A0A087XPS2_POEFO Loading...

Voltage-dependent calcium channel gamma-7 subunit

Regulates the activity of L-type calcium channels that contain CACNA1C as pore-forming subunit (By similarity). Regulates the trafficking and gating properties of AMPA-selective glutamate receptors (AMPARs). Promotes their targeting to the cell membrane and synapses and modulates their gating properties by slowing their rates of activation, deactivation and desensitization and by mediating their resensitization. Shows specificity only for GRIA1 and GRIA2.

AlphaFold DB , UniProt , Accession A0A087XPS2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 363 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
1M49.7Very low75Confident222 Ų22289.8 Ų89.8100%1.09448%0.475SS*.  0-36.20-71.4156.978.500113.8S3 F4M1-S3 PolarHBondContact O-N 3.16Å; M1-F4 PolarHBondContact O-N 3.34Å
2S61.2Low76.3Confident75 Ų7588.3 Ų88.352%0.52447%0.467SS..Hα-helixtrans-49-42.7-17652.80000116.6F4 S5 T6S2-F4 VanDerWaalsContact C-N 3.35Å; S2-F4 PolarHBondContact O-N 3.05Å; S2-S5 WeakPolarHBondContact O-CB 3.41Å; S2-S5 PolarHBondContact O-N 3.29Å; S2-T6 PolarHBondContact O-N 3.32Å; S2-T6 PolarHBondContact O-OG1 2.92Å
3S61.4Low77.3Confident73 Ų7381.7 Ų81.751%0.5143%0.432SS..Hα-helixtrans-61.2-37.6-175.7-169.70000113.8M1 T6 R7M1-S3 PolarHBondContact O-N 3.16Å; S3-T6 PolarHBondContact O-N 3.02Å; S3-R7 PolarHBondContact O-N 3.31Å
4F69.5Low78.3Confident170 Ų17077.5 Ų77.575%0.74641%0.412SS*.Hα-helixtrans-64.1-43.9177-175.9-99.7000111.2M1 S2 R7 A8M1-F4 PolarHBondContact O-N 3.34Å; S2-F4 VanDerWaalsContact C-N 3.35Å; S2-F4 PolarHBondContact O-N 3.05Å; F4-R7 PolarHBondContact O-N 3.36Å; F4-A8 WeakPolarHBondContact O-CB 3.49Å; F4-A8 PolarHBondContact O-N 3Å
5S79.8Confident79.4Confident51 Ų5178.3 Ų78.336%0.35742%0.421SS..Hα-helixtrans-58.3-49.2172.3158.50000111.7S2 R7 A8 L9S2-S5 WeakPolarHBondContact O-CB 3.41Å; S2-S5 PolarHBondContact O-N 3.29Å; S5-R7 VanDerWaalsContact C-N 3.29Å; S5-R7 PolarHBondContact O-N 3.2Å; S5-A8 PolarHBondContact O-N 3.35Å; S5-A8 VanDerWaalsContact O-N 3.16Å; S5-L9 WeakPolarHBondContact O-CD1 3.4Å; S5-L9 PolarHBondContact O-N 2.89Å; S5-L9 WeakPolarHBondContact OG-CD1 3.42Å
6T78.1Confident80.3Confident15 Ų1577.4 Ų77.49%0.09241%0.412CS..Hα-helixtrans-60.5-36.5179.9-56.40000112.4S2 S3 T10 L199 K202S2-T6 PolarHBondContact O-N 3.32Å; S2-T6 PolarHBondContact O-OG1 2.92Å; S3-T6 PolarHBondContact O-N 3.02Å; T6-T10 PolarHBondContact O-N 3.01Å; T6-T10 PolarHBondContact O-OG1 2.91Å; T6-L199 HydrophobicContact CG2-CD2 3.86Å; T6-K202 PolarHBondContact OG1-NZ 3.21Å
7R82.1Confident81.1Confident181 Ų18172.8 Ų72.868%0.68339%0.388SS*.Hα-helixtrans-68.9-47173-69.9-176.8-178-166.30.2112S3 F4 S5 L9 T10 L11S3-R7 PolarHBondContact O-N 3.31Å; F4-R7 PolarHBondContact O-N 3.36Å; S5-R7 VanDerWaalsContact C-N 3.29Å; S5-R7 PolarHBondContact O-N 3.2Å; R7-L9 PolarHBondContact O-N 3.32Å; R7-T10 WeakPolarHBondContact O-CB 3.39Å; R7-T10 PolarHBondContact O-N 3.21Å; R7-T10 VanDerWaalsContact O-N 3.09Å; R7-L11 PolarHBondContact O-N 3.46Å
8A85.4Confident82Confident46 Ų4670.4 Ų70.438%0.3838%0.38SS..Hα-helixtrans-59.3-44.3178.800000112.6F4 S5 T10 L11 L12F4-A8 WeakPolarHBondContact O-CB 3.49Å; F4-A8 PolarHBondContact O-N 3Å; S5-A8 PolarHBondContact O-N 3.35Å; S5-A8 VanDerWaalsContact O-N 3.16Å; A8-T10 VanDerWaalsContact C-N 3.3Å; A8-T10 PolarHBondContact O-N 3.44Å; A8-L11 PolarHBondContact O-N 2.93Å; A8-L12 WeakPolarHBondContact O-CB 3.4Å; A8-L12 PolarHBondContact O-N 3.17Å
9L84.1Confident82.7Confident30 Ų3069.3 Ų69.316%0.15738%0.377CS..Hα-helixtrans-60.3-38.3173.7-90.187.8000112.4S5 R7 L12 S13 M195 Y198 L199S5-L9 WeakPolarHBondContact O-CD1 3.4Å; S5-L9 PolarHBondContact O-N 2.89Å; S5-L9 WeakPolarHBondContact OG-CD1 3.42Å; R7-L9 PolarHBondContact O-N 3.32Å; L9-L12 PolarHBondContact O-N 3.09Å; L9-S13 WeakPolarHBondContact O-CB 3.47Å; L9-S13 PolarHBondContact O-N 3.39Å; L9-M195 HydrophobicContact CB-CE 4.48Å; L9-M195 HydrophobicContact CD2-CE 3.74Å; L9-M195 HydrophobicContact CD2-SD 4.04Å; L9-M195 HydrophobicContact CG-CE 3.67Å; L9-Y198 HydrophobicContact CD2-CD1 3.6Å; L9-Y198 HydrophobicContact CD2-CE1 3.68Å; L9-L199 HydrophobicContact CB-CD1 4.08Å; L9-L199 HydrophobicContact CB-CD2 3.78Å; L9-L199 HydrophobicContact CB-CG 4.06Å; L9-L199 HydrophobicContact CD2-CD2 4.39Å; L9-L199 HydrophobicContact CD2-CG 4.4Å
10T85.3Confident83.4Confident28 Ų2865.8 Ų65.817%0.17236%0.358CS..Hα-helixtrans-67.2-42.2-179.6-52.80000110.9T6 R7 A8 S14 R203T6-T10 PolarHBondContact O-N 3.01Å; T6-T10 PolarHBondContact O-OG1 2.91Å; R7-T10 WeakPolarHBondContact O-CB 3.39Å; R7-T10 PolarHBondContact O-N 3.21Å; R7-T10 VanDerWaalsContact O-N 3.09Å; A8-T10 VanDerWaalsContact C-N 3.3Å; A8-T10 PolarHBondContact O-N 3.44Å; T10-S14 PolarHBondContact O-N 3.4Å; T10-R203 PolarHBondContact OG1-NH2 3.22Å
11L88.4Confident84Confident97 Ų9764.7 Ų64.751%0.50835%0.352SS..Hα-helixtrans-65.7-44.2174.3-66.1174.7000111.8R7 A8 S13 S14 V15R7-L11 PolarHBondContact O-N 3.46Å; A8-L11 PolarHBondContact O-N 2.93Å; L11-S13 PolarHBondContact O-N 3.35Å; L11-S14 PolarHBondContact O-N 3.04Å; L11-V15 WeakPolarHBondContact O-CG2 3.37Å; L11-V15 PolarHBondContact O-N 2.74Å
12L90.3Very high86.2Confident72 Ų7259.5 Ų59.538%0.37733%0.328SS..Hα-helixtrans-61.5-43.5179.6-171.168000112A8 L9 S14 V15 F16 M195A8-L12 WeakPolarHBondContact O-CB 3.4Å; A8-L12 PolarHBondContact O-N 3.17Å; L9-L12 PolarHBondContact O-N 3.09Å; L12-S14 PolarHBondContact O-N 3.29Å; L12-V15 PolarHBondContact O-N 3.37Å; L12-F16 HydrophobicContact CD1-CD1 4.23Å; L12-F16 HydrophobicContact CD1-CE1 3.55Å; L12-F16 HydrophobicContact CD1-CE2 4.34Å; L12-F16 HydrophobicContact CD1-CZ 3.63Å; L12-F16 HydrophobicContact CD2-CE2 4.21Å; L12-F16 HydrophobicContact CD2-CZ 4.1Å; L12-F16 HydrophobicContact CG-CD1 4.47Å; L12-F16 HydrophobicContact CG-CD2 4.42Å; L12-F16 HydrophobicContact CG-CE1 4.03Å; L12-F16 HydrophobicContact CG-CE2 3.97Å; L12-F16 HydrophobicContact CG-CZ 3.77Å; L12-F16 WeakPolarHBondContact O-CB 3.35Å; L12-F16 WeakPolarHBondContact O-CG 3.39Å; L12-F16 PolarHBondContact O-N 2.78Å; L12-M195 HydrophobicContact CD2-CE 3.95Å
13S90.1Very high87.8Confident2 Ų257.7 Ų57.71%0.01431%0.312CS..Hα-helixtrans-61.4-42.2175.1179.40000112L9 L11 F16 G17 A192 S196L9-S13 WeakPolarHBondContact O-CB 3.47Å; L9-S13 PolarHBondContact O-N 3.39Å; L11-S13 PolarHBondContact O-N 3.35Å; S13-F16 PolarHBondContact O-N 3.16Å; S13-G17 PolarHBondContact O-N 3.45Å; S13-A192 PolarHBondContact OG-O 2.89Å; S13-S196 PolarHBondContact OG-OG 2.88Å
14S90.7Very high89.4Confident23 Ų2354.2 Ų54.216%0.16129%0.288CS..Hα-helixtrans-64.1-42.3175.4-174.90000112.6T10 L11 L12 G17 A18T10-S14 PolarHBondContact O-N 3.4Å; L11-S14 PolarHBondContact O-N 3.04Å; L12-S14 PolarHBondContact O-N 3.29Å; S14-G17 PolarHBondContact O-N 2.96Å; S14-A18 WeakPolarHBondContact O-CB 3.11Å; S14-A18 PolarHBondContact O-N 2.88Å
15V94.4Very high90.6Very high90 Ų9047.4 Ų47.455%0.54527%0.265SS..Hα-helixtrans-64.6-42.3175.9170.70000111.7L11 L12 A18 C19L11-V15 WeakPolarHBondContact O-CG2 3.37Å; L11-V15 PolarHBondContact O-N 2.74Å; L12-V15 PolarHBondContact O-N 3.37Å; V15-A18 PolarHBondContact O-N 2.99Å; V15-C19 VanDerWaalsContact O-CB 3.3Å; V15-C19 WeakPolarHBondContact O-CB 3.34Å; V15-C19 PolarHBondContact O-N 3.28Å
16F94.6Very high91.2Very high63 Ų6348 Ų4828%0.27627%0.267SS..Hα-helixtrans-65.6-39.5175.1-71-1000111.7L12 S13 C19 G20 L188 A192L12-F16 HydrophobicContact CD1-CD1 4.23Å; L12-F16 HydrophobicContact CD1-CE1 3.55Å; L12-F16 HydrophobicContact CD1-CE2 4.34Å; L12-F16 HydrophobicContact CD1-CZ 3.63Å; L12-F16 HydrophobicContact CD2-CE2 4.21Å; L12-F16 HydrophobicContact CD2-CZ 4.1Å; L12-F16 HydrophobicContact CG-CD1 4.47Å; L12-F16 HydrophobicContact CG-CD2 4.42Å; L12-F16 HydrophobicContact CG-CE1 4.03Å; L12-F16 HydrophobicContact CG-CE2 3.97Å; L12-F16 HydrophobicContact CG-CZ 3.77Å; L12-F16 WeakPolarHBondContact O-CB 3.35Å; L12-F16 WeakPolarHBondContact O-CG 3.39Å; L12-F16 PolarHBondContact O-N 2.78Å; S13-F16 PolarHBondContact O-N 3.16Å; F16-C19 PolarHBondContact O-N 3Å; F16-G20 PolarHBondContact O-N 3.37Å; F16-L188 HydrophobicContact CB-CD2 4.42Å; F16-L188 HydrophobicContact CD1-CD2 4.13Å; F16-L188 HydrophobicContact CG-CD2 4.18Å; F16-A192 HydrophobicContact CB-CB 3.97Å
17G94.3Very high91.9Very high0 Ų047.2 Ų47.20%026%0.262CS..Hα-helixtrans-62.6-44.4173.300000113.1S13 S14 L21S13-G17 PolarHBondContact O-N 3.45Å; S14-G17 PolarHBondContact O-N 2.96Å; G17-L21 VanDerWaalsContact O-CB 3.32Å; G17-L21 WeakPolarHBondContact O-CB 3.3Å; G17-L21 PolarHBondContact O-N 3.46Å
18A95.9Very high92.2Very high29 Ų2939 Ų3924%0.2423%0.232CC..Hα-helixtrans-63.4-44.7175.500000112.2S14 V15 L21 L22 F115S14-A18 WeakPolarHBondContact O-CB 3.11Å; S14-A18 PolarHBondContact O-N 2.88Å; V15-A18 PolarHBondContact O-N 2.99Å; A18-L21 PolarHBondContact O-N 3.31Å; A18-L22 WeakPolarHBondContact O-CG 3.39Å; A18-L22 PolarHBondContact O-N 3.13Å; A18-F115 HydrophobicContact CB-CD2 4.48Å; A18-F115 HydrophobicContact CB-CE2 3.69Å; A18-F115 HydrophobicContact CB-CZ 4.09Å
19C96.6Very high92.4Very high49 Ų4940.9 Ų40.933%0.33124%0.242SC..Hα-helixtrans-67.7-42.2178.6-169.10000111.7V15 F16 L21 L22 L23 L188V15-C19 VanDerWaalsContact O-CB 3.3Å; V15-C19 WeakPolarHBondContact O-CB 3.34Å; V15-C19 PolarHBondContact O-N 3.28Å; F16-C19 PolarHBondContact O-N 3Å; C19-L21 VanDerWaalsContact C-N 3.31Å; C19-L21 PolarHBondContact O-N 3.39Å; C19-L22 PolarHBondContact O-N 3.08Å; C19-L23 WeakPolarHBondContact O-CB 3.39Å; C19-L23 WeakPolarHBondContact O-CG 3.11Å; C19-L23 PolarHBondContact O-N 3.32Å; C19-L188 HydrophobicContact CB-CD1 3.95Å; C19-L188 VanDerWaalsContact SG-CD1 3.58Å
20G95.8Very high92.6Very high0 Ų041.3 Ų41.30%025%0.246CC..Hα-helixtrans-64-32.3173.600000113.6F16 V24 S185F16-G20 PolarHBondContact O-N 3.37Å; G20-V24 WeakPolarHBondContact O-CG1 3.24Å; G20-V24 PolarHBondContact O-N 2.83Å; G20-S185 WeakPolarHBondContact O-CB 3.3Å
21L95.9Very high92.6Very high42 Ų4241.9 Ų41.922%0.2225%0.248CC..Hα-helixtrans-69.4-46.3171.7-174.4155.1000111.5G17 A18 C19 V24 G25 V111 F112 F115G17-L21 VanDerWaalsContact O-CB 3.32Å; G17-L21 WeakPolarHBondContact O-CB 3.3Å; G17-L21 PolarHBondContact O-N 3.46Å; A18-L21 PolarHBondContact O-N 3.31Å; C19-L21 VanDerWaalsContact C-N 3.31Å; C19-L21 PolarHBondContact O-N 3.39Å; L21-V24 WeakPolarHBondContact O-CG1 3.29Å; L21-G25 PolarHBondContact O-N 2.96Å; L21-V111 HydrophobicContact CB-CG1 4.22Å; L21-V111 HydrophobicContact CB-CG2 4.08Å; L21-V111 HydrophobicContact CD1-CG1 4.45Å; L21-V111 HydrophobicContact CG-CG1 4.12Å; L21-F112 HydrophobicContact CD1-CB 4.44Å; L21-F112 HydrophobicContact CD1-CD2 4.32Å; L21-F115 HydrophobicContact CD1-CB 3.75Å; L21-F115 HydrophobicContact CD1-CD1 3.94Å; L21-F115 HydrophobicContact CD1-CG 3.96Å
22L96.6Very high92.5Very high113 Ų11343.1 Ų43.159%0.59225%0.247SC*.Hα-helixtrans-63.4-46.6177.5-76.6168.2000112.1A18 C19 G25 V26A18-L22 WeakPolarHBondContact O-CG 3.39Å; A18-L22 PolarHBondContact O-N 3.13Å; C19-L22 PolarHBondContact O-N 3.08Å; L22-G25 PolarHBondContact O-N 3.08Å; L22-V26 WeakPolarHBondContact O-CB 3.39Å; L22-V26 WeakPolarHBondContact O-CG2 3.18Å; L22-V26 PolarHBondContact O-N 2.86Å
23L95.4Very high92.3Very high37 Ų3739.8 Ų39.819%0.19423%0.229CC..Hα-helixtrans-65.8-39.8-179.6-70.9-174.9000112.7C19 A27 F181 L188C19-L23 WeakPolarHBondContact O-CB 3.39Å; C19-L23 WeakPolarHBondContact O-CG 3.11Å; C19-L23 PolarHBondContact O-N 3.32Å; L23-A27 VanDerWaalsContact O-CB 3.25Å; L23-A27 WeakPolarHBondContact O-CB 3.24Å; L23-A27 PolarHBondContact O-N 3.22Å; L23-F181 HydrophobicContact CB-CB 4.48Å; L23-F181 HydrophobicContact CD2-CB 4.31Å; L23-F181 HydrophobicContact CD2-CD1 4.03Å; L23-F181 HydrophobicContact CD2-CG 4.17Å; L23-L188 HydrophobicContact CD1-CD1 3.82Å
24V94.4Very high91.8Very high1 Ų139.7 Ų39.71%0.00623%0.229CC..Hα-helixtrans-71.2-34.2174.680.30000111.7G20 L21 A27 V28 V111 L145G20-V24 WeakPolarHBondContact O-CG1 3.24Å; G20-V24 PolarHBondContact O-N 2.83Å; L21-V24 WeakPolarHBondContact O-CG1 3.29Å; V24-A27 PolarHBondContact O-N 3.02Å; V24-V28 HydrophobicContact CG2-CG2 4.27Å; V24-V28 WeakPolarHBondContact O-CB 3.45Å; V24-V28 VanDerWaalsContact O-CG2 3.3Å; V24-V28 WeakPolarHBondContact O-CG2 3.4Å; V24-V28 PolarHBondContact O-N 3.18Å; V24-V111 HydrophobicContact CG1-CG1 3.85Å; V24-L145 HydrophobicContact CG2-CD1 4.13Å; V24-L145 HydrophobicContact CG2-CD2 4.03Å
25G93.5Very high91.2Very high26 Ų2640.8 Ų40.827%0.26823%0.233SC..Hα-helixtrans-61.6-51.6174.200000111.8L21 L22 V28 S29L21-G25 PolarHBondContact O-N 2.96Å; L22-G25 PolarHBondContact O-N 3.08Å; G25-V28 PolarHBondContact O-N 2.8Å; G25-S29 VanDerWaalsContact O-CB 3.31Å; G25-S29 WeakPolarHBondContact O-CB 3.2Å; G25-S29 PolarHBondContact O-N 3.46Å; G25-S29 PolarHBondContact O-OG 2.87Å
26V93.8Very high90.1Very high63 Ų6338.9 Ų38.938%0.38222%0.219SC..Hα-helixtrans-59.4-46.4174.7170.40000110.9L22 S29 T30 F181L22-V26 WeakPolarHBondContact O-CB 3.39Å; L22-V26 WeakPolarHBondContact O-CG2 3.18Å; L22-V26 PolarHBondContact O-N 2.86Å; V26-S29 PolarHBondContact O-N 2.87Å; V26-S29 PolarHBondContact O-OG 3.1Å; V26-T30 HydrophobicContact CG1-CG2 4.15Å; V26-T30 WeakPolarHBondContact O-CB 3.48Å; V26-T30 VanDerWaalsContact O-CG2 3.31Å; V26-T30 WeakPolarHBondContact O-CG2 3.43Å; V26-T30 PolarHBondContact O-N 3.1Å; V26-T30 VanDerWaalsContact O-N 3.11Å; V26-T30 PolarHBondContact O-OG1 2.9Å; V26-F181 HydrophobicContact CG1-CD2 4.21Å
