 4.04Å; Y285-T289 PolarHBondContact O-N 3.33Å; Y285-T289 PolarHBondContact O-OG1 3.42Å; Y285-T289 VanDerWaalsContact O-OG1 3.11Å
286H32.9Very low34.5Very low134 Ų134124.8 Ų124.862%0.6266%0.659SS**Hα-helixtrans-69.8-32178.1-127.1-59.7000113V282 E283 T289 S290V282-H286 PolarHBondContact O-N 3.16Å; V282-H286 VanDerWaalsContact O-N 3.09Å; E283-H286 PolarHBondContact O-N 3.15Å; H286-T289 PolarHBondContact O-OG1 3.13Å; H286-S290 WeakPolarHBondContact O-CB 3.38Å; H286-S290 PolarHBondContact O-N 2.86Å; H286-S290 VanDerWaalsContact O-N 3.15Å; H286-S290 PolarHBondContact O-OG 2.97Å
287R35Very low34.7Very low173 Ų173125.2 Ų125.265%0.65366%0.655SS**Hα-helixtrans-74.7-27174.2-158.4-179.1-77.9174.1-2.9112.1E283 S290E283-R287 VanDerWaalsContact O-CB 3.29Å; E283-R287 WeakPolarHBondContact O-CB 3.48Å; E283-R287 PolarHBondContact O-N 3.48Å; R287-S290 PolarHBondContact O-OG 3.3Å
288W36.7Very low34.7Very low186 Ų186121.9 Ų121.971%0.70564%0.643SS**Hα-helixtrans-76.4-36.3174.2-159.780.1000112.5A284 Y285A284-W288 WeakPolarHBondContact O-CB 3.47Å; A284-W288 PolarHBondContact O-N 3.34Å; A284-W288 VanDerWaalsContact O-N 3.1Å; Y285-W288 PolarHBondContact O-N 2.94Å
289T36Very low35.1Very low70 Ų70119.1 Ų119.143%0.42962%0.619SS.*Hα-helixtrans-77.9-26.517749.70000113.5Y285 H286Y285-T289 HydrophobicContact CD1-CG2 4.36Å; Y285-T289 HydrophobicContact CE1-CG2 4.04Å; Y285-T289 PolarHBondContact O-N 3.33Å; Y285-T289 PolarHBondContact O-OG1 3.42Å; Y285-T289 VanDerWaalsContact O-OG1 3.11Å; H286-T289 PolarHBondContact O-OG1 3.13Å
290S35.9Very low35.6Very low74 Ų74122.9 Ų122.952%0.51762%0.621SS.*Hα-helixtrans-81.5-23.5178.365.30000114.6H286 R287H286-S290 WeakPolarHBondContact O-CB 3.38Å; H286-S290 PolarHBondContact O-N 2.86Å; H286-S290 VanDerWaalsContact O-N 3.15Å; H286-S290 PolarHBondContact O-OG 2.97Å; R287-S290 PolarHBondContact O-OG 3.3Å
291H34Very low35.9Very low138 Ų138120.1 Ų120.164%0.63961%0.61SS**THydrogen-bonded Turntrans-93.819-176.7-92.1-69.5000115.6V293H291-V293 PolarHBondContact O-N 3.31Å
292Q32.5Very low35.9Very low158 Ų158118.9 Ų118.974%0.73860%0.597SS**THydrogen-bonded Turntrans-74.95.7166.5-86.1-158.3-11.700114.6L294Q292-L294 VanDerWaalsContact C-N 3.31Å; Q292-L294 PolarHBondContact O-N 3.4Å
293V34Very low36.3Very low124 Ų124118.7 Ų118.775%0.75260%0.596SS**SBendtrans-83.984.8159.1-171.30000106.9H291 D295H291-V293 PolarHBondContact O-N 3.31Å; V293-D295 PolarHBondContact O-N 2.87Å; V293-D295 VanDerWaalsContact O-N 3.15Å
294L37.5Very low36.6Very low113 Ų113120.1 Ų120.159%0.59260%0.603SS**  trans-58.3115173.4-121.182.4000108.2Q292 E299Q292-L294 VanDerWaalsContact C-N 3.31Å; Q292-L294 PolarHBondContact O-N 3.4Å; L294-E299 HydrophobicContact CD2-CG 4.4Å