27A91.8Very high88.7Confident0 Ų040.4 Ų40.40%023%0.227CC..Hα-helixtrans-58.3-51.8178.100000111.5L23 V24 S29 T30 W33 S178 F181 A182L23-A27 VanDerWaalsContact O-CB 3.25Å; L23-A27 WeakPolarHBondContact O-CB 3.24Å; L23-A27 PolarHBondContact O-N 3.22Å; V24-A27 PolarHBondContact O-N 3.02Å; A27-S29 PolarHBondContact O-N 3.33Å; A27-T30 PolarHBondContact O-N 2.91Å; A27-T30 PolarHBondContact O-OG1 3.41Å; A27-W33 HydrophobicContact CB-CZ2 4.21Å; A27-W33 PolarHBondContact O-NE1 3.33Å; A27-S178 VanDerWaalsContact CB-O 3.28Å; A27-S178 WeakPolarHBondContact CB-O 3.32Å; A27-F181 HydrophobicContact CB-CB 4.39Å; A27-A182 HydrophobicContact CB-CB 4.03Å
28V89.4Confident87.1Confident8 Ų843.4 Ų43.45%0.04824%0.241CC..Hα-helixtrans-66.1-24.1-179.9173.20000112.6V24 G25 W59 P104 M105 L108V24-V28 HydrophobicContact CG2-CG2 4.27Å; V24-V28 WeakPolarHBondContact O-CB 3.45Å; V24-V28 VanDerWaalsContact O-CG2 3.3Å; V24-V28 WeakPolarHBondContact O-CG2 3.4Å; V24-V28 PolarHBondContact O-N 3.18Å; G25-V28 PolarHBondContact O-N 2.8Å; V28-W59 HydrophobicContact CG1-CZ2 3.9Å; V28-W59 PolarHBondContact O-NE1 3.49Å; V28-P104 HydrophobicContact CG2-CB 4.15Å; V28-M105 HydrophobicContact CG1-CE 4.1Å; V28-M105 HydrophobicContact CG1-SD 4.48Å; V28-L108 HydrophobicContact CB-CD1 4.14Å; V28-L108 HydrophobicContact CG1-CD1 4.25Å; V28-L108 HydrophobicContact CG2-CD1 4.31Å
29S88.8Confident85.1Confident86 Ų8642.8 Ų42.860%0.60124%0.237SC*.THydrogen-bonded Turntrans-95.10.1179.579.50000115.6G25 V26 A27G25-S29 VanDerWaalsContact O-CB 3.31Å; G25-S29 WeakPolarHBondContact O-CB 3.2Å; G25-S29 PolarHBondContact O-N 3.46Å; G25-S29 PolarHBondContact O-OG 2.87Å; V26-S29 PolarHBondContact O-N 2.87Å; V26-S29 PolarHBondContact O-OG 3.1Å; A27-S29 PolarHBondContact O-N 3.33Å
30T89.3Confident83Confident39 Ų3941.8 Ų41.824%0.23923%0.228CC..  trans-121.2137-174.248.90000112.6V26 A27 Y32 W33 S178V26-T30 HydrophobicContact CG1-CG2 4.15Å; V26-T30 WeakPolarHBondContact O-CB 3.48Å; V26-T30 VanDerWaalsContact O-CG2 3.31Å; V26-T30 WeakPolarHBondContact O-CG2 3.43Å; V26-T30 PolarHBondContact O-N 3.1Å; V26-T30 VanDerWaalsContact O-N 3.11Å; V26-T30 PolarHBondContact O-OG1 2.9Å; A27-T30 PolarHBondContact O-N 2.91Å; A27-T30 PolarHBondContact O-OG1 3.41Å; T30-Y32 PolarHBondContact O-N 3.32Å; T30-W33 VanDerWaalsContact O-CD1 3.27Å; T30-S178 WeakPolarHBondContact OG1-CB 3.43Å; T30-S178 PolarHBondContact OG1-OG 2.91Å
31D84Confident80.8Confident40 Ų4044.1 Ų44.121%0.21424%0.242CC..SBendtrans-85.632.2-173.1-57.2-53.5000114.1H55 S56D31-H55 CarbonylContact O-C 3.58Å; D31-H55 WeakPolarHBondContact O-CB 3.25Å; D31-S56 CarbonylContact O-C 3.2Å
32Y86.5Confident78.6Confident123 Ų12346.6 Ų46.648%0.48226%0.255SS..  trans-119.347.2-176.1-66-99.4000112T30 H55 G176 W177 S178T30-Y32 PolarHBondContact O-N 3.32Å; Y32-H55 AromaticContact CD1-CE1 3.92Å; Y32-H55 AromaticContact CD1-ND1 3.27Å; Y32-H55 VanDerWaalsContact CD1-ND1 3.27Å; Y32-H55 WeakPolarHBondContact CD1-ND1 3.25Å; Y32-H55 AromaticContact CE1-CE1 3.67Å; Y32-H55 AromaticContact CE1-ND1 3.31Å; Y32-H55 VanDerWaalsContact CE1-ND1 3.31Å; Y32-H55 WeakPolarHBondContact CE1-ND1 3.49Å; Y32-G176 CarbonylContact O-C 3.57Å; Y32-G176 WeakPolarHBondContact O-CA 3.36Å; Y32-W177 PolarHBondContact O-N 2.9Å; Y32-S178 WeakPolarHBondContact CB-OG 3.3Å; Y32-S178 VanDerWaalsContact O-CB 3.24Å; Y32-S178 WeakPolarHBondContact O-CB 3.34Å; Y32-S178 PolarHBondContact O-N 3.38Å; Y32-S178 VanDerWaalsContact O-N 3.1Å; Y32-S178 PolarHBondContact O-OG 3.43Å
33W86.4Confident76.2Confident1 Ų149.1 Ų49.10%0.00426%0.264CS..SBendtrans-83.9-44.6174.2-74.860.7000111.8A27 T30 S56 L58 L149 Y152 G176 F179 A182A27-W33 HydrophobicContact CB-CZ2 4.21Å; A27-W33 PolarHBondContact O-NE1 3.33Å; T30-W33 VanDerWaalsContact O-CD1 3.27Å; W33-S56 WeakPolarHBondContact CA-O 3.47Å; W33-S56 WeakPolarHBondContact CB-O 3.33Å; W33-S56 PolarHBondContact N-O 2.78Å; W33-L58 HydrophobicContact CZ2-CD2 4.34Å; W33-L149 HydrophobicContact CH2-CD2 4.18Å; W33-L149 HydrophobicContact CZ3-CD2 3.7Å; W33-Y152 HydrophobicContact CB-CE1 4.42Å; W33-Y152 WeakPolarHBondContact CB-OH 3.4Å; W33-Y152 HydrophobicContact CE3-CD1 4.13Å; W33-Y152 AromaticContact CE3-CE1 3.84Å; W33-Y152 HydrophobicContact CE3-CE1 3.84Å; W33-Y152 HydrophobicContact CE3-CE2 4.39Å; W33-Y152 AromaticContact CE3-CZ 3.98Å; W33-Y152 HydrophobicContact CZ3-CD1 4.49Å; W33-G176 PolarHBondContact O-N 3.49Å; W33-F179 HydrophobicContact CE3-CD2 4.42Å; W33-A182 HydrophobicContact CH2-CB 4.15Å
34L79.2Confident73.9Confident1 Ų156.4 Ų56.41%0.00530%0.297CS..EExtended strand (participates in β ladder)trans-129.6140.1173.8-72.9169.1000110.4H55 S56 Y152 I156 Y173 H174 Y175L34-H55 WeakPolarHBondContact O-CA 3.09Å; L34-S56 PolarHBondContact N-O 2.94Å; L34-S56 VanDerWaalsContact N-O 3.11Å; L34-S56 PolarHBondContact O-N 3.34Å; L34-Y152 HydrophobicContact CD1-CE1 4.1Å; L34-Y152 WeakPolarHBondContact CD1-OH 3.47Å; L34-Y152 HydrophobicContact CG-CE1 4.22Å; L34-Y152 WeakPolarHBondContact CG-OH 3.47Å; L34-I156 HydrophobicContact CD1-CB 4.37Å; L34-I156 HydrophobicContact CD1-CD1 3.66Å; L34-I156 HydrophobicContact CD1-CG1 3.76Å; L34-I156 HydrophobicContact CD1-CG2 3.82Å; L34-Y173 HydrophobicContact CD2-CD2 4.17Å; L34-H174 WeakPolarHBondContact CA-O 3.5Å; L34-Y175 HydrophobicContact CD2-CD1 3.68Å; L34-Y175 HydrophobicContact CD2-CE1 3.86Å; L34-Y175 HydrophobicContact CD2-CG 4.32Å
35L78.4Confident71.7Confident45 Ų4561.4 Ų61.424%0.23632%0.324CS..EExtended strand (participates in β ladder)trans-102.7132161.7-82.762.7000106.8H55 Y173 H174L35-H55 WeakPolarHBondContact CD1-ND1 3.3Å; L35-Y173 CarbonylContact O-C 3.59Å; L35-Y173 WeakPolarHBondContact O-CA 3.42Å; L35-H174 HydrophobicContact CB-CB 4.33Å; L35-H174 PolarHBondContact N-O 3.19Å; L35-H174 PolarHBondContact O-N 2.97Å
36M71.2Confident69.6Low51 Ų5169.4 Ų69.425%0.25135%0.354SS..EExtended strand (participates in β ladder)trans-126.7119.7176.4-66.5156.952.900107.8L54 F171M36-L54 HydrophobicContact CB-CD1 3.74Å; M36-L54 HydrophobicContact CB-CG 4.08Å; M36-L54 HydrophobicContact CE-CD1 4.02Å; M36-L54 HydrophobicContact CG-CD1 4.16Å; M36-L54 PolarHBondContact N-O 3.15Å; M36-L54 PolarHBondContact O-N 3.32Å; M36-L54 HydrophobicContact SD-CD1 3.69Å; M36-F171 HydrophobicContact CB-CE2 4.02Å; M36-F171 HydrophobicContact CB-CZ 3.84Å; M36-F171 HydrophobicContact CE-CE2 4.02Å; M36-F171 HydrophobicContact CE-CZ 3.61Å; M36-F171 HydrophobicContact CG-CE2 4.37Å; M36-F171 HydrophobicContact CG-CZ 3.7Å; M36-F171 HydrophobicContact SD-CZ 4.3Å
37E65.8Low67.5Low95 Ų9570.2 Ų70.244%0.44436%0.359SS..EExtended strand (participates in β ladder)trans-111.4121.8177.4-66.9-174.4-177.200108.9A53 H172E37-A53 HydrophobicContact CG-CB 4.3Å; E37-H172 PolarHBondContact N-O 3.14Å; E37-H172 PolarHBondContact O-N 2.94Å
38E61.2Low65.5Low63 Ų6377.2 Ų77.229%0.29439%0.394SS..EExtended strand (participates in β ladder)trans-112.9101.7-178.4-166.5-177.2161.900109.9K51 M52 Q169E38-K51 PolarHBondContact O-N 3.45Å; E38-M52 PolarHBondContact N-O 3.39Å; E38-M52 PolarHBondContact O-N 2.77Å; E38-Q169 PolarHBondContact OE1-NE2 3.01Å
39G54.3Low63.6Low16 Ų1682.5 Ų82.517%0.16542%0.418CS..EExtended strand (participates in β ladder)trans-103.1139.3174.100000111.6F170G39-F170 PolarHBondContact O-N 2.89Å
40I52.1Low62.1Low28 Ų2882.1 Ų82.114%0.14441%0.412CS..EExtended strand (participates in β ladder)trans-90.7139.7158.953.7150.2000109.3L42 E49 K51 Q169I40-L42 HydrophobicContact CD1-CD1 4.2Å; I40-L42 PolarHBondContact O-N 2.97Å; I40-E49 PolarHBondContact N-O 3.06Å; I40-K51 HydrophobicContact CD1-CD 4.16Å; I40-K51 VanDerWaalsContact CD1-CE 3.46Å; I40-K51 HydrophobicContact CG1-CD 3.87Å; I40-K51 HydrophobicContact CG1-CG 4.11Å; I40-K51 HydrophobicContact CG2-CD 3.94Å; I40-Q169 HydrophobicContact CG2-CG 4.18Å
41V48.7Very low60.5Low48 Ų4885.6 Ų85.629%0.29142%0.423SS..EExtended strand (participates in β ladder)trans-91.597.2166173.50000107.5Q43 E168 F170V41-Q43 PolarHBondContact O-N 2.84Å; V41-E168 PolarHBondContact N-O 2.95Å; V41-F170 HydrophobicContact CB-CD2 4.13Å; V41-F170 HydrophobicContact CB-CE2 4.04Å; V41-F170 HydrophobicContact CG2-CD2 3.4Å; V41-F170 VanDerWaalsContact CG2-CD2 3.4Å; V41-F170 HydrophobicContact CG2-CE2 3.58Å; V41-F170 HydrophobicContact CG2-CG 4.23Å
42L50.3Low59.5Low95 Ų9586.9 Ų86.950%0.49743%0.429SS..  trans-68.2101.2175.1-163.175.8000108.7I40 Q44 N45I40-L42 HydrophobicContact CD1-CD1 4.2Å; I40-L42 PolarHBondContact O-N 2.97Å; L42-Q44 PolarHBondContact O-N 3.37Å; L42-N45 PolarHBondContact O-N 3.46Å; L42-N45 VanDerWaalsContact O-N 3.15Å
43Q46.5Very low58.6Low165 Ų16581.7 Ų81.777%0.77141%0.411SS*.THydrogen-bonded Turntrans-50.6-24.1-163.9-155.7-171.4111.100115V41 E168V41-Q43 PolarHBondContact O-N 2.84Å; Q43-E168 PolarHBondContact NE2-OE1 3.34Å
44Q46.6Very low57.9Low190 Ų19082.9 Ų82.989%0.88842%0.418SS*.THydrogen-bonded Turntrans-100.6-4.3-171.4-164.4161.4-8.200115.7L42L42-Q44 PolarHBondContact O-N 3.37Å
45N49.1Very low58Low107 Ų10784.4 Ų84.457%0.57243%0.425SS*.THydrogen-bonded Turntrans-138.76.3-176.3-159.149.4000116.9L42 T47L42-N45 PolarHBondContact O-N 3.46Å; L42-N45 VanDerWaalsContact O-N 3.15Å; N45-T47 PolarHBondContact O-N 3.25Å
46Q48.9Very low57.9Low193 Ų19382.9 Ų82.990%0.90242%0.418SS*.  trans58.60.7170.4-141.217513.300117.4
47T49.2Very low58.2Low80 Ų8080.6 Ų80.649%0.49141%0.407SS..  trans-87.9119.8172.9500000110.5N45 E49N45-T47 PolarHBondContact O-N 3.25Å; T47-E49 PolarHBondContact O-N 2.98Å
48M49.8Very low58.6Low148 Ų14876.5 Ų76.573%0.72939%0.388SS*.EExtended strand (participates in β ladder)trans-70.4107.7169.6-71.2174.2165.500109.6
49E50.2Low59.3Low118 Ų11877.9 Ų77.955%0.55139%0.391SS*.EExtended strand (participates in β ladder)trans-91.2110.6173.5-169.1173-146.100109.1I40 T47 K51I40-E49 PolarHBondContact N-O 3.06Å; T47-E49 PolarHBondContact O-N 2.98Å; E49-K51 PolarHBondContact O-N 2.89Å
50V56.6Low60.4Low78 Ų7884.2 Ų84.247%0.47341%0.41SS..EExtended strand (participates in β ladder)trans-70.994176.2-178.50000108.1A53V50-A53 HydrophobicContact CG1-CB 4.17Å
51K56.5Low61.7Low112 Ų11283.9 Ų83.949%0.48741%0.409SS..EExtended strand (participates in β ladder)trans-69.9-41.9-177.2-100.1-172.5-179.81720111.8E38 I40 E49 G66E38-K51 PolarHBondContact O-N 3.45Å; I40-K51 HydrophobicContact CD1-CD 4.16Å; I40-K51 VanDerWaalsContact CD1-CE 3.46Å; I40-K51 HydrophobicContact CG1-CD 3.87Å; I40-K51 HydrophobicContact CG1-CG 4.11Å; I40-K51 HydrophobicContact CG2-CD 3.94Å; E49-K51 PolarHBondContact O-N 2.89Å; K51-G66 WeakPolarHBondContact O-CA 3.48Å
52M61.7Low63.2Low68 Ų6882.7 Ų82.734%0.33540%0.403SS..EExtended strand (participates in β ladder)trans-142.1145.6173.9-59-161.8-164.400111E38 A65 P67E38-M52 PolarHBondContact N-O 3.39Å; E38-M52 PolarHBondContact O-N 2.77Å; M52-A65 WeakPolarHBondContact CA-O 3.5Å; M52-P67 HydrophobicContact CE-CG 4.14Å
53A67.6Low64.6Low13 Ų1380.3 Ų80.311%0.10739%0.388CS..EExtended strand (participates in β ladder)trans-138.2130.1168.500000108.4E37 V50 V64 A65E37-A53 HydrophobicContact CG-CB 4.3Å; V50-A53 HydrophobicContact CG1-CB 4.17Å; A53-V64 PolarHBondContact O-N 3.35Å; A53-A65 HydrophobicContact CB-CB 3.87Å; A53-A65 PolarHBondContact N-O 2.98Å; A53-A65 VanDerWaalsContact N-O 3.13Å; A53-A65 PolarHBondContact O-N 2.94Å
54L71.7Confident66Low27 Ų2775.8 Ų75.814%0.14137%0.372CS..EExtended strand (participates in β ladder)trans-136.9153.9-174.464.981.4000112.3M36 V61 C62 F63M36-L54 HydrophobicContact CB-CD1 3.74Å; M36-L54 HydrophobicContact CB-CG 4.08Å; M36-L54 HydrophobicContact CE-CD1 4.02Å; M36-L54 HydrophobicContact CG-CD1 4.16Å; M36-L54 PolarHBondContact N-O 3.15Å; M36-L54 PolarHBondContact O-N 3.32Å; M36-L54 HydrophobicContact SD-CD1 3.69Å; L54-V61 HydrophobicContact CB-CG1 4.27Å; L54-V61 HydrophobicContact CD1-CG1 3.79Å; L54-V61 HydrophobicContact CD2-CG1 4.26Å; L54-V61 HydrophobicContact CG-CG1 4.34Å; L54-C62 WeakPolarHBondContact CA-O 3.36Å; L54-F63 HydrophobicContact CB-CD1 4Å; L54-F63 HydrophobicContact CB-CE1 4.37Å; L54-F63 HydrophobicContact CD2-CD1 4.15Å; L54-F63 HydrophobicContact CD2-CE1 3.71Å
55H81.6Confident67.1Low33 Ų3368.1 Ų68.115%0.15334%0.341CS..EExtended strand (participates in β ladder)trans-114.9127.8174.2-65.3-111.6000108.2D31 Y32 L34 L35 V61 C62 V64D31-H55 CarbonylContact O-C 3.58Å; D31-H55 WeakPolarHBondContact O-CB 3.25Å; Y32-H55 AromaticContact CD1-CE1 3.92Å; Y32-H55 AromaticContact CD1-ND1 3.27Å; Y32-H55 VanDerWaalsContact CD1-ND1 3.27Å; Y32-H55 WeakPolarHBondContact CD1-ND1 3.25Å; Y32-H55 AromaticContact CE1-CE1 3.67Å; Y32-H55 AromaticContact CE1-ND1 3.31Å; Y32-H55 VanDerWaalsContact CE1-ND1 3.31Å; Y32-H55 WeakPolarHBondContact CE1-ND1 3.49Å; L34-H55 WeakPolarHBondContact O-CA 3.09Å; L35-H55 WeakPolarHBondContact CD1-ND1 3.3Å; H55-V61 WeakPolarHBondContact O-CA 3.5Å; H55-C62 PolarHBondContact N-O 3.37Å; H55-C62 PolarHBondContact O-N 2.98Å; H55-V64 VanDerWaalsContact CD2-CG2 3.41Å; H55-V64 WeakPolarHBondContact CD2-CG2 3.28Å
56S75.7Confident68.1Low13 Ų1364.4 Ų64.49%0.09133%0.328CS..EExtended strand (participates in β ladder)trans-111.2127-178.7-175.30000110.2D31 W33 L34D31-S56 CarbonylContact O-C 3.2Å; W33-S56 WeakPolarHBondContact CA-O 3.47Å; W33-S56 WeakPolarHBondContact CB-O 3.33Å; W33-S56 PolarHBondContact N-O 2.78Å; L34-S56 PolarHBondContact N-O 2.94Å; L34-S56 VanDerWaalsContact N-O 3.11Å; L34-S56 PolarHBondContact O-N 3.34Å
57G79.2Confident68.8Low3 Ų360.6 Ų60.63%0.03132%0.32CS..  trans-98.8-176.5167.600000112.6W59 R60G57-W59 PolarHBondContact O-N 2.76Å; G57-R60 WeakPolarHBondContact CA-O 3.34Å; G57-R60 PolarHBondContact N-O 3.39Å
58L73.8Confident69.7Low8 Ų861 Ų614%0.04232%0.316CS..SBendtrans-72.5-14.1175.4-165.162.4000113.1W33 T101 P104 Y152W33-L58 HydrophobicContact CZ2-CD2 4.34Å; L58-T101 HydrophobicContact CD1-CG2 3.94Å; L58-T101 HydrophobicContact CG-CG2 4.28Å; L58-P104 HydrophobicContact CD2-CB 3.82Å; L58-P104 HydrophobicContact CD2-CG 3.95Å; L58-Y152 HydrophobicContact CD1-CD2 4.32Å; L58-Y152 HydrophobicContact CD1-CE2 4.39Å
59W75.9Confident70.9Confident92 Ų9261.3 Ų61.335%0.34831%0.314SS..SBendtrans-130.7-25.3-172.9-43104.2000114.4V28 G57 S75 M105V28-W59 HydrophobicContact CG1-CZ2 3.9Å; V28-W59 PolarHBondContact O-NE1 3.49Å; G57-W59 PolarHBondContact O-N 2.76Å; W59-S75 PolarHBondContact O-N 3.44Å; W59-M105 HydrophobicContact CH2-CE 3.78Å; W59-M105 HydrophobicContact CH2-CG 3.59Å; W59-M105 HydrophobicContact CZ2-CE 3.4Å; W59-M105 HydrophobicContact CZ2-CG 3.79Å; W59-M105 HydrophobicContact CZ2-SD 4.36Å
60R77.3Confident72.1Confident149 Ų14958.7 Ų58.756%0.56232%0.319SS*.EExtended strand (participates in β ladder)trans-143.3154.3-169.4-64.9179178.4-172-2.5110.6G57 V73G57-R60 WeakPolarHBondContact CA-O 3.34Å; G57-R60 PolarHBondContact N-O 3.39Å; R60-V73 CarbonylContact C-O 3.58Å; R60-V73 VanDerWaalsContact CA-O 3.3Å; R60-V73 WeakPolarHBondContact CA-O 3.42Å
61V78Confident73.2Confident22 Ų2261 Ų6113%0.13332%0.319CS..EExtended strand (participates in β ladder)trans-124.8130.1173.1-177.10000108.2L54 H55 C72 V73L54-V61 HydrophobicContact CB-CG1 4.27Å; L54-V61 HydrophobicContact CD1-CG1 3.79Å; L54-V61 HydrophobicContact CD2-CG1 4.26Å; L54-V61 HydrophobicContact CG-CG1 4.34Å; H55-V61 WeakPolarHBondContact O-CA 3.5Å; V61-C72 CarbonylContact O-C 3.55Å; V61-C72 VanDerWaalsContact O-CA 3.29Å; V61-C72 WeakPolarHBondContact O-CA 3.4Å; V61-V73 PolarHBondContact N-O 3.42Å; V61-V73 PolarHBondContact O-N 2.76Å
62C80.9Confident74.4Confident22 Ų2259.2 Ų59.215%0.14932%0.319CS..EExtended strand (participates in β ladder)trans-119.4126.2-178.4-67.20000110.9L54 H55 C72L54-C62 WeakPolarHBondContact CA-O 3.36Å; H55-C62 PolarHBondContact N-O 3.37Å; H55-C62 PolarHBondContact O-N 2.98Å; C62-C72 HydrophobicContact CB-CB 4.16Å; C62-C72 WeakPolarHBondContact CB-SG 3.47Å; C62-C72 WeakPolarHBondContact SG-CB 3.36Å; C62-C72 CovalentContact SG-SG 2.04Å; C62-C72 PolarHBondContact SG-SG 2.85Å
63F79.7Confident75Confident45 Ų4558 Ų5820%0.19732%0.316CS..EExtended strand (participates in β ladder)trans-86.4123.1-179.9-62.9-84.3000110.7L54 E68 G70 R71 V73L54-F63 HydrophobicContact CB-CD1 4Å; L54-F63 HydrophobicContact CB-CE1 4.37Å; L54-F63 HydrophobicContact CD2-CD1 4.15Å; L54-F63 HydrophobicContact CD2-CE1 3.71Å; F63-E68 HydrophobicContact CB-CB 4.47Å; F63-E68 HydrophobicContact CD2-CB 4.35Å; F63-E68 HydrophobicContact CG-CB 4.33Å; F63-G70 PolarHBondContact O-N 3.27Å; F63-R71 HydrophobicContact CD2-CB 4.46Å; F63-R71 WeakPolarHBondContact CD2-O 3.44Å; F63-R71 PolarHBondContact N-O 2.95Å; F63-V73 HydrophobicContact CE2-CG2 4.15Å
64V76.8Confident75Confident70 Ų7060.5 Ų60.542%0.42434%0.336SS..EExtended strand (participates in β ladder)trans-106.6-28.9-176.2168.80000112.3A53 H55 K69A53-V64 PolarHBondContact O-N 3.35Å; H55-V64 VanDerWaalsContact CD2-CG2 3.41Å; H55-V64 WeakPolarHBondContact CD2-CG2 3.28Å; V64-K69 WeakPolarHBondContact O-CD 3.32Å; V64-K69 WeakPolarHBondContact O-CE 3.27Å; V64-K69 WeakPolarHBondContact O-CG 3.44Å
65A69.1Low74.4Confident30 Ų3060.3 Ų60.325%0.24834%0.337CS..EExtended strand (participates in β ladder)trans-134.6154.7167.200000111.1M52 A53M52-A65 WeakPolarHBondContact CA-O 3.5Å; A53-A65 HydrophobicContact CB-CB 3.87Å; A53-A65 PolarHBondContact N-O 2.98Å; A53-A65 VanDerWaalsContact N-O 3.13Å; A53-A65 PolarHBondContact O-N 2.94Å
66G70.9Confident73Confident29 Ų2964.8 Ų64.830%0.29936%0.358SS..SBendtrans112.7-177.7-172.700000113.1K51 E68 K69K51-G66 WeakPolarHBondContact O-CA 3.48Å; G66-E68 VanDerWaalsContact C-N 3.31Å; G66-E68 PolarHBondContact O-N 3.43Å; G66-K69 WeakPolarHBondContact O-CB 3.29Å; G66-K69 PolarHBondContact O-N 2.93Å
67P63.3Low71.6Confident113 Ų11366.9 Ų66.973%0.73437%0.365SS*.THydrogen-bonded Turntrans-68-28.4-176.727.1-34.5000113.4M52 K69M52-P67 HydrophobicContact CE-CG 4.14Å; P67-K69 VanDerWaalsContact C-N 3.28Å; P67-K69 PolarHBondContact O-N 3.38Å
68E67.3Low69.5Low87 Ų8775.2 Ų75.241%0.40740%0.4SS..THydrogen-bonded Turntrans-9122.4-178.7-67.7-76.4-178.300112.7F63 G66 G70 R71F63-E68 HydrophobicContact CB-CB 4.47Å; F63-E68 HydrophobicContact CD2-CB 4.35Å; F63-E68 HydrophobicContact CG-CB 4.33Å; G66-E68 VanDerWaalsContact C-N 3.31Å; G66-E68 PolarHBondContact O-N 3.43Å; E68-G70 PolarHBondContact O-N 3.36Å; E68-R71 HydrophobicContact CB-CB 4.47Å; E68-R71 WeakPolarHBondContact O-CB 3.37Å; E68-R71 PolarHBondContact O-N 3.35Å; E68-R71 IonicContact OE1-NH1 2.78Å; E68-R71 PolarHBondContact OE1-NH1 3.41Å; E68-R71 WeakPolarHBondContact OE2-CD 3.23Å; E68-R71 IonicContact OE2-CZ 3.72Å; E68-R71 IonicContact OE2-NE 2.89Å; E68-R71 IonicContact OE2-NH1 3.64Å; E68-R71 PolarHBondContact OE2-NH1 3.41Å
69K74.3Confident67.8Low155 Ų15578.7 Ų78.767%0.67442%0.422SS*.THydrogen-bonded Turntrans-55.3127.1-172.5177.4170.8-176.7171.80112.9V64 G66 P67 R71V64-K69 WeakPolarHBondContact O-CD 3.32Å; V64-K69 WeakPolarHBondContact O-CE 3.27Å; V64-K69 WeakPolarHBondContact O-CG 3.44Å; G66-K69 WeakPolarHBondContact O-CB 3.29Å; G66-K69 PolarHBondContact O-N 2.93Å; P67-K69 VanDerWaalsContact C-N 3.28Å; P67-K69 PolarHBondContact O-N 3.38Å; K69-R71 VanDerWaalsContact C-N 3.32Å
70G76.3Confident65.9Low64 Ų6480.1 Ų80.166%0.6643%0.433SS*.THydrogen-bonded Turntrans87.9-7.1-179.300000114.2F63 E68F63-G70 PolarHBondContact O-N 3.27Å; E68-G70 PolarHBondContact O-N 3.36Å
71R79.7Confident64.3Low127 Ų12777.4 Ų77.448%0.47944%0.435SS..  trans-73.1131.9169.4-172.6173.4172.5177.3-8109.5F63 E68 K69 V73F63-R71 HydrophobicContact CD2-CB 4.46Å; F63-R71 WeakPolarHBondContact CD2-O 3.44Å; F63-R71 PolarHBondContact N-O 2.95Å; E68-R71 HydrophobicContact CB-CB 4.47Å; E68-R71 WeakPolarHBondContact O-CB 3.37Å; E68-R71 PolarHBondContact O-N 3.35Å; E68-R71 IonicContact OE1-NH1 2.78Å; E68-R71 PolarHBondContact OE1-NH1 3.41Å; E68-R71 WeakPolarHBondContact OE2-CD 3.23Å; E68-R71 IonicContact OE2-CZ 3.72Å; E68-R71 IonicContact OE2-NE 2.89Å; E68-R71 IonicContact OE2-NH1 3.64Å; E68-R71 PolarHBondContact OE2-NH1 3.41Å; K69-R71 VanDerWaalsContact C-N 3.32Å; R71-V73 HydrophobicContact CG-CG2 3.99Å
72C81Confident62.3Low73 Ų7385.8 Ų85.849%0.49347%0.472SS..EExtended strand (participates in β ladder)trans-113.3126.8164-63.80000108.4V61 C62V61-C72 CarbonylContact O-C 3.55Å; V61-C72 VanDerWaalsContact O-CA 3.29Å; V61-C72 WeakPolarHBondContact O-CA 3.4Å; C62-C72 HydrophobicContact CB-CB 4.16Å; C62-C72 WeakPolarHBondContact CB-SG 3.47Å; C62-C72 WeakPolarHBondContact SG-CB 3.36Å; C62-C72 CovalentContact SG-SG 2.04Å; C62-C72 PolarHBondContact SG-SG 2.85Å
73V74.3Confident60.4Low42 Ų4290.8 Ų90.826%0.25550%0.496SS..EExtended strand (participates in β ladder)trans-108.1150.7175-164.50000107.6R60 V61 F63 R71 S75 E76R60-V73 CarbonylContact C-O 3.58Å; R60-V73 VanDerWaalsContact CA-O 3.3Å; R60-V73 WeakPolarHBondContact CA-O 3.42Å; V61-V73 PolarHBondContact N-O 3.42Å; V61-V73 PolarHBondContact O-N 2.76Å; F63-V73 HydrophobicContact CE2-CG2 4.15Å; R71-V73 HydrophobicContact CG-CG2 3.99Å; V73-S75 PolarHBondContact O-N 2.83Å; V73-E76 HydrophobicContact CG1-CG 4.47Å
74A69.3Low58.8Low66 Ų6698 Ų9855%0.54553%0.53SS..EExtended strand (participates in β ladder)trans-59.3136.6162.100000107.8E76A74-E76 PolarHBondContact O-N 3.14Å; A74-E76 VanDerWaalsContact O-N 3.16Å
75S59Low57.1Low23 Ų23101.2 Ų101.216%0.16154%0.544CS..  trans-61.2124.5176.4-166.20000107.6W59 V73 Y77W59-S75 PolarHBondContact O-N 3.44Å; V73-S75 PolarHBondContact O-N 2.83Å; S75-Y77 PolarHBondContact O-N 3.48Å; S75-Y77 WeakPolarHBondContact OG-CE2 3.46Å
76E50.9Low56.2Low127 Ų127106 Ų10659%0.59357%0.57SS**SBendtrans-76.749.6-163.3-67-161.9102.600114V73 A74 F78 T79V73-E76 HydrophobicContact CG1-CG 4.47Å; A74-E76 PolarHBondContact O-N 3.14Å; A74-E76 VanDerWaalsContact O-N 3.16Å; E76-F78 PolarHBondContact O-N 2.92Å; E76-T79 WeakPolarHBondContact OE1-CB 3.27Å; E76-T79 PolarHBondContact OE1-OG1 3.23Å
77Y47.6Very low55.3Low57 Ų57108.4 Ų108.422%0.22458%0.579CS.*SBendtrans-72.7-2.3160.3-62.9-65000112.9S75 V97 R98S75-Y77 PolarHBondContact O-N 3.48Å; S75-Y77 WeakPolarHBondContact OG-CE2 3.46Å; Y77-V97 HydrophobicContact CD1-CB 4.4Å; Y77-V97 HydrophobicContact CD1-CG1 4.26Å; Y77-V97 HydrophobicContact CE1-CB 3.87Å; Y77-V97 HydrophobicContact CE1-CG1 3.4Å; Y77-V97 VanDerWaalsContact CE1-CG1 3.4Å; Y77-R98 PolarHBondContact O-NE 3.25Å; Y77-R98 PolarHBondContact O-NH2 2.99Å
78F34.3Very low54.8Low178 Ų178111 Ų11178%0.78158%0.582SS**SBendtrans-123.8-10.3-174.8-97-79.8000115.7E76E76-F78 PolarHBondContact O-N 2.92Å
79T37.1Very low54.1Low81 Ų81112.8 Ų112.850%0.49759%0.594SS.*SBendtrans-84.7114165.8-44.30000106.5E76E76-T79 WeakPolarHBondContact OE1-CB 3.27Å; E76-T79 PolarHBondContact OE1-OG1 3.23Å
80E37.1Very low53Low122 Ų122108.5 Ų108.557%0.5758%0.581SS**  trans-58.1139.2168.6-105.165-120.400109.2E82 R98E80-E82 PolarHBondContact O-N 2.94Å; E80-R98 IonicContact OE1-CZ 3.73Å; E80-R98 VanDerWaalsContact OE1-CZ 3.24Å; E80-R98 IonicContact OE1-NH1 2.75Å; E80-R98 PolarHBondContact OE1-NH1 3.22Å; E80-R98 IonicContact OE1-NH2 3.24Å; E80-R98 PolarHBondContact OE1-NH2 3.43Å
81P43.2Very low51.8Low93 Ų93108.3 Ų108.360%0.60457%0.573SS**  trans-67.8100.4170.328.2-32.5000108.8I83P81-I83 PolarHBondContact O-N 3.29Å
82E36.3Very low50.4Low197 Ų197106.7 Ų106.792%0.92157%0.574SS**  trans-7348.7167.1-160.3-177.1178.700110.6E80E80-E82 PolarHBondContact O-N 2.94Å
83I41.6Very low48.9Very low128 Ų128106.6 Ų106.666%0.65657%0.567SS**SBendtrans-135.7105.1172.7-56.5-178.4000106.7P81 I85P81-I83 PolarHBondContact O-N 3.29Å; I83-I85 VanDerWaalsContact C-N 3.29Å; I83-I85 HydrophobicContact CG2-CD1 3.91Å; I83-I85 HydrophobicContact CG2-CG1 4.03Å; I83-I85 PolarHBondContact O-N 2.83Å
84E45.2Very low47.5Very low196 Ų196108 Ų10892%0.91657%0.574SS**  trans-67.775.2-179.5-171.6-172160.400111.6
85I40.5Very low46.6Very low137 Ų137111.5 Ų111.570%0.70358%0.576SS**  trans-123.5108.6172.1-64.1176.3000110.5I83 T87I83-I85 VanDerWaalsContact C-N 3.29Å; I83-I85 HydrophobicContact CG2-CD1 3.91Å; I83-I85 HydrophobicContact CG2-CG1 4.03Å; I83-I85 PolarHBondContact O-N 2.83Å; I85-T87 PolarHBondContact O-N 3.46Å
86T50.9Low46Very low131 Ų131115.8 Ų115.880%0.80460%0.595SS**  trans-64.1110.9-17651.40000113.6
87T51.2Low45.7Very low79 Ų79110.5 Ų110.549%0.48557%0.571SS.*  trans-148.7112.2152.535.20000110.4I85 N89 T90I85-T87 PolarHBondContact O-N 3.46Å; T87-N89 PolarHBondContact O-N 2.85Å; T87-N89 VanDerWaalsContact O-N 3.16Å; T87-T90 PolarHBondContact O-N 3.43Å; T87-T90 VanDerWaalsContact O-N 3.1Å; T87-T90 WeakPolarHBondContact OG1-CB 3.39Å; T87-T90 PolarHBondContact OG1-OG1 2.95Å
88E53.9Low46Very low169 Ų169112.3 Ų112.379%0.7958%0.578SS**Hα-helixtrans-58.9-29.6178.8-61.7-175.111000112.5N92E88-N92 PolarHBondContact O-N 3.21Å; E88-N92 PolarHBondContact O-ND2 2.95Å
89N52.6Low46.9Very low123 Ų123107.5 Ų107.566%0.65856%0.563SS**Hα-helixtrans-62.3-42.5176.9-60.13.3000111.8T87 N92 I93T87-N89 PolarHBondContact O-N 2.85Å; T87-N89 VanDerWaalsContact O-N 3.16Å; N89-N92 PolarHBondContact O-N 2.85Å; N89-I93 WeakPolarHBondContact O-CG1 3.14Å; N89-I93 PolarHBondContact O-N 3.44Å; N89-I93 VanDerWaalsContact O-N 3.11Å
90T51.3Low47.7Very low65 Ų65104 Ų10440%0.39954%0.542SS..Hα-helixtrans-69-38.3-176.7-52.90000111.5T87 N92 I93 L94T87-T90 PolarHBondContact O-N 3.43Å; T87-T90 VanDerWaalsContact O-N 3.1Å; T87-T90 WeakPolarHBondContact OG1-CB 3.39Å; T87-T90 PolarHBondContact OG1-OG1 2.95Å; T90-N92 VanDerWaalsContact C-N 3.25Å; T90-N92 PolarHBondContact O-N 2.98Å; T90-I93 PolarHBondContact O-N 2.86Å; T90-I93 VanDerWaalsContact O-N 3.15Å; T90-L94 HydrophobicContact CG2-CD1 3.79Å; T90-L94 VanDerWaalsContact O-CD1 3.28Å; T90-L94 WeakPolarHBondContact O-CD1 3.35Å; T90-L94 PolarHBondContact O-N 3.29Å
91A51.3Low48.9Very low60 Ų6099.5 Ų99.550%0.49652%0.524SS..Hα-helixtrans-61.4-32.9173.500000112.8K95A91-K95 WeakPolarHBondContact O-CB 3.49Å; A91-K95 PolarHBondContact O-N 3.36Å; A91-K95 VanDerWaalsContact O-N 3.16Å
92N49.7Very low50.2Low93 Ų9397.7 Ų97.750%0.49751%0.512SS..Hα-helixtrans-75.4-33.4174.7-71.8-40.5000112.6E88 N89 T90 K95 M96E88-N92 PolarHBondContact O-N 3.21Å; E88-N92 PolarHBondContact O-ND2 2.95Å; N89-N92 PolarHBondContact O-N 2.85Å; T90-N92 VanDerWaalsContact C-N 3.25Å; T90-N92 PolarHBondContact O-N 2.98Å; N92-K95 WeakPolarHBondContact O-CB 3.28Å; N92-M96 PolarHBondContact O-N 3.47Å
93I48.8Very low52.3Low71 Ų7191.5 Ų91.536%0.36448%0.482SS..Hα-helixtrans-67.3-50174.6-65.5165.8000110.6N89 T90 K95 M96 V97N89-I93 WeakPolarHBondContact O-CG1 3.14Å; N89-I93 PolarHBondContact O-N 3.44Å; N89-I93 VanDerWaalsContact O-N 3.11Å; T90-I93 PolarHBondContact O-N 2.86Å; T90-I93 VanDerWaalsContact O-N 3.15Å; I93-K95 VanDerWaalsContact C-N 3.28Å; I93-K95 PolarHBondContact O-N 2.9Å; I93-M96 WeakPolarHBondContact O-CA 3.45Å; I93-M96 WeakPolarHBondContact O-CB 3.44Å; I93-M96 PolarHBondContact O-N 3.1Å; I93-V97 WeakPolarHBondContact O-CG2 3.38Å; I93-V97 PolarHBondContact O-N 3.39Å
94L46.4Very low54.3Low73 Ų7385.5 Ų85.538%0.38245%0.451SS..Hα-helixtrans-63.1-33.3176.9-83.583.1000112.4T90 M96 V97 R98T90-L94 HydrophobicContact CG2-CD1 3.79Å; T90-L94 VanDerWaalsContact O-CD1 3.28Å; T90-L94 WeakPolarHBondContact O-CD1 3.35Å; T90-L94 PolarHBondContact O-N 3.29Å; L94-M96 VanDerWaalsContact C-N 3.33Å; L94-V97 PolarHBondContact O-N 3.05Å; L94-R98 WeakPolarHBondContact O-CB 3.38Å; L94-R98 WeakPolarHBondContact O-CG 3.29Å; L94-R98 PolarHBondContact O-N 2.82Å