295D33.4Very low36.4Very low98 Ų98119.1 Ų119.152%0.52460%0.599SS.*  trans-62.5124.4171.1-171.1-24.6000108.5V293 R297 L298V293-D295 PolarHBondContact O-N 2.87Å; V293-D295 VanDerWaalsContact O-N 3.15Å; D295-R297 PolarHBondContact O-N 2.89Å; D295-R297 PolarHBondContact OD1-N 3.27Å; D295-L298 WeakPolarHBondContact O-CB 3.19Å; D295-L298 PolarHBondContact O-N 3.27Å
296P37.4Very low36.4Very low90 Ų90117.3 Ų117.358%0.58460%0.598SS**Hα-helixtrans-58-19.8-177.419.5-31.4000113.9L298 E299P296-L298 VanDerWaalsContact C-N 3.28Å; P296-L298 PolarHBondContact O-N 3Å; P296-E299 WeakPolarHBondContact O-CB 3.5Å; P296-E299 PolarHBondContact O-N 3.47Å
297R34.9Very low36.6Very low202 Ų202115.1 Ų115.176%0.76260%0.603SS**Hα-helixtrans-69.7-24173-70.7-175.1171.5-176.1-1.7113.7D295 E299D295-R297 PolarHBondContact O-N 2.89Å; D295-R297 PolarHBondContact OD1-N 3.27Å; R297-E299 VanDerWaalsContact C-N 3.34Å
298L34.9Very low36.5Very low108 Ų108111 Ų11157%0.56560%0.601SS**Hα-helixtrans-77.7-22.9174.3-149.479.5000111.5D295 P296 V302D295-L298 WeakPolarHBondContact O-CB 3.19Å; D295-L298 PolarHBondContact O-N 3.27Å; P296-L298 VanDerWaalsContact C-N 3.28Å; P296-L298 PolarHBondContact O-N 3Å; L298-V302 WeakPolarHBondContact O-CG2 3.4Å; L298-V302 PolarHBondContact O-N 3.46Å
299E37.1Very low36.3Very low93 Ų93110.6 Ų110.644%0.43561%0.607SS.*Hα-helixtrans-66.1-41.1171.5-82.7-170.7139.600111.5L294 P296 R297 V302 V303L294-E299 HydrophobicContact CD2-CG 4.4Å; P296-E299 WeakPolarHBondContact O-CB 3.5Å; P296-E299 PolarHBondContact O-N 3.47Å; R297-E299 VanDerWaalsContact C-N 3.34Å; E299-V302 PolarHBondContact O-N 3.35Å; E299-V303 VanDerWaalsContact O-CG2 3.27Å; E299-V303 WeakPolarHBondContact O-CG2 3.36Å; E299-V303 PolarHBondContact O-N 3.05Å
300E39.3Very low36.1Very low139 Ų139112.7 Ų112.765%0.6562%0.622SS**Hα-helixtrans-63.3-42.3176-79.2178160.800111.8V302 V303 E304E300-V302 PolarHBondContact O-N 2.86Å; E300-V303 PolarHBondContact O-N 3.31Å; E300-E304 PolarHBondContact O-N 2.03Å
301A38.6Very low36.1Very low56 Ų56118.4 Ų118.446%0.46364%0.64SS.*Hα-helixtrans-66.3-33.8179.300000113.4G305A301-G305 PolarHBondContact O-N 3.39Å
302V40.6Very low36Very low80 Ų80121 Ų12149%0.48565%0.653SS.*Hα-helixtrans-74.5-32.7175.2174.10000111.2L298 E299 E300 M306L298-V302 WeakPolarHBondContact O-CG2 3.4Å; L298-V302 PolarHBondContact O-N 3.46Å; E299-V302 PolarHBondContact O-N 3.35Å; E300-V302 PolarHBondContact O-N 2.86Å; V302-M306 WeakPolarHBondContact O-CG 3.47Å; V302-M306 PolarHBondContact O-N 3.37Å
303V42.9Very low36.1Very low99 Ų99117.4 Ų117.460%0.665%0.65SS**Hα-helixtrans-71-40.6175173.20000111.1E299 E300 A307E299-V303 VanDerWaalsContact O-CG2 3.27Å; E299-V303 WeakPolarHBondContact O-CG2 3.36Å; E299-V303 PolarHBondContact O-N 3.05Å; E300-V303 PolarHBondContact O-N 3.31Å; V303-A307 PolarHBondContact O-N 3.09Å