95K49.2Very low56.2Low138 Ų13879.9 Ų79.960%0.643%0.426SS*.Hα-helixtrans-57.2-45.2166.8-98.5177.6177.4170.30112A91 N92 I93 R98 T99A91-K95 WeakPolarHBondContact O-CB 3.49Å; A91-K95 PolarHBondContact O-N 3.36Å; A91-K95 VanDerWaalsContact O-N 3.16Å; N92-K95 WeakPolarHBondContact O-CB 3.28Å; I93-K95 VanDerWaalsContact C-N 3.28Å; I93-K95 PolarHBondContact O-N 2.9Å; K95-R98 PolarHBondContact O-N 3.36Å; K95-T99 WeakPolarHBondContact O-CB 3.36Å; K95-T99 PolarHBondContact O-N 3.36Å; K95-T99 PolarHBondContact O-OG1 3.45Å
96M46.8Very low58.6Low113 Ų11376 Ų7656%0.55741%0.408SS*.Hα-helixtrans-64.3-40.1-178.5-158.2-175.7-55.100111.8N92 I93 L94 T99 A100N92-M96 PolarHBondContact O-N 3.47Å; I93-M96 WeakPolarHBondContact O-CA 3.45Å; I93-M96 WeakPolarHBondContact O-CB 3.44Å; I93-M96 PolarHBondContact O-N 3.1Å; L94-M96 VanDerWaalsContact C-N 3.33Å; M96-T99 CarbonylContact O-C 3.32Å; M96-T99 VanDerWaalsContact O-C 3.32Å; M96-T99 WeakPolarHBondContact O-CA 3.31Å; M96-T99 WeakPolarHBondContact O-CB 3.5Å; M96-T99 PolarHBondContact O-N 3.47Å; M96-A100 PolarHBondContact O-N 2.86Å
97V44.8Very low60.5Low16 Ų1669.8 Ų69.810%0.09737%0.37CS..Hα-helixtrans-75.8-36.3177.9-157.50000112.5Y77 I93 L94 T99 A100Y77-V97 HydrophobicContact CD1-CB 4.4Å; Y77-V97 HydrophobicContact CD1-CG1 4.26Å; Y77-V97 HydrophobicContact CE1-CB 3.87Å; Y77-V97 HydrophobicContact CE1-CG1 3.4Å; Y77-V97 VanDerWaalsContact CE1-CG1 3.4Å; I93-V97 WeakPolarHBondContact O-CG2 3.38Å; I93-V97 PolarHBondContact O-N 3.39Å; L94-V97 PolarHBondContact O-N 3.05Å; V97-T99 PolarHBondContact O-N 2.92Å; V97-T99 VanDerWaalsContact O-N 3.11Å; V97-A100 HydrophobicContact CG1-CB 4.48Å; V97-A100 WeakPolarHBondContact O-CB 3.37Å; V97-A100 PolarHBondContact O-N 2.83Å
98R54.5Low62.5Low95 Ų9568.3 Ų68.336%0.35836%0.359SS..Hα-helixtrans-57.7-19.9163.7-78-179.1171.9169.7-0.3112.4Y77 E80 L94 K95Y77-R98 PolarHBondContact O-NE 3.25Å; Y77-R98 PolarHBondContact O-NH2 2.99Å; E80-R98 IonicContact OE1-CZ 3.73Å; E80-R98 VanDerWaalsContact OE1-CZ 3.24Å; E80-R98 IonicContact OE1-NH1 2.75Å; E80-R98 PolarHBondContact OE1-NH1 3.22Å; E80-R98 IonicContact OE1-NH2 3.24Å; E80-R98 PolarHBondContact OE1-NH2 3.43Å; L94-R98 WeakPolarHBondContact O-CB 3.38Å; L94-R98 WeakPolarHBondContact O-CG 3.29Å; L94-R98 PolarHBondContact O-N 2.82Å; K95-R98 PolarHBondContact O-N 3.36Å
99T52.3Low64.4Low78 Ų7865.2 Ų65.248%0.47935%0.348SS..Hα-helixtrans-97.6-9.9175-49.50000113.1K95 M96 V97 P102 F103K95-T99 WeakPolarHBondContact O-CB 3.36Å; K95-T99 PolarHBondContact O-N 3.36Å; K95-T99 PolarHBondContact O-OG1 3.45Å; M96-T99 CarbonylContact O-C 3.32Å; M96-T99 VanDerWaalsContact O-C 3.32Å; M96-T99 WeakPolarHBondContact O-CA 3.31Å; M96-T99 WeakPolarHBondContact O-CB 3.5Å; M96-T99 PolarHBondContact O-N 3.47Å; V97-T99 PolarHBondContact O-N 2.92Å; V97-T99 VanDerWaalsContact O-N 3.11Å; T99-P102 WeakPolarHBondContact O-CD 3.28Å; T99-P102 VanDerWaalsContact O-CG 3.24Å; T99-P102 WeakPolarHBondContact O-CG 3.25Å; T99-F103 HydrophobicContact CG2-CE2 4.29Å; T99-F103 WeakPolarHBondContact O-CD2 3.49Å; T99-F103 WeakPolarHBondContact O-CE2 3.43Å
100A53.7Low66.4Low7 Ų762.8 Ų62.86%0.05833%0.331CS..Hα-helixtrans-80.1-44.2178.400000112.6M96 V97 P102 F103 P104 L151M96-A100 PolarHBondContact O-N 2.86Å; V97-A100 HydrophobicContact CG1-CB 4.48Å; V97-A100 WeakPolarHBondContact O-CB 3.37Å; V97-A100 PolarHBondContact O-N 2.83Å; A100-P102 VanDerWaalsContact C-CD 3.5Å; A100-F103 PolarHBondContact O-N 3.4Å; A100-F103 VanDerWaalsContact O-N 3.14Å; A100-P104 VanDerWaalsContact O-CD 3.24Å; A100-P104 WeakPolarHBondContact O-CD 3.34Å; A100-L151 HydrophobicContact CB-CB 4.14Å
101T63Low68.5Low28 Ų2859.8 Ų59.817%0.17231%0.313CS..THydrogen-bonded Turntrans-59.9-30.3179.8580000116.3L58 F103 P104L58-T101 HydrophobicContact CD1-CG2 3.94Å; L58-T101 HydrophobicContact CG-CG2 4.28Å; T101-F103 VanDerWaalsContact C-N 3.32Å; T101-F103 PolarHBondContact O-N 2.96Å; T101-P104 WeakPolarHBondContact O-CD 3.36Å
102P70.4Confident70.6Confident55 Ų5562.7 Ų62.736%0.35732%0.315SS..Hα-helixtrans-68.7-21.8172.624.6-35.5000114.3T99 A100 M105 V106T99-P102 WeakPolarHBondContact O-CD 3.28Å; T99-P102 VanDerWaalsContact O-CG 3.24Å; T99-P102 WeakPolarHBondContact O-CG 3.25Å; A100-P102 VanDerWaalsContact C-CD 3.5Å; P102-M105 PolarHBondContact O-N 3.27Å; P102-V106 WeakPolarHBondContact O-CB 3.25Å; P102-V106 WeakPolarHBondContact O-CG2 3.43Å; P102-V106 PolarHBondContact O-N 3.2Å
103F79.8Confident72.8Confident66 Ų6661 Ų6129%0.28931%0.308SS..Hα-helixtrans-65.9-47.2-178.4-72.5-76.8000113.3T99 A100 T101 M105 V106 S107 V147 L151T99-F103 HydrophobicContact CG2-CE2 4.29Å; T99-F103 WeakPolarHBondContact O-CD2 3.49Å; T99-F103 WeakPolarHBondContact O-CE2 3.43Å; A100-F103 PolarHBondContact O-N 3.4Å; A100-F103 VanDerWaalsContact O-N 3.14Å; T101-F103 VanDerWaalsContact C-N 3.32Å; T101-F103 PolarHBondContact O-N 2.96Å; F103-M105 VanDerWaalsContact C-N 3.3Å; F103-M105 PolarHBondContact O-N 2.95Å; F103-V106 PolarHBondContact O-N 2.85Å; F103-S107 WeakPolarHBondContact O-CB 3.37Å; F103-S107 PolarHBondContact O-N 3.39Å; F103-V147 HydrophobicContact CD1-CG1 4.25Å; F103-V147 HydrophobicContact CE1-CG1 4.21Å; F103-V147 HydrophobicContact CZ-CG1 4.46Å; F103-L151 HydrophobicContact CD2-CD1 3.67Å; F103-L151 HydrophobicContact CE2-CD1 3.5Å; F103-L151 VanDerWaalsContact CE2-CD1 3.5Å; F103-L151 HydrophobicContact CZ-CD1 4.3Å
104P84.3Confident75Confident3 Ų357.7 Ų57.72%0.01929%0.29CS..Hα-helixtrans-58.6-35.7169.2-27.336000114.1V28 L58 A100 T101 S107 L108 L145V28-P104 HydrophobicContact CG2-CB 4.15Å; L58-P104 HydrophobicContact CD2-CB 3.82Å; L58-P104 HydrophobicContact CD2-CG 3.95Å; A100-P104 VanDerWaalsContact O-CD 3.24Å; A100-P104 WeakPolarHBondContact O-CD 3.34Å; T101-P104 WeakPolarHBondContact O-CD 3.36Å; P104-S107 WeakPolarHBondContact O-CB 3.32Å; P104-S107 PolarHBondContact O-N 2.82Å; P104-L108 WeakPolarHBondContact O-CB 3.16Å; P104-L108 PolarHBondContact O-N 3.24Å; P104-L145 HydrophobicContact CB-CD1 4.23Å
105M85.7Confident77.3Confident78 Ų7856.7 Ų56.738%0.38428%0.283SS..Hα-helixtrans-68.8-44.6176.2-86.2-70.2-171.300112.7V28 W59 P102 F103 S107 L108 L109V28-M105 HydrophobicContact CG1-CE 4.1Å; V28-M105 HydrophobicContact CG1-SD 4.48Å; W59-M105 HydrophobicContact CH2-CE 3.78Å; W59-M105 HydrophobicContact CH2-CG 3.59Å; W59-M105 HydrophobicContact CZ2-CE 3.4Å; W59-M105 HydrophobicContact CZ2-CG 3.79Å; W59-M105 HydrophobicContact CZ2-SD 4.36Å; P102-M105 PolarHBondContact O-N 3.27Å; F103-M105 VanDerWaalsContact C-N 3.3Å; F103-M105 PolarHBondContact O-N 2.95Å; M105-S107 VanDerWaalsContact C-N 3.3Å; M105-S107 PolarHBondContact O-N 3.02Å; M105-L108 WeakPolarHBondContact O-CB 3.48Å; M105-L108 PolarHBondContact O-N 2.9Å; M105-L108 VanDerWaalsContact O-N 3.11Å; M105-L109 WeakPolarHBondContact O-CG 3.47Å; M105-L109 PolarHBondContact O-N 2.69Å
106V89.5Confident79.4Confident55 Ų5553 Ų5333%0.33327%0.272SS..Hα-helixtrans-61.8-40.7173.7167.90000110.4P102 F103 L108 L109 F110P102-V106 WeakPolarHBondContact O-CB 3.25Å; P102-V106 WeakPolarHBondContact O-CG2 3.43Å; P102-V106 PolarHBondContact O-N 3.2Å; F103-V106 PolarHBondContact O-N 2.85Å; V106-L108 VanDerWaalsContact C-N 3.33Å; V106-L108 PolarHBondContact O-N 2.83Å; V106-L109 PolarHBondContact O-N 2.94Å; V106-F110 HydrophobicContact CG1-CD2 3.76Å; V106-F110 HydrophobicContact CG1-CE2 3.38Å; V106-F110 HydrophobicContact CG1-CZ 3.88Å; V106-F110 WeakPolarHBondContact O-CB 3.45Å; V106-F110 WeakPolarHBondContact O-CG 3.46Å; V106-F110 PolarHBondContact O-N 3.47Å
107S92.3Very high81.6Confident0 Ų049.2 Ų49.20%025%0.254CS..Hα-helixtrans-59.5-41.8171.6179.10000112.4F103 P104 M105 F110 V111 S141 L145 K189F103-S107 WeakPolarHBondContact O-CB 3.37Å; F103-S107 PolarHBondContact O-N 3.39Å; P104-S107 WeakPolarHBondContact O-CB 3.32Å; P104-S107 PolarHBondContact O-N 2.82Å; M105-S107 VanDerWaalsContact C-N 3.3Å; M105-S107 PolarHBondContact O-N 3.02Å; S107-F110 PolarHBondContact O-N 3.42Å; S107-V111 PolarHBondContact O-N 3.33Å; S107-S141 WeakPolarHBondContact CB-O 3.43Å; S107-S141 PolarHBondContact O-OG 3.44Å; S107-S141 PolarHBondContact OG-O 2.93Å; S107-S141 PolarHBondContact OG-OG 3.08Å; S107-L145 WeakPolarHBondContact OG-CB 3.43Å; S107-K189 PolarHBondContact OG-NZ 2.73Å
108L92.1Very high83.8Confident48 Ų4849.1 Ų49.125%0.25125%0.254SS..Hα-helixtrans-65-43177.5-171.3150.6000111.6V28 P104 M105 V106 V111 F112V28-L108 HydrophobicContact CB-CD1 4.14Å; V28-L108 HydrophobicContact CG1-CD1 4.25Å; V28-L108 HydrophobicContact CG2-CD1 4.31Å; P104-L108 WeakPolarHBondContact O-CB 3.16Å; P104-L108 PolarHBondContact O-N 3.24Å; M105-L108 WeakPolarHBondContact O-CB 3.48Å; M105-L108 PolarHBondContact O-N 2.9Å; M105-L108 VanDerWaalsContact O-N 3.11Å; V106-L108 VanDerWaalsContact C-N 3.33Å; V106-L108 PolarHBondContact O-N 2.83Å; L108-V111 WeakPolarHBondContact O-CG1 3.42Å; L108-V111 PolarHBondContact O-N 3.4Å; L108-F112 WeakPolarHBondContact O-CB 3.42Å; L108-F112 PolarHBondContact O-N 3.11Å
109L93.6Very high85.4Confident105 Ų10547.1 Ų47.155%0.5525%0.25SS..Hα-helixtrans-63.4-40.9173.9-67174.4000112.1M105 V106 T113M105-L109 WeakPolarHBondContact O-CG 3.47Å; M105-L109 PolarHBondContact O-N 2.69Å; V106-L109 PolarHBondContact O-N 2.94Å; L109-T113 WeakPolarHBondContact O-CB 3.38Å; L109-T113 PolarHBondContact O-N 3.31Å; L109-T113 PolarHBondContact O-OG1 2.93Å
110F95.2Very high87.2Confident72 Ų7247 Ų4732%0.31625%0.246SC..Hα-helixtrans-69.2-39.3176.7-70.9-27.1000113V106 S107 T113 A114 F137V106-F110 HydrophobicContact CG1-CD2 3.76Å; V106-F110 HydrophobicContact CG1-CE2 3.38Å; V106-F110 HydrophobicContact CG1-CZ 3.88Å; V106-F110 WeakPolarHBondContact O-CB 3.45Å; V106-F110 WeakPolarHBondContact O-CG 3.46Å; V106-F110 PolarHBondContact O-N 3.47Å; S107-F110 PolarHBondContact O-N 3.42Å; F110-T113 PolarHBondContact O-N 3.41Å; F110-A114 VanDerWaalsContact O-CB 3.25Å; F110-A114 WeakPolarHBondContact O-CB 3.47Å; F110-A114 PolarHBondContact O-N 3.28Å; F110-F137 HydrophobicContact CD1-CD1 4.31Å
111V95.5Very high88.7Confident1 Ų147.1 Ų47.11%0.00625%0.248CC..Hα-helixtrans-69.1-37.2175.574.20000111.7L21 V24 S107 L108 A114 F115 F138 S141 K189L21-V111 HydrophobicContact CB-CG1 4.22Å; L21-V111 HydrophobicContact CB-CG2 4.08Å; L21-V111 HydrophobicContact CD1-CG1 4.45Å; L21-V111 HydrophobicContact CG-CG1 4.12Å; V24-V111 HydrophobicContact CG1-CG1 3.85Å; S107-V111 PolarHBondContact O-N 3.33Å; L108-V111 WeakPolarHBondContact O-CG1 3.42Å; L108-V111 PolarHBondContact O-N 3.4Å; V111-A114 PolarHBondContact O-N 3.09Å; V111-F115 VanDerWaalsContact O-CB 3.27Å; V111-F115 WeakPolarHBondContact O-CB 3.32Å; V111-F115 PolarHBondContact O-N 3.49Å; V111-F138 HydrophobicContact CG2-CD1 3.94Å; V111-F138 HydrophobicContact CG2-CE1 3.72Å; V111-S141 WeakPolarHBondContact CB-OG 3.17Å; V111-S141 PolarHBondContact N-OG 3.24Å; V111-K189 HydrophobicContact CG2-CD 4.4Å; V111-K189 HydrophobicContact CG2-CG 4.11Å
112F95.8Very high89.7Confident122 Ų12250 Ų5054%0.53526%0.259SS..Hα-helixtrans-61.1-47.4174.5-178.6-96.5000110.9L21 L108 F115 V116L21-F112 HydrophobicContact CD1-CB 4.44Å; L21-F112 HydrophobicContact CD1-CD2 4.32Å; L108-F112 WeakPolarHBondContact O-CB 3.42Å; L108-F112 PolarHBondContact O-N 3.11Å; F112-F115 PolarHBondContact O-N 2.91Å; F112-V116 HydrophobicContact CD1-CG2 4.46Å; F112-V116 HydrophobicContact CE1-CG2 4.11Å; F112-V116 HydrophobicContact CZ-CG2 4.18Å; F112-V116 WeakPolarHBondContact O-CG2 3.36Å; F112-V116 PolarHBondContact O-N 3.44Å
113T95.3Very high90.3Very high58 Ų5853.7 Ų53.736%0.35628%0.275SS..Hα-helixtrans-62.9-44.7176.4-54.60000111.8L109 F110 F115 V116 I117L109-T113 WeakPolarHBondContact O-CB 3.38Å; L109-T113 PolarHBondContact O-N 3.31Å; L109-T113 PolarHBondContact O-OG1 2.93Å; F110-T113 PolarHBondContact O-N 3.41Å; T113-F115 PolarHBondContact O-N 3.32Å; T113-V116 PolarHBondContact O-N 3.07Å; T113-I117 HydrophobicContact CG2-CD1 3.87Å; T113-I117 VanDerWaalsContact O-CG1 3.29Å; T113-I117 WeakPolarHBondContact O-CG1 3.44Å; T113-I117 PolarHBondContact O-N 2.91Å
114A94.7Very high90.4Very high0 Ų058.8 Ų58.80%029%0.292CS..Hα-helixtrans-58.6-46.5175.600000111.8F110 V111 I117 S118 S134 F137 F138F110-A114 VanDerWaalsContact O-CB 3.25Å; F110-A114 WeakPolarHBondContact O-CB 3.47Å; F110-A114 PolarHBondContact O-N 3.28Å; V111-A114 PolarHBondContact O-N 3.09Å; A114-I117 PolarHBondContact O-N 3.44Å; A114-S118 VanDerWaalsContact O-CB 3.23Å; A114-S118 WeakPolarHBondContact O-CB 3.44Å; A114-S118 PolarHBondContact O-N 3.32Å; A114-S134 WeakPolarHBondContact O-CB 3.24Å; A114-F137 HydrophobicContact CB-CB 3.65Å; A114-F138 HydrophobicContact CB-CB 4.49Å; A114-F138 HydrophobicContact CB-CD1 3.73Å; A114-F138 HydrophobicContact CB-CD2 3.87Å; A114-F138 HydrophobicContact CB-CE1 3.81Å; A114-F138 HydrophobicContact CB-CE2 3.95Å; A114-F138 HydrophobicContact CB-CG 3.75Å; A114-F138 HydrophobicContact CB-CZ 3.91Å
115F94.4Very high89.8Confident53 Ų5362.2 Ų62.223%0.23231%0.314CS..Hα-helixtrans-63.9-43.2179-177.1-110.2000112A18 L21 V111 F112 T113 S118 N119 F138A18-F115 HydrophobicContact CB-CD2 4.48Å; A18-F115 HydrophobicContact CB-CE2 3.69Å; A18-F115 HydrophobicContact CB-CZ 4.09Å; L21-F115 HydrophobicContact CD1-CB 3.75Å; L21-F115 HydrophobicContact CD1-CD1 3.94Å; L21-F115 HydrophobicContact CD1-CG 3.96Å; V111-F115 VanDerWaalsContact O-CB 3.27Å; V111-F115 WeakPolarHBondContact O-CB 3.32Å; V111-F115 PolarHBondContact O-N 3.49Å; F112-F115 PolarHBondContact O-N 2.91Å; T113-F115 PolarHBondContact O-N 3.32Å; F115-S118 PolarHBondContact O-N 3.3Å; F115-N119 WeakPolarHBondContact CD2-ND2 3.49Å; F115-N119 WeakPolarHBondContact CE1-ND2 3.37Å; F115-N119 WeakPolarHBondContact CE2-ND2 3.3Å; F115-N119 WeakPolarHBondContact CZ-ND2 3.45Å; F115-N119 PolarHBondContact O-N 3.04Å; F115-N119 PolarHBondContact O-ND2 3.49Å; F115-F138 HydrophobicContact CB-CZ 4.39Å
116V94.3Very high88.8Confident60 Ų6067.4 Ų67.436%0.36434%0.337SS..Hα-helixtrans-61.5-47.9175.1170.70000111.1F112 T113 S118 N119 I120F112-V116 HydrophobicContact CD1-CG2 4.46Å; F112-V116 HydrophobicContact CE1-CG2 4.11Å; F112-V116 HydrophobicContact CZ-CG2 4.18Å; F112-V116 WeakPolarHBondContact O-CG2 3.36Å; F112-V116 PolarHBondContact O-N 3.44Å; T113-V116 PolarHBondContact O-N 3.07Å; V116-S118 VanDerWaalsContact C-N 3.33Å; V116-S118 PolarHBondContact O-N 2.74Å; V116-N119 PolarHBondContact O-N 3.46Å; V116-I120 HydrophobicContact CG1-CD1 3.85Å; V116-I120 VanDerWaalsContact O-CG1 3.29Å; V116-I120 WeakPolarHBondContact O-CG1 3.38Å; V116-I120 PolarHBondContact O-N 3.15Å
117I92.9Very high88.2Confident33 Ų3373 Ų7317%0.16935%0.352CS..Hα-helixtrans-63.5-39.5177.9-63168.3000111T113 A114 I120 G121 L130 V133 F137T113-I117 HydrophobicContact CG2-CD1 3.87Å; T113-I117 VanDerWaalsContact O-CG1 3.29Å; T113-I117 WeakPolarHBondContact O-CG1 3.44Å; T113-I117 PolarHBondContact O-N 2.91Å; A114-I117 PolarHBondContact O-N 3.44Å; I117-I120 PolarHBondContact O-N 3.17Å; I117-G121 PolarHBondContact O-N 3.44Å; I117-L130 HydrophobicContact CG2-CB 4.29Å; I117-L130 HydrophobicContact CG2-CD2 4.43Å; I117-L130 WeakPolarHBondContact CG2-O 3.31Å; I117-V133 HydrophobicContact CD1-CG1 4.36Å; I117-F137 HydrophobicContact CD1-CD2 3.88Å; I117-F137 HydrophobicContact CD1-CE2 3.93Å
118S90.2Very high87.5Confident15 Ų1574 Ų7411%0.10536%0.359CS..Hα-helixtrans-62.5-44.5177.3-169.90000111.9A114 F115 V116 G121 H122A114-S118 VanDerWaalsContact O-CB 3.23Å; A114-S118 WeakPolarHBondContact O-CB 3.44Å; A114-S118 PolarHBondContact O-N 3.32Å; F115-S118 PolarHBondContact O-N 3.3Å; V116-S118 VanDerWaalsContact C-N 3.33Å; V116-S118 PolarHBondContact O-N 2.74Å; S118-G121 CarbonylContact O-C 3.53Å; S118-G121 PolarHBondContact O-N 3.42Å; S118-H122 PolarHBondContact O-N 3.28Å
119N89.1Confident87.1Confident53 Ų5376.8 Ų76.828%0.28337%0.372SS..Hα-helixtrans-64-41.5174.8-81.3-85.5000112.3F115 V116 G121 H122 I123F115-N119 WeakPolarHBondContact CD2-ND2 3.49Å; F115-N119 WeakPolarHBondContact CE1-ND2 3.37Å; F115-N119 WeakPolarHBondContact CE2-ND2 3.3Å; F115-N119 WeakPolarHBondContact CZ-ND2 3.45Å; F115-N119 PolarHBondContact O-N 3.04Å; F115-N119 PolarHBondContact O-ND2 3.49Å; V116-N119 PolarHBondContact O-N 3.46Å; N119-G121 VanDerWaalsContact C-N 3.31Å; N119-G121 PolarHBondContact O-N 3.1Å; N119-H122 WeakPolarHBondContact O-CB 3.31Å; N119-H122 PolarHBondContact O-N 3.12Å; N119-I123 WeakPolarHBondContact O-CG1 3.42Å; N119-I123 PolarHBondContact O-N 2.93Å
120I89.9Confident86.8Confident75 Ų7574.4 Ų74.439%0.38536%0.36SS..Hα-helixtrans-62.6-40.4174.3-64.8164.7000110.6V116 I117 H122 I123 R124 L130V116-I120 HydrophobicContact CG1-CD1 3.85Å; V116-I120 VanDerWaalsContact O-CG1 3.29Å; V116-I120 WeakPolarHBondContact O-CG1 3.38Å; V116-I120 PolarHBondContact O-N 3.15Å; I117-I120 PolarHBondContact O-N 3.17Å; I120-H122 VanDerWaalsContact C-N 3.33Å; I120-H122 PolarHBondContact O-N 3.34Å; I120-I123 PolarHBondContact O-N 3.25Å; I120-R124 PolarHBondContact O-N 2.86Å; I120-L130 HydrophobicContact CG2-CD1 4.02Å
121G85.9Confident86.4Confident9 Ų972.1 Ų72.19%0.09335%0.354CS..Hα-helixtrans-65-31.5173.800000113.8I117 S118 N119 R124 P125I117-G121 PolarHBondContact O-N 3.44Å; S118-G121 CarbonylContact O-C 3.53Å; S118-G121 PolarHBondContact O-N 3.42Å; N119-G121 VanDerWaalsContact C-N 3.31Å; N119-G121 PolarHBondContact O-N 3.1Å; G121-R124 CarbonylContact O-C 3.37Å; G121-P125 WeakPolarHBondContact O-CA 3.41Å
122H82.4Confident86.1Confident89 Ų8975.4 Ų75.441%0.41237%0.369SS..Hα-helixtrans-71.5-39.3173.6-172.1-125.2000112.2S118 N119 I120S118-H122 PolarHBondContact O-N 3.28Å; N119-H122 WeakPolarHBondContact O-CB 3.31Å; N119-H122 PolarHBondContact O-N 3.12Å; I120-H122 VanDerWaalsContact C-N 3.33Å; I120-H122 PolarHBondContact O-N 3.34Å
123I84.4Confident86Confident133 Ų13371.8 Ų71.868%0.68236%0.357SS*.Hα-helixtrans-72.8-34.2176.3-63.5165.8000111.6N119 I120 P125N119-I123 WeakPolarHBondContact O-CG1 3.42Å; N119-I123 PolarHBondContact O-N 2.93Å; I120-I123 PolarHBondContact O-N 3.25Å; I123-P125 VanDerWaalsContact C-CD 3.46Å; I123-P125 WeakPolarHBondContact O-CD 3.44Å
124R81.4Confident85.8Confident173 Ų17369 Ų6965%0.65334%0.34SS*.  trans-122.170178.4-66.3-169.1176.9127.4-1.4112.1I120 G121 Q126 R127I120-R124 PolarHBondContact O-N 2.86Å; G121-R124 CarbonylContact O-C 3.37Å; R124-Q126 PolarHBondContact O-N 2.77Å; R124-R127 PolarHBondContact O-N 2.92Å; R124-R127 VanDerWaalsContact O-N 3.1Å
125P70.3Confident85.8Confident74 Ų7469 Ų6948%0.48134%0.34SS..THydrogen-bonded Turntrans-63.9-13.5-177.227.1-35.8000114.2G121 I123 R127G121-P125 WeakPolarHBondContact O-CA 3.41Å; I123-P125 VanDerWaalsContact C-CD 3.46Å; I123-P125 WeakPolarHBondContact O-CD 3.44Å; P125-R127 PolarHBondContact O-N 3.34Å
126Q66.6Low85.8Confident187 Ų18769.8 Ų69.887%0.87435%0.345SS*.THydrogen-bonded Turntrans-65.6-8.1172.8-158.5-178.824.800113.8R124R124-Q126 PolarHBondContact O-N 2.77Å
127R76.6Confident85.9Confident172 Ų17269.8 Ų69.865%0.64934%0.34SS*.  trans-115.671.6171.7-63.9-63.4-171.4167.21.8109.8R124 P125 I129 L130R124-R127 PolarHBondContact O-N 2.92Å; R124-R127 VanDerWaalsContact O-N 3.1Å; P125-R127 PolarHBondContact O-N 3.34Å; R127-I129 PolarHBondContact O-N 3.06Å; R127-I129 VanDerWaalsContact O-N 3.1Å; R127-L130 HydrophobicContact CB-CD1 3.9Å; R127-L130 HydrophobicContact CB-CG 4Å; R127-L130 WeakPolarHBondContact O-CB 3.49Å; R127-L130 PolarHBondContact O-N 2.68Å
128T77Confident86Confident22 Ų2268.2 Ų68.214%0.13533%0.332CS..Hα-helixtrans-51.3-32.5-179.344.90000113.9L130 A131 F132 R203 E207T128-L130 PolarHBondContact O-N 3.34Å; T128-A131 WeakPolarHBondContact O-CB 3.46Å; T128-A131 PolarHBondContact O-N 3.24Å; T128-A131 VanDerWaalsContact O-N 3.14Å; T128-F132 PolarHBondContact O-N 3.46Å; T128-R203 HydrophobicContact CG2-CB 4.46Å; T128-E207 WeakPolarHBondContact CG2-OE1 3.33Å
129I84.7Confident86.3Confident106 Ų10669.7 Ų69.754%0.54434%0.339SS..Hα-helixtrans-51.9-37172.3-54.6174.1000112.5R127 A131 F132 V133R127-I129 PolarHBondContact O-N 3.06Å; R127-I129 VanDerWaalsContact O-N 3.1Å; I129-A131 VanDerWaalsContact C-N 3.35Å; I129-A131 PolarHBondContact O-N 2.9Å; I129-F132 WeakPolarHBondContact O-CB 3.46Å; I129-F132 PolarHBondContact O-N 3.42Å; I129-V133 HydrophobicContact CG2-CG2 4.23Å; I129-V133 WeakPolarHBondContact O-CG2 3.27Å; I129-V133 PolarHBondContact O-N 2.63Å
130L86.9Confident86.6Confident56 Ų5670.8 Ų70.829%0.29334%0.344SS..Hα-helixtrans-65.9-36.7-179.3-64.8179.1000112.3I117 I120 R127 T128 V133 S134I117-L130 HydrophobicContact CG2-CB 4.29Å; I117-L130 HydrophobicContact CG2-CD2 4.43Å; I117-L130 WeakPolarHBondContact CG2-O 3.31Å; I120-L130 HydrophobicContact CG2-CD1 4.02Å; R127-L130 HydrophobicContact CB-CD1 3.9Å; R127-L130 HydrophobicContact CB-CG 4Å; R127-L130 WeakPolarHBondContact O-CB 3.49Å; R127-L130 PolarHBondContact O-N 2.68Å; T128-L130 PolarHBondContact O-N 3.34Å; L130-V133 PolarHBondContact O-N 3.11Å; L130-S134 PolarHBondContact O-N 3.27Å; L130-S134 PolarHBondContact O-OG 3.45Å
131A85.4Confident86.9Confident23 Ų2367.2 Ų67.219%0.1933%0.326CS..Hα-helixtrans-64.6-44.1175.700000110.8T128 I129 S134 G135T128-A131 WeakPolarHBondContact O-CB 3.46Å; T128-A131 PolarHBondContact O-N 3.24Å; T128-A131 VanDerWaalsContact O-N 3.14Å; I129-A131 VanDerWaalsContact C-N 3.35Å; I129-A131 PolarHBondContact O-N 2.9Å; A131-S134 PolarHBondContact O-N 3.11Å; A131-S134 PolarHBondContact O-OG 2.67Å; A131-G135 PolarHBondContact O-N 2.75Å
132F89.8Confident87.3Confident71 Ų7166.8 Ų66.831%0.31132%0.321SS..Hα-helixtrans-59.4-49.4175-178.1-118.7000112.4T128 I129 S134 G135 I136 V197 F200T128-F132 PolarHBondContact O-N 3.46Å; I129-F132 WeakPolarHBondContact O-CB 3.46Å; I129-F132 PolarHBondContact O-N 3.42Å; F132-S134 VanDerWaalsContact C-N 3.34Å; F132-S134 PolarHBondContact O-N 2.93Å; F132-G135 WeakPolarHBondContact O-CA 3.21Å; F132-G135 PolarHBondContact O-N 2.89Å; F132-G135 VanDerWaalsContact O-N 3.07Å; F132-I136 HydrophobicContact CD1-CD1 4.06Å; F132-I136 HydrophobicContact CE1-CD1 3.67Å; F132-I136 HydrophobicContact CE2-CD1 4.4Å; F132-I136 HydrophobicContact CZ-CD1 3.86Å; F132-I136 PolarHBondContact O-N 3.48Å; F132-V197 HydrophobicContact CD2-CG2 4.27Å; F132-V197 HydrophobicContact CE2-CG1 4.31Å; F132-V197 HydrophobicContact CE2-CG2 4.36Å; F132-F200 HydrophobicContact CB-CB 3.98Å; F132-F200 HydrophobicContact CB-CD1 3.96Å; F132-F200 HydrophobicContact CB-CD2 3.73Å; F132-F200 HydrophobicContact CB-CE1 4.4Å; F132-F200 HydrophobicContact CB-CE2 4.2Å; F132-F200 HydrophobicContact CB-CG 3.6Å; F132-F200 HydrophobicContact CD1-CE1 4.38Å; F132-F200 HydrophobicContact CD2-CB 4.16Å; F132-F200 AromaticContact CD2-CD1 3.4Å; F132-F200 HydrophobicContact CD2-CD1 3.4Å; F132-F200 VanDerWaalsContact CD2-CD1 3.4Å; F132-F200 AromaticContact CD2-CE1 3.95Å; F132-F200 HydrophobicContact CD2-CE1 3.95Å; F132-F200 AromaticContact CD2-CG 3.84Å; F132-F200 HydrophobicContact CD2-CG 3.84Å; F132-F200 AromaticContact CE2-CD1 3.99Å; F132-F200 HydrophobicContact CE2-CD1 3.99Å; F132-F200 HydrophobicContact CE2-CE1 4.29Å; F132-F200 HydrophobicContact CG-CB 4.48Å; F132-F200 AromaticContact CG-CD1 3.73Å; F132-F200 HydrophobicContact CG-CD1 3.73Å; F132-F200 HydrophobicContact CG-CD2 4.35Å; F132-F200 AromaticContact CG-CE1 4Å; F132-F200 HydrophobicContact CG-CE1 4Å; F132-F200 AromaticContact CG-CG 3.92Å; F132-F200 HydrophobicContact CG-CG 3.92Å; F132-F200 HydrophobicContact CG-CZ 4.42Å
133V93.1Very high87.9Confident46 Ų4667 Ų6728%0.27933%0.325SS..Hα-helixtrans-60.8-41.2177.4170.80000111.4I117 I129 L130 G135 I136 F137I117-V133 HydrophobicContact CD1-CG1 4.36Å; I129-V133 HydrophobicContact CG2-CG2 4.23Å; I129-V133 WeakPolarHBondContact O-CG2 3.27Å; I129-V133 PolarHBondContact O-N 2.63Å; L130-V133 PolarHBondContact O-N 3.11Å; V133-G135 VanDerWaalsContact C-N 3.32Å; V133-G135 PolarHBondContact O-N 3.37Å; V133-I136 PolarHBondContact O-N 2.9Å; V133-F137 HydrophobicContact CG1-CD2 3.8Å; V133-F137 HydrophobicContact CG1-CE2 3.6Å; V133-F137 VanDerWaalsContact O-CD2 3.28Å; V133-F137 WeakPolarHBondContact O-CD2 3.28Å; V133-F137 PolarHBondContact O-N 3.19Å; V133-F137 VanDerWaalsContact O-N 3.09Å
134S92.9Very high88.3Confident0 Ų061.4 Ų61.40%030%0.298CS..Hα-helixtrans-62.7-37.9173.769.90000112.6A114 L130 A131 F132 I136 F137 F138A114-S134 WeakPolarHBondContact O-CB 3.24Å; L130-S134 PolarHBondContact O-N 3.27Å; L130-S134 PolarHBondContact O-OG 3.45Å; A131-S134 PolarHBondContact O-N 3.11Å; A131-S134 PolarHBondContact O-OG 2.67Å; F132-S134 VanDerWaalsContact C-N 3.34Å; F132-S134 PolarHBondContact O-N 2.93Å; S134-I136 PolarHBondContact O-N 3.11Å; S134-F137 PolarHBondContact O-N 3.1Å; S134-F138 WeakPolarHBondContact O-CD2 3.49Å; S134-F138 PolarHBondContact O-N 3.21Å
135G93.4Very high88.8Confident0 Ų053.2 Ų53.20%027%0.267CS..Hα-helixtrans-61-42.4174.900000112.9A131 F132 V133 F138 I139A131-G135 PolarHBondContact O-N 2.75Å; F132-G135 WeakPolarHBondContact O-CA 3.21Å; F132-G135 PolarHBondContact O-N 2.89Å; F132-G135 VanDerWaalsContact O-N 3.07Å; V133-G135 VanDerWaalsContact C-N 3.32Å; V133-G135 PolarHBondContact O-N 3.37Å; G135-F138 PolarHBondContact O-N 3.42Å; G135-I139 WeakPolarHBondContact O-CG1 3.5Å; G135-I139 PolarHBondContact O-N 3.05Å; G135-I139 VanDerWaalsContact O-N 3.11Å
136I94.7Very high89.9Confident68 Ų6852 Ų5235%0.34926%0.258SS..Hα-helixtrans-61.9-46.6174.4-63.9169000110.8F132 V133 S134 F138 I139 L140F132-I136 HydrophobicContact CD1-CD1 4.06Å; F132-I136 HydrophobicContact CE1-CD1 3.67Å; F132-I136 HydrophobicContact CE2-CD1 4.4Å; F132-I136 HydrophobicContact CZ-CD1 3.86Å; F132-I136 PolarHBondContact O-N 3.48Å; V133-I136 PolarHBondContact O-N 2.9Å; S134-I136 PolarHBondContact O-N 3.11Å; I136-F138 VanDerWaalsContact C-N 3.32Å; I136-F138 PolarHBondContact O-N 2.91Å; I136-I139 PolarHBondContact O-N 2.85Å; I136-L140 HydrophobicContact CG2-CD1 3.85Å; I136-L140 HydrophobicContact CG2-CG 4.22Å; I136-L140 WeakPolarHBondContact O-CG 3.41Å; I136-L140 PolarHBondContact O-N 3Å
137F95.9Very high91.1Very high60 Ų6046.4 Ų46.426%0.26324%0.237SC..Hα-helixtrans-66.2-30.4178-76.6-66.5000113.4F110 A114 I117 V133 S134 S141F110-F137 HydrophobicContact CD1-CD1 4.31Å; A114-F137 HydrophobicContact CB-CB 3.65Å; I117-F137 HydrophobicContact CD1-CD2 3.88Å; I117-F137 HydrophobicContact CD1-CE2 3.93Å; V133-F137 HydrophobicContact CG1-CD2 3.8Å; V133-F137 HydrophobicContact CG1-CE2 3.6Å; V133-F137 VanDerWaalsContact O-CD2 3.28Å; V133-F137 WeakPolarHBondContact O-CD2 3.28Å; V133-F137 PolarHBondContact O-N 3.19Å; V133-F137 VanDerWaalsContact O-N 3.09Å; S134-F137 PolarHBondContact O-N 3.1Å; F137-S141 VanDerWaalsContact O-CB 3.28Å; F137-S141 WeakPolarHBondContact O-CB 3.28Å; F137-S141 PolarHBondContact O-N 3.14Å
138F96Very high91.6Very high0 Ų038.3 Ų38.30%021%0.207CC..Hα-helixtrans-64.2-45.3170.8-81.2-60.6000112.1V111 A114 F115 S134 G135 I136 S141 G142 A192V111-F138 HydrophobicContact CG2-CD1 3.94Å; V111-F138 HydrophobicContact CG2-CE1 3.72Å; A114-F138 HydrophobicContact CB-CB 4.49Å; A114-F138 HydrophobicContact CB-CD1 3.73Å; A114-F138 HydrophobicContact CB-CD2 3.87Å; A114-F138 HydrophobicContact CB-CE1 3.81Å; A114-F138 HydrophobicContact CB-CE2 3.95Å; A114-F138 HydrophobicContact CB-CG 3.75Å; A114-F138 HydrophobicContact CB-CZ 3.91Å; F115-F138 HydrophobicContact CB-CZ 4.39Å; S134-F138 WeakPolarHBondContact O-CD2 3.49Å; S134-F138 PolarHBondContact O-N 3.21Å; G135-F138 PolarHBondContact O-N 3.42Å; I136-F138 VanDerWaalsContact C-N 3.32Å; I136-F138 PolarHBondContact O-N 2.91Å; F138-S141 WeakPolarHBondContact O-CB 3.36Å; F138-S141 PolarHBondContact O-N 3.24Å; F138-G142 PolarHBondContact O-N 3.36Å; F138-A192 HydrophobicContact CD1-CB 4.48Å; F138-A192 HydrophobicContact CD2-CB 4.39Å; F138-A192 HydrophobicContact CG-CB 4.37Å