304E40.9Very low36.2Very low154 Ų154120.1 Ų120.172%0.7266%0.659SS**Hα-helixtrans-67.7-38.5174.8-75.5-174.7158.500112.3E300 M306 A307E300-E304 PolarHBondContact O-N 2.03Å; E304-M306 VanDerWaalsContact C-N 3.34Å; E304-M306 PolarHBondContact O-N 2.8Å; E304-A307 PolarHBondContact O-N 3.18Å
305G35.5Very low35.8Very low49 Ų49120.3 Ų120.351%0.50567%0.665SS.*Hα-helixtrans-72.1-19.3179.300000115.5A301 S308A301-G305 PolarHBondContact O-N 3.39Å; G305-S308 PolarHBondContact O-OG 2.83Å
306M34.4Very low36.4Very low125 Ų125129.9 Ų129.962%0.61670%0.696SS**Hα-helixtrans-93.1-11.8175.1-70.9-165.3-44.100113.5V302 E304 S308V302-M306 WeakPolarHBondContact O-CG 3.47Å; V302-M306 PolarHBondContact O-N 3.37Å; E304-M306 VanDerWaalsContact C-N 3.34Å; E304-M306 PolarHBondContact O-N 2.8Å; M306-S308 PolarHBondContact O-N 2.69Å
307A36.4Very low36.3Very low89 Ų89131.9 Ų131.974%0.73670%0.701SS**THydrogen-bonded Turntrans-75.2-4.2173.800000112.8V303 E304V303-A307 PolarHBondContact O-N 3.09Å; E304-A307 PolarHBondContact O-N 3.18Å
308S34.2Very low36.4Very low86 Ų86128.2 Ų128.260%0.60170%0.698SS**THydrogen-bonded Turntrans-117.229.6-174.668.70000114.9G305 M306 P310G305-S308 PolarHBondContact O-OG 2.83Å; M306-S308 PolarHBondContact O-N 2.69Å; S308-P310 WeakPolarHBondContact O-CD 3.22Å
309E31.8Very low36.5Very low178 Ų178129.3 Ų129.383%0.83271%0.706SS**  trans-89.6110.9157.4-90.7-174.9149.900108.6E311E309-E311 PolarHBondContact O-N 3.15Å
310P32.6Very low36.5Very low114 Ų114131.5 Ų131.574%0.7472%0.722SS**  trans-70.7132179.728.2-30.7000109.6S308 E312S308-P310 WeakPolarHBondContact O-CD 3.22Å; P310-E312 PolarHBondContact O-N 2.99Å
311E34.8Very low36.3Very low193 Ų193131 Ų13190%0.90273%0.726SS**  trans-51109.8163.7-76.6-179.2141.200108.5E309 A313E309-E311 PolarHBondContact O-N 3.15Å; E311-A313 VanDerWaalsContact C-N 3.31Å; E311-A313 PolarHBondContact O-N 2.99Å
312E33.4Very low36.1Very low193 Ų193136 Ų13690%0.90274%0.744SS**  trans-56.1101.5162.3-82.2-177.9151.800107.5P310 L314P310-E312 PolarHBondContact O-N 2.99Å; E312-L314 PolarHBondContact O-N 3.32Å; E312-L314 VanDerWaalsContact O-N 3.17Å
313A34.6Very low35.8Very low83 Ų83140 Ų14069%0.68676%0.762SS**  trans-53.7116.1168.800000108.9E311 V315E311-A313 VanDerWaalsContact C-N 3.31Å; E311-A313 PolarHBondContact O-N 2.99Å; A313-V315 PolarHBondContact O-N 3.18Å; A313-V315 VanDerWaalsContact O-N 3.16Å
314L35.6Very low35.3Very low181 Ų181143.2 Ų143.295%0.94877%0.774SS**  trans-58.1115.2162.8-102.3135.4000108.3E312E312-L314 PolarHBondContact O-N 3.32Å; E312-L314 VanDerWaalsContact O-N 3.17Å
315V29.6Very low34.8Very low117 Ų117142.3 Ų142.371%0.70978%0.779SS**  trans-80.8126.2-177.4170.60000110A313A313-V315 PolarHBondContact O-N 3.18Å; A313-V315 VanDerWaalsContact O-N 3.16Å
316Y44.7Very low34.7Very low299 Ų299150.7 Ų150.7100%1.17380%0.804SS**  trans520168.6-67.2-69.3000119.3

Retrieved 316 of 316 residues in 322.9 ms (Link to these results)

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