139I96.1Very high92Very high46 Ų4637.9 Ų37.924%0.23620%0.204CC..Hα-helixtrans-65.4-45.9177-63.9162.6000110.6G135 I136 S141 G142 L143 V197G135-I139 WeakPolarHBondContact O-CG1 3.5Å; G135-I139 PolarHBondContact O-N 3.05Å; G135-I139 VanDerWaalsContact O-N 3.11Å; I136-I139 PolarHBondContact O-N 2.85Å; I139-S141 VanDerWaalsContact C-N 3.26Å; I139-S141 PolarHBondContact O-N 3.06Å; I139-G142 PolarHBondContact O-N 2.88Å; I139-L143 HydrophobicContact CG2-CD1 3.84Å; I139-L143 HydrophobicContact CG2-CG 4.22Å; I139-L143 WeakPolarHBondContact O-CG 3.45Å; I139-L143 PolarHBondContact O-N 2.98Å; I139-V197 HydrophobicContact CD1-CG2 4.34Å
140L95.1Very high92.2Very high76 Ų7636.7 Ų36.740%0.39820%0.201SC..Hα-helixtrans-62.3-33.3175.9-67.7175.8000112.3I136 S144I136-L140 HydrophobicContact CG2-CD1 3.85Å; I136-L140 HydrophobicContact CG2-CG 4.22Å; I136-L140 WeakPolarHBondContact O-CG 3.41Å; I136-L140 PolarHBondContact O-N 3Å; L140-S144 VanDerWaalsContact O-CB 3.32Å; L140-S144 WeakPolarHBondContact O-CB 3.46Å; L140-S144 PolarHBondContact O-N 2.63Å; L140-S144 VanDerWaalsContact O-N 3.08Å; L140-S144 PolarHBondContact O-OG 3.07Å
141S95.9Very high92Very high0 Ų036.2 Ų36.20%020%0.199CC..Hα-helixtrans-67.7-40.7170.5179.40000112.5S107 V111 F137 F138 I139 S144 L145 K189S107-S141 WeakPolarHBondContact CB-O 3.43Å; S107-S141 PolarHBondContact O-OG 3.44Å; S107-S141 PolarHBondContact OG-O 2.93Å; S107-S141 PolarHBondContact OG-OG 3.08Å; V111-S141 WeakPolarHBondContact CB-OG 3.17Å; V111-S141 PolarHBondContact N-OG 3.24Å; F137-S141 VanDerWaalsContact O-CB 3.28Å; F137-S141 WeakPolarHBondContact O-CB 3.28Å; F137-S141 PolarHBondContact O-N 3.14Å; F138-S141 WeakPolarHBondContact O-CB 3.36Å; F138-S141 PolarHBondContact O-N 3.24Å; I139-S141 VanDerWaalsContact C-N 3.26Å; I139-S141 PolarHBondContact O-N 3.06Å; S141-S144 WeakPolarHBondContact CA-OG 3.44Å; S141-S144 PolarHBondContact O-OG 3.31Å; S141-L145 WeakPolarHBondContact O-CB 3.42Å; S141-L145 PolarHBondContact O-N 2.66Å; S141-L145 VanDerWaalsContact O-N 3.07Å; S141-K189 WeakPolarHBondContact OG-CE 3.3Å; S141-K189 PolarHBondContact OG-NZ 2.8Å
142G95.3Very high91.7Very high0 Ų035.8 Ų35.80%019%0.192CC..Hα-helixtrans-64.8-52.8177.200000112F138 I139 S144 L145 V146 F186 E190F138-G142 PolarHBondContact O-N 3.36Å; I139-G142 PolarHBondContact O-N 2.88Å; G142-S144 PolarHBondContact O-N 2.98Å; G142-L145 WeakPolarHBondContact O-CB 3.34Å; G142-L145 PolarHBondContact O-N 2.87Å; G142-L145 VanDerWaalsContact O-N 3.08Å; G142-V146 PolarHBondContact O-N 3.4Å; G142-F186 WeakPolarHBondContact O-CD2 3.42Å; G142-E190 WeakPolarHBondContact CA-OE1 3.32Å
143L94.1Very high91.3Very high93 Ų9335.1 Ų35.149%0.48719%0.191SC..Hα-helixtrans-57.5-45176.8-65.6174.2000112.7I139 L145 V146 V147I139-L143 HydrophobicContact CG2-CD1 3.84Å; I139-L143 HydrophobicContact CG2-CG 4.22Å; I139-L143 WeakPolarHBondContact O-CG 3.45Å; I139-L143 PolarHBondContact O-N 2.98Å; L143-L145 VanDerWaalsContact C-N 3.3Å; L143-L145 PolarHBondContact O-N 3.48Å; L143-V146 PolarHBondContact O-N 3.3Å; L143-V147 WeakPolarHBondContact O-CG2 3.37Å; L143-V147 PolarHBondContact O-N 2.04Å
144S92.8Very high90.6Very high17 Ų1735.5 Ų35.512%0.11920%0.196CC..Hα-helixtrans-66.1-30.3176.252.20000113.1L140 S141 G142 G148L140-S144 VanDerWaalsContact O-CB 3.32Å; L140-S144 WeakPolarHBondContact O-CB 3.46Å; L140-S144 PolarHBondContact O-N 2.63Å; L140-S144 VanDerWaalsContact O-N 3.08Å; L140-S144 PolarHBondContact O-OG 3.07Å; S141-S144 WeakPolarHBondContact CA-OG 3.44Å; S141-S144 PolarHBondContact O-OG 3.31Å; G142-S144 PolarHBondContact O-N 2.98Å; S144-G148 PolarHBondContact O-N 3.03Å; S144-G148 VanDerWaalsContact O-N 3.1Å
145L93.1Very high89.6Confident0 Ų036.4 Ų36.40%020%0.202CC..Hα-helixtrans-68.3-44.6171.5-169.759000111.5V24 P104 S107 S141 G142 L143 G148 L149 A182 S185 F186V24-L145 HydrophobicContact CG2-CD1 4.13Å; V24-L145 HydrophobicContact CG2-CD2 4.03Å; P104-L145 HydrophobicContact CB-CD1 4.23Å; S107-L145 WeakPolarHBondContact OG-CB 3.43Å; S141-L145 WeakPolarHBondContact O-CB 3.42Å; S141-L145 PolarHBondContact O-N 2.66Å; S141-L145 VanDerWaalsContact O-N 3.07Å; G142-L145 WeakPolarHBondContact O-CB 3.34Å; G142-L145 PolarHBondContact O-N 2.87Å; G142-L145 VanDerWaalsContact O-N 3.08Å; L143-L145 VanDerWaalsContact C-N 3.3Å; L143-L145 PolarHBondContact O-N 3.48Å; L145-G148 CarbonylContact O-C 3.59Å; L145-G148 PolarHBondContact O-N 2.84Å; L145-L149 HydrophobicContact CD1-CG 4.46Å; L145-L149 HydrophobicContact CG-CD1 4.01Å; L145-L149 HydrophobicContact CG-CG 4.29Å; L145-L149 WeakPolarHBondContact O-CB 3.43Å; L145-L149 WeakPolarHBondContact O-CG 3.08Å; L145-L149 PolarHBondContact O-N 2.86Å; L145-A182 WeakPolarHBondContact CD2-O 3.37Å; L145-S185 WeakPolarHBondContact CD2-OG 3.2Å; L145-F186 HydrophobicContact CD2-CB 4.38Å
146V93.2Very high88.5Confident48 Ų4837.2 Ų37.229%0.29121%0.206SC..Hα-helixtrans-63.7-42.3179.8171.80000111.4G142 L143 G148 L149 V150 F186G142-V146 PolarHBondContact O-N 3.4Å; L143-V146 PolarHBondContact O-N 3.3Å; V146-G148 VanDerWaalsContact C-N 3.32Å; V146-G148 PolarHBondContact O-N 2.94Å; V146-L149 PolarHBondContact O-N 2.84Å; V146-V150 HydrophobicContact CG1-CG2 4.33Å; V146-V150 WeakPolarHBondContact O-CG2 3.34Å; V146-V150 PolarHBondContact O-N 2.84Å; V146-F186 HydrophobicContact CG2-CB 4.34Å; V146-F186 HydrophobicContact CG2-CD1 3.79Å; V146-F186 HydrophobicContact CG2-CD2 3.34Å; V146-F186 HydrophobicContact CG2-CE1 3.84Å; V146-F186 HydrophobicContact CG2-CE2 3.39Å; V146-F186 HydrophobicContact CG2-CG 3.54Å; V146-F186 HydrophobicContact CG2-CZ 3.65Å
147V90.5Very high87.4Confident70 Ų7037.1 Ų37.142%0.42421%0.207SC..Hα-helixtrans-59.3-44.8172.9172.40000110.8F103 L143 L149 V150 L151F103-V147 HydrophobicContact CD1-CG1 4.25Å; F103-V147 HydrophobicContact CE1-CG1 4.21Å; F103-V147 HydrophobicContact CZ-CG1 4.46Å; L143-V147 WeakPolarHBondContact O-CG2 3.37Å; L143-V147 PolarHBondContact O-N 2.04Å; V147-L149 PolarHBondContact O-N 3.46Å; V147-V150 PolarHBondContact O-N 3.48Å; V147-L151 HydrophobicContact CG1-CD1 3.94Å; V147-L151 HydrophobicContact CG1-CG 4.47Å; V147-L151 WeakPolarHBondContact O-CB 3.2Å; V147-L151 VanDerWaalsContact O-CG 3.29Å; V147-L151 WeakPolarHBondContact O-CG 3.41Å; V147-L151 PolarHBondContact O-N 3.38Å
148G86.8Confident85.8Confident2 Ų237.6 Ų37.62%0.02121%0.212CC..Hα-helixtrans-61.5-40.9174.600000114S144 L145 V146 Y152S144-G148 PolarHBondContact O-N 3.03Å; S144-G148 VanDerWaalsContact O-N 3.1Å; L145-G148 CarbonylContact O-C 3.59Å; L145-G148 PolarHBondContact O-N 2.84Å; V146-G148 VanDerWaalsContact C-N 3.32Å; V146-G148 PolarHBondContact O-N 2.94Å; G148-Y152 VanDerWaalsContact O-CB 3.3Å; G148-Y152 WeakPolarHBondContact O-CB 3.43Å; G148-Y152 PolarHBondContact O-N 2.89Å
149L86.9Confident84.2Confident14 Ų1442 Ų427%0.07323%0.232CC..Hα-helixtrans-67.9-41.7177.6-72.2171.3000112.1W33 L145 V146 V147 Y152 I153 F179 A182W33-L149 HydrophobicContact CH2-CD2 4.18Å; W33-L149 HydrophobicContact CZ3-CD2 3.7Å; L145-L149 HydrophobicContact CD1-CG 4.46Å; L145-L149 HydrophobicContact CG-CD1 4.01Å; L145-L149 HydrophobicContact CG-CG 4.29Å; L145-L149 WeakPolarHBondContact O-CB 3.43Å; L145-L149 WeakPolarHBondContact O-CG 3.08Å; L145-L149 PolarHBondContact O-N 2.86Å; V146-L149 PolarHBondContact O-N 2.84Å; V147-L149 PolarHBondContact O-N 3.46Å; L149-Y152 PolarHBondContact O-N 2.8Å; L149-I153 WeakPolarHBondContact O-CD1 3.45Å; L149-I153 VanDerWaalsContact O-CG1 3.22Å; L149-I153 WeakPolarHBondContact O-CG1 3.5Å; L149-I153 PolarHBondContact O-N 2.83Å; L149-F179 HydrophobicContact CD2-CD2 3.95Å; L149-F179 HydrophobicContact CD2-CE2 3.85Å; L149-A182 HydrophobicContact CD1-CB 4.38Å; L149-A182 HydrophobicContact CD2-CB 3.97Å
150V87.6Confident82.2Confident80 Ų8041.8 Ų41.849%0.48523%0.233SC..Hα-helixtrans-64.3-47.4175.7171.30000110.4V146 V147 Y152 I153 S154V146-V150 HydrophobicContact CG1-CG2 4.33Å; V146-V150 WeakPolarHBondContact O-CG2 3.34Å; V146-V150 PolarHBondContact O-N 2.84Å; V147-V150 PolarHBondContact O-N 3.48Å; V150-Y152 VanDerWaalsContact C-N 3.3Å; V150-Y152 PolarHBondContact O-N 3.38Å; V150-I153 PolarHBondContact O-N 3.11Å; V150-S154 WeakPolarHBondContact O-CB 3.07Å; V150-S154 PolarHBondContact O-N 3.1Å; V150-S154 PolarHBondContact O-OG 2.91Å
151L82.7Confident80.1Confident47 Ų4743.7 Ų43.725%0.24624%0.242CC..Hα-helixtrans-60.8-38.5176.2-71172.4000112.3A100 F103 V147 S155A100-L151 HydrophobicContact CB-CB 4.14Å; F103-L151 HydrophobicContact CD2-CD1 3.67Å; F103-L151 HydrophobicContact CE2-CD1 3.5Å; F103-L151 VanDerWaalsContact CE2-CD1 3.5Å; F103-L151 HydrophobicContact CZ-CD1 4.3Å; V147-L151 HydrophobicContact CG1-CD1 3.94Å; V147-L151 HydrophobicContact CG1-CG 4.47Å; V147-L151 WeakPolarHBondContact O-CB 3.2Å; V147-L151 VanDerWaalsContact O-CG 3.29Å; V147-L151 WeakPolarHBondContact O-CG 3.41Å; V147-L151 PolarHBondContact O-N 3.38Å; L151-S155 WeakPolarHBondContact O-CB 3.46Å; L151-S155 PolarHBondContact O-N 3.19Å; L151-S155 PolarHBondContact O-OG 3.08Å
152Y79.6Confident77.8Confident13 Ų1349.4 Ų49.45%0.05127%0.272CS..Hα-helixtrans-60.9-52.5174.1-177.9-101.6000111.5W33 L34 L58 G148 L149 V150 S154 S155 I156W33-Y152 HydrophobicContact CB-CE1 4.42Å; W33-Y152 WeakPolarHBondContact CB-OH 3.4Å; W33-Y152 HydrophobicContact CE3-CD1 4.13Å; W33-Y152 AromaticContact CE3-CE1 3.84Å; W33-Y152 HydrophobicContact CE3-CE1 3.84Å; W33-Y152 HydrophobicContact CE3-CE2 4.39Å; W33-Y152 AromaticContact CE3-CZ 3.98Å; W33-Y152 HydrophobicContact CZ3-CD1 4.49Å; L34-Y152 HydrophobicContact CD1-CE1 4.1Å; L34-Y152 WeakPolarHBondContact CD1-OH 3.47Å; L34-Y152 HydrophobicContact CG-CE1 4.22Å; L34-Y152 WeakPolarHBondContact CG-OH 3.47Å; L58-Y152 HydrophobicContact CD1-CD2 4.32Å; L58-Y152 HydrophobicContact CD1-CE2 4.39Å; G148-Y152 VanDerWaalsContact O-CB 3.3Å; G148-Y152 WeakPolarHBondContact O-CB 3.43Å; G148-Y152 PolarHBondContact O-N 2.89Å; L149-Y152 PolarHBondContact O-N 2.8Å; V150-Y152 VanDerWaalsContact C-N 3.3Å; V150-Y152 PolarHBondContact O-N 3.38Å; Y152-S154 PolarHBondContact O-N 3.45Å; Y152-S155 PolarHBondContact O-N 3.24Å; Y152-S155 PolarHBondContact O-OG 3.42Å; Y152-I156 WeakPolarHBondContact O-CG1 3.41Å; Y152-I156 PolarHBondContact O-N 3.02Å; Y152-I156 VanDerWaalsContact O-N 3.12Å
153I80.9Confident75.7Confident58 Ų5857.8 Ų57.830%0.29730%0.304SS..Hα-helixtrans-58.4-46177.5-63.7158.4000111.1L149 V150 I156 N157 Y175 F179L149-I153 WeakPolarHBondContact O-CD1 3.45Å; L149-I153 VanDerWaalsContact O-CG1 3.22Å; L149-I153 WeakPolarHBondContact O-CG1 3.5Å; L149-I153 PolarHBondContact O-N 2.83Å; V150-I153 PolarHBondContact O-N 3.11Å; I153-I156 PolarHBondContact O-N 2.93Å; I153-N157 WeakPolarHBondContact O-CB 3.49Å; I153-N157 PolarHBondContact O-N 2.87Å; I153-Y175 HydrophobicContact CG1-CE1 4.36Å; I153-F179 HydrophobicContact CD1-CE2 4.04Å; I153-F179 HydrophobicContact CD1-CZ 3.87Å; I153-F179 HydrophobicContact CG1-CE2 4.05Å; I153-F179 HydrophobicContact CG1-CZ 4.23Å
154S78.4Confident73.4Confident54 Ų5458.8 Ų58.838%0.37832%0.316SS..Hα-helixtrans-59.9-48.7177.3-70.10000111.8V150 Y152 I156 N157 D158V150-S154 WeakPolarHBondContact O-CB 3.07Å; V150-S154 PolarHBondContact O-N 3.1Å; V150-S154 PolarHBondContact O-OG 2.91Å; Y152-S154 PolarHBondContact O-N 3.45Å; S154-I156 VanDerWaalsContact C-N 3.31Å; S154-I156 PolarHBondContact O-N 2.88Å; S154-N157 PolarHBondContact O-N 3.24Å; S154-D158 WeakPolarHBondContact O-CB 3.44Å; S154-D158 VanDerWaalsContact O-CG 3.24Å; S154-D158 PolarHBondContact O-N 2.87Å
155S72.3Confident71.3Confident18 Ų1867.6 Ų67.613%0.12635%0.346CS..Hα-helixtrans-60.5-38.8-179.263.80000113.4L151 Y152 E159L151-S155 WeakPolarHBondContact O-CB 3.46Å; L151-S155 PolarHBondContact O-N 3.19Å; L151-S155 PolarHBondContact O-OG 3.08Å; Y152-S155 PolarHBondContact O-N 3.24Å; Y152-S155 PolarHBondContact O-OG 3.42Å; S155-E159 PolarHBondContact O-N 3.42Å
156I70.5Confident69Low17 Ų1773.7 Ų73.79%0.08738%0.375CS..Hα-helixtrans-72-41177.6-64.5-70.5000110.9L34 Y152 I153 S154 D158 E159 V160L34-I156 HydrophobicContact CD1-CB 4.37Å; L34-I156 HydrophobicContact CD1-CD1 3.66Å; L34-I156 HydrophobicContact CD1-CG1 3.76Å; L34-I156 HydrophobicContact CD1-CG2 3.82Å; Y152-I156 WeakPolarHBondContact O-CG1 3.41Å; Y152-I156 PolarHBondContact O-N 3.02Å; Y152-I156 VanDerWaalsContact O-N 3.12Å; I153-I156 PolarHBondContact O-N 2.93Å; S154-I156 VanDerWaalsContact C-N 3.31Å; S154-I156 PolarHBondContact O-N 2.88Å; I156-D158 VanDerWaalsContact C-N 3.32Å; I156-D158 PolarHBondContact O-N 2.8Å; I156-E159 PolarHBondContact O-N 3.49Å; I156-V160 HydrophobicContact CG2-CG2 4.49Å; I156-V160 WeakPolarHBondContact O-CB 3.38Å; I156-V160 VanDerWaalsContact O-CG2 3.28Å; I156-V160 WeakPolarHBondContact O-CG2 3.49Å; I156-V160 PolarHBondContact O-N 3.02Å
157N70.8Confident66.8Low67 Ų6777 Ų7736%0.35840%0.397SS..Hα-helixtrans-62.3-40.9174.3-179.782.9000111.6I153 S154 V160 M161I153-N157 WeakPolarHBondContact O-CB 3.49Å; I153-N157 PolarHBondContact O-N 2.87Å; S154-N157 PolarHBondContact O-N 3.24Å; N157-V160 PolarHBondContact O-N 3.42Å; N157-M161 VanDerWaalsContact O-CB 3.24Å; N157-M161 WeakPolarHBondContact O-CB 3.33Å; N157-M161 PolarHBondContact O-N 2.99Å
158D63.5Low64.6Low70 Ų7078.3 Ų78.337%0.37440%0.399SS..Hα-helixtrans-70.3-36.6178.3-67.1-13.2000112S154 I156 N162S154-D158 WeakPolarHBondContact O-CB 3.44Å; S154-D158 VanDerWaalsContact O-CG 3.24Å; S154-D158 PolarHBondContact O-N 2.87Å; I156-D158 VanDerWaalsContact C-N 3.32Å; I156-D158 PolarHBondContact O-N 2.8Å; D158-N162 WeakPolarHBondContact O-CB 3.49Å; D158-N162 PolarHBondContact O-N 3.25Å; D158-N162 VanDerWaalsContact O-N 3.08Å; D158-N162 PolarHBondContact O-ND2 2.98Å
159E61.2Low63Low92 Ų9282.8 Ų82.843%0.4342%0.419SS..Hα-helixtrans-64.9-46.6172.6-172179.8171.100111.6S155 I156 M161 N162 R163S155-E159 PolarHBondContact O-N 3.42Å; I156-E159 PolarHBondContact O-N 3.49Å; E159-M161 VanDerWaalsContact C-N 3.28Å; E159-M161 PolarHBondContact O-N 3.39Å; E159-N162 PolarHBondContact O-N 3.44Å; E159-R163 PolarHBondContact O-N 2.89Å; E159-R163 IonicContact OE1-NE 3.26Å; E159-R163 IonicContact OE1-NH2 2.78Å; E159-R163 PolarHBondContact OE1-NH2 3.45Å
160V55.1Low61.4Low42 Ų4287.5 Ų87.526%0.25544%0.439SS..Hα-helixtrans-68.5-25.3179.9172.60000112.4I156 N157 F171 Y173I156-V160 HydrophobicContact CG2-CG2 4.49Å; I156-V160 WeakPolarHBondContact O-CB 3.38Å; I156-V160 VanDerWaalsContact O-CG2 3.28Å; I156-V160 WeakPolarHBondContact O-CG2 3.49Å; I156-V160 PolarHBondContact O-N 3.02Å; N157-V160 PolarHBondContact O-N 3.42Å; V160-F171 HydrophobicContact CG1-CD1 4.43Å; V160-F171 HydrophobicContact CG2-CE1 3.95Å; V160-Y173 HydrophobicContact CG1-CE1 4.45Å
161M50.3Low60Low116 Ų11687.4 Ų87.457%0.57143%0.432SS*.Hα-helixtrans-85.6-29.3177.2-158.965.670.800113.5N157 E159N157-M161 VanDerWaalsContact O-CB 3.24Å; N157-M161 WeakPolarHBondContact O-CB 3.33Å; N157-M161 PolarHBondContact O-N 2.99Å; E159-M161 VanDerWaalsContact C-N 3.28Å; E159-M161 PolarHBondContact O-N 3.39Å
162N48.6Very low59.2Low120 Ų12090.8 Ų90.864%0.64245%0.447SS*.Hα-helixtrans-91.5-13.6-175.6-75.9-67.6000114.8D158 E159 P164D158-N162 WeakPolarHBondContact O-CB 3.49Å; D158-N162 PolarHBondContact O-N 3.25Å; D158-N162 VanDerWaalsContact O-N 3.08Å; D158-N162 PolarHBondContact O-ND2 2.98Å; E159-N162 PolarHBondContact O-N 3.44Å; N162-P164 WeakPolarHBondContact O-CD 3.33Å
163R51.8Low58.8Low176 Ų17693.8 Ų93.866%0.66446%0.458SS*.SBendtrans-70.4127.3165.9-71.3-165.1-172.3-1534.9109.7E159 R165E159-R163 PolarHBondContact O-N 2.89Å; E159-R163 IonicContact OE1-NE 3.26Å; E159-R163 IonicContact OE1-NH2 2.78Å; E159-R163 PolarHBondContact OE1-NH2 3.45Å; R163-R165 PolarHBondContact O-N 2.97Å
164P43.9Very low58.9Low113 Ų11396 Ų9673%0.73447%0.468SS*.  trans-55.3128.9168.5-23.534.2000109.9N162 E166N162-P164 WeakPolarHBondContact O-CD 3.33Å; P164-E166 PolarHBondContact O-N 2.88Å
165R49.2Very low59.2Low202 Ų20298 Ų9876%0.76247%0.467SS*.  trans-74.591.9173.5-75.2-177.8172.71380.9109.4R163R163-R165 PolarHBondContact O-N 2.97Å
166E44.6Very low59.9Low128 Ų12897.5 Ų97.560%0.59847%0.465SS*.  trans-47.9125.8158.9-74.2-68.4128.100108.5P164 E168 Q169P164-E166 PolarHBondContact O-N 2.88Å; E166-E168 PolarHBondContact O-N 3.13Å; E166-Q169 PolarHBondContact O-N 3.43Å
167P47.1Very low60.9Low118 Ų118106.1 Ų106.177%0.76650%0.497SS*.THydrogen-bonded Turntrans-72.10.4-157.825.7-35.2000116.2
168E45.8Very low61.9Low98 Ų98103.1 Ų103.146%0.45848%0.481SS..THydrogen-bonded Turntrans-120.4-0.1-177.4-59-161.213500115V41 Q43 E166V41-E168 PolarHBondContact N-O 2.95Å; Q43-E168 PolarHBondContact NE2-OE1 3.34Å; E166-E168 PolarHBondContact O-N 3.13Å
169Q52.2Low63.2Low95 Ų95101.6 Ų101.644%0.44447%0.471SS..EExtended strand (participates in β ladder)trans-98.6116.7177.7-88.1157.1-6500112.1E38 I40 E166E38-Q169 PolarHBondContact OE1-NE2 3.01Å; I40-Q169 HydrophobicContact CG2-CG 4.18Å; E166-Q169 PolarHBondContact O-N 3.43Å
170F53.9Low64.7Low113 Ų11399.1 Ų99.150%0.49647%0.467SS..EExtended strand (participates in β ladder)trans-95.6105175-74.4-101.7000109.1G39 V41G39-F170 PolarHBondContact O-N 2.89Å; V41-F170 HydrophobicContact CB-CD2 4.13Å; V41-F170 HydrophobicContact CB-CE2 4.04Å; V41-F170 HydrophobicContact CG2-CD2 3.4Å; V41-F170 VanDerWaalsContact CG2-CD2 3.4Å; V41-F170 HydrophobicContact CG2-CE2 3.58Å; V41-F170 HydrophobicContact CG2-CG 4.23Å
171F57.8Low66.6Low78 Ų78101 Ų10134%0.34247%0.472SS..EExtended strand (participates in β ladder)trans-100.2106.8-177.8-173.7-98.2000111.2M36 V160 Y173M36-F171 HydrophobicContact CB-CE2 4.02Å; M36-F171 HydrophobicContact CB-CZ 3.84Å; M36-F171 HydrophobicContact CE-CE2 4.02Å; M36-F171 HydrophobicContact CE-CZ 3.61Å; M36-F171 HydrophobicContact CG-CE2 4.37Å; M36-F171 HydrophobicContact CG-CZ 3.7Å; M36-F171 HydrophobicContact SD-CZ 4.3Å; V160-F171 HydrophobicContact CG1-CD1 4.43Å; V160-F171 HydrophobicContact CG2-CE1 3.95Å; F171-Y173 HydrophobicContact CE1-CD1 4.16Å
172H65.8Low68.6Low118 Ų11895.6 Ų95.655%0.54645%0.445SS..EExtended strand (participates in β ladder)trans-108.1128.6174.6-78.3-86.3000110.2E37E37-H172 PolarHBondContact N-O 3.14Å; E37-H172 PolarHBondContact O-N 2.94Å
173Y71.8Confident70.7Confident76 Ų7691.7 Ų91.730%0.29843%0.43SS..EExtended strand (participates in β ladder)trans-119.1145.2175.472.7-93.6000111L34 L35 V160 F171 Y175L34-Y173 HydrophobicContact CD2-CD2 4.17Å; L35-Y173 CarbonylContact O-C 3.59Å; L35-Y173 WeakPolarHBondContact O-CA 3.42Å; V160-Y173 HydrophobicContact CG1-CE1 4.45Å; F171-Y173 HydrophobicContact CE1-CD1 4.16Å; Y173-Y175 HydrophobicContact CE2-CE2 4.02Å
174H81.6Confident72.8Confident106 Ų10685.8 Ų85.849%0.49142%0.415SS..EExtended strand (participates in β ladder)trans-131.9138.3-179.9-68.6-75.3000110.6L34 L35L34-H174 WeakPolarHBondContact CA-O 3.5Å; L35-H174 HydrophobicContact CB-CB 4.33Å; L35-H174 PolarHBondContact N-O 3.19Å; L35-H174 PolarHBondContact O-N 2.97Å
175Y85.9Confident75.3Confident95 Ų9580.4 Ų80.437%0.37338%0.38SS..EExtended strand (participates in β ladder)trans-72.8129173.3-64.4-80.6000110.5L34 I153 Y173 F179L34-Y175 HydrophobicContact CD2-CD1 3.68Å; L34-Y175 HydrophobicContact CD2-CE1 3.86Å; L34-Y175 HydrophobicContact CD2-CG 4.32Å; I153-Y175 HydrophobicContact CG1-CE1 4.36Å; Y173-Y175 HydrophobicContact CE2-CE2 4.02Å; Y175-F179 AromaticContact CD1-CD1 3.92Å; Y175-F179 HydrophobicContact CD1-CD1 3.92Å; Y175-F179 HydrophobicContact CD1-CD2 4.14Å; Y175-F179 HydrophobicContact CD1-CE1 4.03Å; Y175-F179 HydrophobicContact CD1-CE2 4.24Å; Y175-F179 AromaticContact CD1-CG 3.98Å; Y175-F179 HydrophobicContact CD1-CG 3.98Å; Y175-F179 HydrophobicContact CD1-CZ 4.19Å; Y175-F179 HydrophobicContact CE1-CE2 4.36Å; Y175-F179 HydrophobicContact CE1-CZ 4.33Å; Y175-F179 HydrophobicContact CG-CD1 4.1Å; Y175-F179 HydrophobicContact CG-CE1 4.24Å
176G87.2Confident77.5Confident8 Ų873.3 Ų73.38%0.08236%0.355CS..  trans-88.3172.6-178.500000114Y32 W33 S178 F179 A180Y32-G176 CarbonylContact O-C 3.57Å; Y32-G176 WeakPolarHBondContact O-CA 3.36Å; W33-G176 PolarHBondContact O-N 3.49Å; G176-S178 PolarHBondContact O-N 3.2Å; G176-F179 WeakPolarHBondContact O-CB 3.49Å; G176-F179 PolarHBondContact O-N 3.41Å; G176-F179 VanDerWaalsContact O-N 3.11Å; G176-A180 PolarHBondContact O-N 3.06Å
177W90.8Very high80Confident198 Ų19873 Ų7375%0.7536%0.356SS*.Hα-helixtrans-60.6-29.5-175.4-55.3105.2000113.7Y32 F179 A180 F181Y32-W177 PolarHBondContact O-N 2.9Å; W177-F179 VanDerWaalsContact C-N 3.32Å; W177-F179 PolarHBondContact O-N 3.25Å; W177-A180 PolarHBondContact O-N 3.02Å; W177-F181 HydrophobicContact CB-CE2 4.34Å; W177-F181 WeakPolarHBondContact O-CD2 3.44Å; W177-F181 WeakPolarHBondContact O-CG 3.24Å; W177-F181 PolarHBondContact O-N 2.93Å
178S91.7Very high82.3Confident3 Ų369.2 Ų69.22%0.02133%0.33CS..Hα-helixtrans-63.7-37.6176.7-51.50000112A27 T30 Y32 G176 F181 A182A27-S178 VanDerWaalsContact CB-O 3.28Å; A27-S178 WeakPolarHBondContact CB-O 3.32Å; T30-S178 WeakPolarHBondContact OG1-CB 3.43Å; T30-S178 PolarHBondContact OG1-OG 2.91Å; Y32-S178 WeakPolarHBondContact CB-OG 3.3Å; Y32-S178 VanDerWaalsContact O-CB 3.24Å; Y32-S178 WeakPolarHBondContact O-CB 3.34Å; Y32-S178 PolarHBondContact O-N 3.38Å; Y32-S178 VanDerWaalsContact O-N 3.1Å; Y32-S178 PolarHBondContact O-OG 3.43Å; G176-S178 PolarHBondContact O-N 3.2Å; S178-F181 PolarHBondContact O-N 3.07Å; S178-A182 PolarHBondContact O-N 3.12Å
179F90.4Very high84.6Confident38 Ų3864.5 Ų64.517%0.16731%0.308CS..Hα-helixtrans-66.9-41.8175.1177.2-92.5000111.3W33 L149 I153 Y175 G176 W177 F181 A182 A183W33-F179 HydrophobicContact CE3-CD2 4.42Å; L149-F179 HydrophobicContact CD2-CD2 3.95Å; L149-F179 HydrophobicContact CD2-CE2 3.85Å; I153-F179 HydrophobicContact CD1-CE2 4.04Å; I153-F179 HydrophobicContact CD1-CZ 3.87Å; I153-F179 HydrophobicContact CG1-CE2 4.05Å; I153-F179 HydrophobicContact CG1-CZ 4.23Å; Y175-F179 AromaticContact CD1-CD1 3.92Å; Y175-F179 HydrophobicContact CD1-CD1 3.92Å; Y175-F179 HydrophobicContact CD1-CD2 4.14Å; Y175-F179 HydrophobicContact CD1-CE1 4.03Å; Y175-F179 HydrophobicContact CD1-CE2 4.24Å; Y175-F179 AromaticContact CD1-CG 3.98Å; Y175-F179 HydrophobicContact CD1-CG 3.98Å; Y175-F179 HydrophobicContact CD1-CZ 4.19Å; Y175-F179 HydrophobicContact CE1-CE2 4.36Å; Y175-F179 HydrophobicContact CE1-CZ 4.33Å; Y175-F179 HydrophobicContact CG-CD1 4.1Å; Y175-F179 HydrophobicContact CG-CE1 4.24Å; G176-F179 WeakPolarHBondContact O-CB 3.49Å; G176-F179 PolarHBondContact O-N 3.41Å; G176-F179 VanDerWaalsContact O-N 3.11Å; W177-F179 VanDerWaalsContact C-N 3.32Å; W177-F179 PolarHBondContact O-N 3.25Å; F179-F181 VanDerWaalsContact C-N 3.34Å; F179-F181 PolarHBondContact O-N 2.96Å; F179-A182 WeakPolarHBondContact O-CB 2.95Å; F179-A182 PolarHBondContact O-N 3.28Å; F179-A183 PolarHBondContact O-N 2.89Å
180A92.8Very high86.7Confident41 Ų4161.7 Ų61.734%0.33930%0.295SS..Hα-helixtrans-63.4-37.5173.900000112.5G176 W177 S184G176-A180 PolarHBondContact O-N 3.06Å; W177-A180 PolarHBondContact O-N 3.02Å; A180-S184 VanDerWaalsContact O-CB 3.32Å; A180-S184 WeakPolarHBondContact O-CB 3.49Å; A180-S184 PolarHBondContact O-N 3.45Å; A180-S184 PolarHBondContact O-OG 3.44Å
181F94.6Very high88.7Confident82 Ų8257.5 Ų57.536%0.3628%0.283SS..Hα-helixtrans-68.6-37.2172.9-64.6-31.3000112.6L23 V26 A27 W177 S178 F179 S184 S185L23-F181 HydrophobicContact CB-CB 4.48Å; L23-F181 HydrophobicContact CD2-CB 4.31Å; L23-F181 HydrophobicContact CD2-CD1 4.03Å; L23-F181 HydrophobicContact CD2-CG 4.17Å; V26-F181 HydrophobicContact CG1-CD2 4.21Å; A27-F181 HydrophobicContact CB-CB 4.39Å; W177-F181 HydrophobicContact CB-CE2 4.34Å; W177-F181 WeakPolarHBondContact O-CD2 3.44Å; W177-F181 WeakPolarHBondContact O-CG 3.24Å; W177-F181 PolarHBondContact O-N 2.93Å; S178-F181 PolarHBondContact O-N 3.07Å; F179-F181 VanDerWaalsContact C-N 3.34Å; F179-F181 PolarHBondContact O-N 2.96Å; F181-S184 PolarHBondContact O-N 3.28Å; F181-S185 WeakPolarHBondContact O-CB 3.35Å; F181-S185 PolarHBondContact O-N 2.99Å
182A93Very high90.4Very high1 Ų153.8 Ų53.81%0.00827%0.267CS..Hα-helixtrans-61.1-49.9172.800000111.3A27 W33 L145 L149 S178 F179 S184 S185 F186A27-A182 HydrophobicContact CB-CB 4.03Å; W33-A182 HydrophobicContact CH2-CB 4.15Å; L145-A182 WeakPolarHBondContact CD2-O 3.37Å; L149-A182 HydrophobicContact CD1-CB 4.38Å; L149-A182 HydrophobicContact CD2-CB 3.97Å; S178-A182 PolarHBondContact O-N 3.12Å; F179-A182 WeakPolarHBondContact O-CB 2.95Å; F179-A182 PolarHBondContact O-N 3.28Å; A182-S184 VanDerWaalsContact C-N 3.35Å; A182-S184 PolarHBondContact O-N 3.4Å; A182-S185 WeakPolarHBondContact O-CB 3.29Å; A182-S185 PolarHBondContact O-N 2.79Å; A182-S185 VanDerWaalsContact O-N 3.15Å; A182-S185 PolarHBondContact O-OG 3.16Å; A182-F186 PolarHBondContact O-N 3.39Å; A182-F186 VanDerWaalsContact O-N 3.12Å
183A93.8Very high91.8Very high39 Ų3948.1 Ų48.132%0.32224%0.241SC..Hα-helixtrans-61.1-40.3175.800000112.7F179 S185 F186 L187F179-A183 PolarHBondContact O-N 2.89Å; A183-S185 VanDerWaalsContact C-N 3.34Å; A183-S185 PolarHBondContact O-N 2.78Å; A183-F186 WeakPolarHBondContact O-CB 3.17Å; A183-F186 PolarHBondContact O-N 3.11Å; A183-L187 PolarHBondContact O-N 3.39Å
184S95.5Very high92.8Very high51 Ų5148.8 Ų48.836%0.35725%0.252SS..Hα-helixtrans-64.6-37.8174.3-58.80000112.2A180 F181 A182 F186 L187 L188A180-S184 VanDerWaalsContact O-CB 3.32Å; A180-S184 WeakPolarHBondContact O-CB 3.49Å; A180-S184 PolarHBondContact O-N 3.45Å; A180-S184 PolarHBondContact O-OG 3.44Å; F181-S184 PolarHBondContact O-N 3.28Å; A182-S184 VanDerWaalsContact C-N 3.35Å; A182-S184 PolarHBondContact O-N 3.4Å; S184-F186 VanDerWaalsContact C-N 3.31Å; S184-F186 PolarHBondContact O-N 2.99Å; S184-L187 PolarHBondContact O-N 2.97Å; S184-L188 WeakPolarHBondContact O-CG 3.46Å; S184-L188 PolarHBondContact O-N 3.25Å
185S95.9Very high93.3Very high0 Ų046 Ų460%024%0.24CC..Hα-helixtrans-65.4-33.1177.183.90000112.6G20 L145 F181 A182 A183 L188 K189G20-S185 WeakPolarHBondContact O-CB 3.3Å; L145-S185 WeakPolarHBondContact CD2-OG 3.2Å; F181-S185 WeakPolarHBondContact O-CB 3.35Å; F181-S185 PolarHBondContact O-N 2.99Å; A182-S185 WeakPolarHBondContact O-CB 3.29Å; A182-S185 PolarHBondContact O-N 2.79Å; A182-S185 VanDerWaalsContact O-N 3.15Å; A182-S185 PolarHBondContact O-OG 3.16Å; A183-S185 VanDerWaalsContact C-N 3.34Å; A183-S185 PolarHBondContact O-N 2.78Å; S185-L188 PolarHBondContact O-N 2.89Å; S185-K189 WeakPolarHBondContact O-CB 3.24Å; S185-K189 WeakPolarHBondContact O-CD 3.49Å; S185-K189 WeakPolarHBondContact O-CG 3.35Å; S185-K189 PolarHBondContact O-N 2.73Å
186F95.9Very high93.4Very high54 Ų5441.8 Ų41.824%0.23722%0.224CC..Hα-helixtrans-60.8-51.8172.9163.4-112.1000111.3G142 L145 V146 A182 A183 S184 L188 K189 E190G142-F186 WeakPolarHBondContact O-CD2 3.42Å; L145-F186 HydrophobicContact CD2-CB 4.38Å; V146-F186 HydrophobicContact CG2-CB 4.34Å; V146-F186 HydrophobicContact CG2-CD1 3.79Å; V146-F186 HydrophobicContact CG2-CD2 3.34Å; V146-F186 HydrophobicContact CG2-CE1 3.84Å; V146-F186 HydrophobicContact CG2-CE2 3.39Å; V146-F186 HydrophobicContact CG2-CG 3.54Å; V146-F186 HydrophobicContact CG2-CZ 3.65Å; A182-F186 PolarHBondContact O-N 3.39Å; A182-F186 VanDerWaalsContact O-N 3.12Å; A183-F186 WeakPolarHBondContact O-CB 3.17Å; A183-F186 PolarHBondContact O-N 3.11Å; S184-F186 VanDerWaalsContact C-N 3.31Å; S184-F186 PolarHBondContact O-N 2.99Å; F186-L188 VanDerWaalsContact C-N 3.27Å; F186-L188 PolarHBondContact O-N 2.96Å; F186-K189 PolarHBondContact O-N 2.68Å; F186-K189 VanDerWaalsContact O-N 3.1Å; F186-E190 HydrophobicContact CD2-CG 3.75Å; F186-E190 HydrophobicContact CE2-CG 3.24Å; F186-E190 WeakPolarHBondContact CE2-OE1 3.38Å; F186-E190 HydrophobicContact CZ-CG 3.68Å; F186-E190 PolarHBondContact O-N 3.04Å
187L95.8Very high93.6Very high120 Ų12043.2 Ų43.263%0.62823%0.231SC*.Hα-helixtrans-59.1-38179.6-62.4177.2000112.3A183 S184 G191A183-L187 PolarHBondContact O-N 3.39Å; S184-L187 PolarHBondContact O-N 2.97Å; L187-G191 PolarHBondContact O-N 3.47Å
188L96.1Very high93.5Very high39 Ų3939.7 Ų39.720%0.20422%0.219CC..Hα-helixtrans-70.7-37.4175.6-68.5172.9000113.2F16 C19 L23 S184 S185 F186 A192F16-L188 HydrophobicContact CB-CD2 4.42Å; F16-L188 HydrophobicContact CD1-CD2 4.13Å; F16-L188 HydrophobicContact CG-CD2 4.18Å; C19-L188 HydrophobicContact CB-CD1 3.95Å; C19-L188 VanDerWaalsContact SG-CD1 3.58Å; L23-L188 HydrophobicContact CD1-CD1 3.82Å; S184-L188 WeakPolarHBondContact O-CG 3.46Å; S184-L188 PolarHBondContact O-N 3.25Å; S185-L188 PolarHBondContact O-N 2.89Å; F186-L188 VanDerWaalsContact C-N 3.27Å; F186-L188 PolarHBondContact O-N 2.96Å; L188-A192 VanDerWaalsContact O-CB 3.27Å; L188-A192 WeakPolarHBondContact O-CB 3.34Å; L188-A192 PolarHBondContact O-N 2.97Å
189K95.2Very high93.3Very high0 Ų039.9 Ų39.90%022%0.22CC..Hα-helixtrans-65.4-48.7175.3-74.2166.1-177.5-170.70111.4S107 V111 S141 S185 F186 A192 G193S107-K189 PolarHBondContact OG-NZ 2.73Å; V111-K189 HydrophobicContact CG2-CD 4.4Å; V111-K189 HydrophobicContact CG2-CG 4.11Å; S141-K189 WeakPolarHBondContact OG-CE 3.3Å; S141-K189 PolarHBondContact OG-NZ 2.8Å; S185-K189 WeakPolarHBondContact O-CB 3.24Å; S185-K189 WeakPolarHBondContact O-CD 3.49Å; S185-K189 WeakPolarHBondContact O-CG 3.35Å; S185-K189 PolarHBondContact O-N 2.73Å; F186-K189 PolarHBondContact O-N 2.68Å; F186-K189 VanDerWaalsContact O-N 3.1Å; K189-A192 PolarHBondContact O-N 2.94Å; K189-G193 PolarHBondContact O-N 3.3Å
190E95.8Very high93Very high36 Ų3640 Ų4017%0.16822%0.22CC..Hα-helixtrans-63.2-43176.1-65.5-55.6148.900111.2G142 F186 A192 G193 V194G142-E190 WeakPolarHBondContact CA-OE1 3.32Å; F186-E190 HydrophobicContact CD2-CG 3.75Å; F186-E190 HydrophobicContact CE2-CG 3.24Å; F186-E190 WeakPolarHBondContact CE2-OE1 3.38Å; F186-E190 HydrophobicContact CZ-CG 3.68Å; F186-E190 PolarHBondContact O-N 3.04Å; E190-A192 PolarHBondContact O-N 3.07Å; E190-G193 PolarHBondContact O-N 2.97Å; E190-V194 WeakPolarHBondContact O-CB 3.35Å; E190-V194 WeakPolarHBondContact O-CG2 3.22Å; E190-V194 PolarHBondContact O-N 3.49Å
191G94.6Very high92.6Very high24 Ų2443.9 Ų43.925%0.24723%0.233CC..Hα-helixtrans-58-45.5173.300000112.9L187 M195L187-G191 PolarHBondContact O-N 3.47Å; G191-M195 VanDerWaalsContact O-CB 3.25Å; G191-M195 WeakPolarHBondContact O-CB 3.36Å; G191-M195 WeakPolarHBondContact O-CG 3.47Å; G191-M195 PolarHBondContact O-N 3.18Å
192A94.4Very high92.2Very high0 Ų042 Ų420%023%0.225CC..Hα-helixtrans-64.5-39.8175.500000112.4S13 F16 F138 L188 K189 E190 S196S13-A192 PolarHBondContact OG-O 2.89Å; F16-A192 HydrophobicContact CB-CB 3.97Å; F138-A192 HydrophobicContact CD1-CB 4.48Å; F138-A192 HydrophobicContact CD2-CB 4.39Å; F138-A192 HydrophobicContact CG-CB 4.37Å; L188-A192 VanDerWaalsContact O-CB 3.27Å; L188-A192 WeakPolarHBondContact O-CB 3.34Å; L188-A192 PolarHBondContact O-N 2.97Å; K189-A192 PolarHBondContact O-N 2.94Å; E190-A192 PolarHBondContact O-N 3.07Å; A192-S196 WeakPolarHBondContact O-CB 3.39Å; A192-S196 PolarHBondContact O-N 3.45Å; A192-S196 PolarHBondContact O-OG 2.97Å
193G94.4Very high91.6Very high0 Ų044.1 Ų44.10%023%0.232CC..Hα-helixtrans-65.8-54.3178.300000112.8K189 E190 M195 S196 V197K189-G193 PolarHBondContact O-N 3.3Å; E190-G193 PolarHBondContact O-N 2.97Å; G193-M195 VanDerWaalsContact C-N 3.31Å; G193-M195 PolarHBondContact O-N 3.41Å; G193-S196 WeakPolarHBondContact O-CB 3.49Å; G193-S196 PolarHBondContact O-N 2.85Å; G193-S196 VanDerWaalsContact O-N 3.1Å; G193-V197 WeakPolarHBondContact O-CG2 3.43Å; G193-V197 PolarHBondContact O-N 2.9Å
194V94.2Very high90.9Very high89 Ų8947.8 Ų47.854%0.53924%0.238SC..Hα-helixtrans-58.4-42.8176.1172.80000111E190 S196 V197 Y198E190-V194 WeakPolarHBondContact O-CB 3.35Å; E190-V194 WeakPolarHBondContact O-CG2 3.22Å; E190-V194 PolarHBondContact O-N 3.49Å; V194-S196 VanDerWaalsContact C-N 3.35Å; V194-S196 PolarHBondContact O-N 3.33Å; V194-V197 PolarHBondContact O-N 3.15Å; V194-Y198 VanDerWaalsContact O-CB 3.28Å; V194-Y198 WeakPolarHBondContact O-CB 3.47Å; V194-Y198 PolarHBondContact O-N 3.22Å
195M91.2Very high90.3Very high49 Ų4948 Ų4824%0.24124%0.243CC..Hα-helixtrans-66.9-34.2176.6-69.2-70.3-97.100112.7L9 L12 G191 G193 L199L9-M195 HydrophobicContact CB-CE 4.48Å; L9-M195 HydrophobicContact CD2-CE 3.74Å; L9-M195 HydrophobicContact CD2-SD 4.04Å; L9-M195 HydrophobicContact CG-CE 3.67Å; L12-M195 HydrophobicContact CD2-CE 3.95Å; G191-M195 VanDerWaalsContact O-CB 3.25Å; G191-M195 WeakPolarHBondContact O-CB 3.36Å; G191-M195 WeakPolarHBondContact O-CG 3.47Å; G191-M195 PolarHBondContact O-N 3.18Å; G193-M195 VanDerWaalsContact C-N 3.31Å; G193-M195 PolarHBondContact O-N 3.41Å; M195-L199 VanDerWaalsContact O-CB 3.3Å; M195-L199 WeakPolarHBondContact O-CB 3.29Å; M195-L199 WeakPolarHBondContact O-CD1 3.33Å; M195-L199 VanDerWaalsContact O-CG 3.25Å; M195-L199 WeakPolarHBondContact O-CG 3.33Å; M195-L199 PolarHBondContact O-N 3.48Å
196S88.9Confident89.4Confident5 Ų551.8 Ų51.84%0.03526%0.261CS..Hα-helixtrans-67.2-43.6173.3-67.20000112.3S13 A192 G193 V194 L199 F200S13-S196 PolarHBondContact OG-OG 2.88Å; A192-S196 WeakPolarHBondContact O-CB 3.39Å; A192-S196 PolarHBondContact O-N 3.45Å; A192-S196 PolarHBondContact O-OG 2.97Å; G193-S196 WeakPolarHBondContact O-CB 3.49Å; G193-S196 PolarHBondContact O-N 2.85Å; G193-S196 VanDerWaalsContact O-N 3.1Å; V194-S196 VanDerWaalsContact C-N 3.35Å; V194-S196 PolarHBondContact O-N 3.33Å; S196-L199 PolarHBondContact O-N 3.45Å; S196-F200 PolarHBondContact O-N 2.62Å
197V90.4Very high88.2Confident38 Ų3854 Ų5423%0.2327%0.272CS..Hα-helixtrans-68.8-40.6177.7174.20000111F132 I139 G193 V194 F200 M201F132-V197 HydrophobicContact CD2-CG2 4.27Å; F132-V197 HydrophobicContact CE2-CG1 4.31Å; F132-V197 HydrophobicContact CE2-CG2 4.36Å; I139-V197 HydrophobicContact CD1-CG2 4.34Å; G193-V197 WeakPolarHBondContact O-CG2 3.43Å; G193-V197 PolarHBondContact O-N 2.9Å; V194-V197 PolarHBondContact O-N 3.15Å; V197-F200 PolarHBondContact O-N 2.85Å; V197-M201 WeakPolarHBondContact O-CB 3.15Å; V197-M201 PolarHBondContact O-N 2.78Å
198Y89.4Confident86.9Confident124 Ų12452.9 Ų52.949%0.48626%0.264SS..Hα-helixtrans-62.5-43.2173.4176.1-99.1000112.1L9 V194 F200 M201 K202L9-Y198 HydrophobicContact CD2-CD1 3.6Å; L9-Y198 HydrophobicContact CD2-CE1 3.68Å; V194-Y198 VanDerWaalsContact O-CB 3.28Å; V194-Y198 WeakPolarHBondContact O-CB 3.47Å; V194-Y198 PolarHBondContact O-N 3.22Å; Y198-F200 VanDerWaalsContact C-N 3.32Å; Y198-F200 PolarHBondContact O-N 2.75Å; Y198-M201 PolarHBondContact O-N 3.16Å; Y198-K202 WeakPolarHBondContact O-CB 3.14Å; Y198-K202 PolarHBondContact O-N 2.84Å
199L86.1Confident85.2Confident8 Ų858.1 Ų58.14%0.04229%0.291CS..Hα-helixtrans-60.2-40.8173.1-83.6168.5000112.4T6 L9 M195 S196 R203T6-L199 HydrophobicContact CG2-CD2 3.86Å; L9-L199 HydrophobicContact CB-CD1 4.08Å; L9-L199 HydrophobicContact CB-CD2 3.78Å; L9-L199 HydrophobicContact CB-CG 4.06Å; L9-L199 HydrophobicContact CD2-CD2 4.39Å; L9-L199 HydrophobicContact CD2-CG 4.4Å; M195-L199 VanDerWaalsContact O-CB 3.3Å; M195-L199 WeakPolarHBondContact O-CB 3.29Å; M195-L199 WeakPolarHBondContact O-CD1 3.33Å; M195-L199 VanDerWaalsContact O-CG 3.25Å; M195-L199 WeakPolarHBondContact O-CG 3.33Å; M195-L199 PolarHBondContact O-N 3.48Å; S196-L199 PolarHBondContact O-N 3.45Å; L199-R203 WeakPolarHBondContact O-CB 3.39Å; L199-R203 VanDerWaalsContact O-CG 3.3Å; L199-R203 WeakPolarHBondContact O-CG 3.28Å; L199-R203 PolarHBondContact O-N 2.94Å
200F84.6Confident83.3Confident39 Ų3967.7 Ų67.717%0.17133%0.328CS..Hα-helixtrans-64.9-51.1174.4173.9-104.2000111.4F132 S196 V197 Y198 K202 R203 Y204F132-F200 HydrophobicContact CB-CB 3.98Å; F132-F200 HydrophobicContact CB-CD1 3.96Å; F132-F200 HydrophobicContact CB-CD2 3.73Å; F132-F200 HydrophobicContact CB-CE1 4.4Å; F132-F200 HydrophobicContact CB-CE2 4.2Å; F132-F200 HydrophobicContact CB-CG 3.6Å; F132-F200 HydrophobicContact CD1-CE1 4.38Å; F132-F200 HydrophobicContact CD2-CB 4.16Å; F132-F200 AromaticContact CD2-CD1 3.4Å; F132-F200 HydrophobicContact CD2-CD1 3.4Å; F132-F200 VanDerWaalsContact CD2-CD1 3.4Å; F132-F200 AromaticContact CD2-CE1 3.95Å; F132-F200 HydrophobicContact CD2-CE1 3.95Å; F132-F200 AromaticContact CD2-CG 3.84Å; F132-F200 HydrophobicContact CD2-CG 3.84Å; F132-F200 AromaticContact CE2-CD1 3.99Å; F132-F200 HydrophobicContact CE2-CD1 3.99Å; F132-F200 HydrophobicContact CE2-CE1 4.29Å; F132-F200 HydrophobicContact CG-CB 4.48Å; F132-F200 AromaticContact CG-CD1 3.73Å; F132-F200 HydrophobicContact CG-CD1 3.73Å; F132-F200 HydrophobicContact CG-CD2 4.35Å; F132-F200 AromaticContact CG-CE1 4Å; F132-F200 HydrophobicContact CG-CE1 4Å; F132-F200 AromaticContact CG-CG 3.92Å; F132-F200 HydrophobicContact CG-CG 3.92Å; F132-F200 HydrophobicContact CG-CZ 4.42Å; S196-F200 PolarHBondContact O-N 2.62Å; V197-F200 PolarHBondContact O-N 2.85Å; Y198-F200 VanDerWaalsContact C-N 3.32Å; Y198-F200 PolarHBondContact O-N 2.75Å; F200-K202 VanDerWaalsContact C-N 3.31Å; F200-K202 PolarHBondContact O-N 2.76Å; F200-R203 PolarHBondContact O-N 3.26Å; F200-R203 VanDerWaalsContact O-N 3.15Å; F200-Y204 HydrophobicContact CZ-CD2 4.09Å; F200-Y204 WeakPolarHBondContact O-CB 3.39Å; F200-Y204 PolarHBondContact O-N 2.91Å
201M85.5Confident81.3Confident124 Ų12475 Ų7561%0.61135%0.354SS*.Hα-helixtrans-57.5-42.7179.4-175.9-177.4-71.900112V197 Y198 Y204 A205V197-M201 WeakPolarHBondContact O-CB 3.15Å; V197-M201 PolarHBondContact O-N 2.78Å; Y198-M201 PolarHBondContact O-N 3.16Å; M201-Y204 PolarHBondContact O-N 3.03Å; M201-A205 WeakPolarHBondContact O-CB 3.35Å; M201-A205 PolarHBondContact O-N 3.34Å
202K84.8Confident79.1Confident43 Ų4379.2 Ų79.219%0.18738%0.378CS..Hα-helixtrans-63.1-46.5175.3-175.7-176.1177.2-1720112.1T6 Y198 F200 Y204 A205 E206T6-K202 PolarHBondContact OG1-NZ 3.21Å; Y198-K202 WeakPolarHBondContact O-CB 3.14Å; Y198-K202 PolarHBondContact O-N 2.84Å; F200-K202 VanDerWaalsContact C-N 3.31Å; F200-K202 PolarHBondContact O-N 2.76Å; K202-Y204 VanDerWaalsContact C-N 3.34Å; K202-A205 PolarHBondContact O-N 3.32Å; K202-E206 VanDerWaalsContact CE-OE1 3.24Å; K202-E206 WeakPolarHBondContact CE-OE1 3.38Å; K202-E206 WeakPolarHBondContact O-CG 3.47Å; K202-E206 PolarHBondContact O-N 3.46Å
203R81.4Confident76.9Confident45 Ų4585.2 Ų85.217%0.1741%0.405CS..Hα-helixtrans-65.8-37176.7-71.9-179.9-161.5-177.19.5111.8T10 T128 L199 F200 E206 E207T10-R203 PolarHBondContact OG1-NH2 3.22Å; T128-R203 HydrophobicContact CG2-CB 4.46Å; L199-R203 WeakPolarHBondContact O-CB 3.39Å; L199-R203 VanDerWaalsContact O-CG 3.3Å; L199-R203 WeakPolarHBondContact O-CG 3.28Å; L199-R203 PolarHBondContact O-N 2.94Å; F200-R203 PolarHBondContact O-N 3.26Å; F200-R203 VanDerWaalsContact O-N 3.15Å; R203-E206 PolarHBondContact O-N 2.98Å; R203-E207 WeakPolarHBondContact O-CB 3.48Å; R203-E207 WeakPolarHBondContact O-CG 3.4Å; R203-E207 PolarHBondContact O-N 3.42Å
204Y79.8Confident74.9Confident115 Ų11590.5 Ų90.545%0.45144%0.44SS..Hα-helixtrans-64.4-43176.1-173.9-86.1000111.2F200 M201 K202 E207 E208F200-Y204 HydrophobicContact CZ-CD2 4.09Å; F200-Y204 WeakPolarHBondContact O-CB 3.39Å; F200-Y204 PolarHBondContact O-N 2.91Å; M201-Y204 PolarHBondContact O-N 3.03Å; K202-Y204 VanDerWaalsContact C-N 3.34Å; Y204-E207 PolarHBondContact O-N 3.38Å; Y204-E208 HydrophobicContact CE1-CB 4.45Å; Y204-E208 WeakPolarHBondContact CE1-OE2 3.24Å; Y204-E208 VanDerWaalsContact O-CB 3.28Å; Y204-E208 WeakPolarHBondContact O-CB 3.44Å; Y204-E208 PolarHBondContact O-N 2.81Å
205A81.3Confident73Confident55 Ų5590.3 Ų90.346%0.45545%0.447SS..Hα-helixtrans-66.3-37.4173.500000112.8M201 K202 L209M201-A205 WeakPolarHBondContact O-CB 3.35Å; M201-A205 PolarHBondContact O-N 3.34Å; K202-A205 PolarHBondContact O-N 3.32Å; A205-L209 VanDerWaalsContact O-CB 3.29Å; A205-L209 WeakPolarHBondContact O-CB 3.42Å; A205-L209 PolarHBondContact O-N 3.41Å
206E77.3Confident71.3Confident80 Ų8095.3 Ų95.337%0.37448%0.475SS..Hα-helixtrans-64.7-40.8171.4-72.9172.9-177.800111.2K202 R203 Y210K202-E206 VanDerWaalsContact CE-OE1 3.24Å; K202-E206 WeakPolarHBondContact CE-OE1 3.38Å; K202-E206 WeakPolarHBondContact O-CG 3.47Å; K202-E206 PolarHBondContact O-N 3.46Å; R203-E206 PolarHBondContact O-N 2.98Å; E206-Y210 WeakPolarHBondContact O-CD2 3.28Å; E206-Y210 PolarHBondContact O-N 2.78Å; E206-Y210 VanDerWaalsContact O-N 3.16Å
207E72.1Confident69.2Low102 Ų102105.4 Ų105.448%0.47751%0.513SS..Hα-helixtrans-68.1-38.4175-77.5176.4-148.600112.7T128 R203 Y204 Y210 R211T128-E207 WeakPolarHBondContact CG2-OE1 3.33Å; R203-E207 WeakPolarHBondContact O-CB 3.48Å; R203-E207 WeakPolarHBondContact O-CG 3.4Å; R203-E207 PolarHBondContact O-N 3.42Å; Y204-E207 PolarHBondContact O-N 3.38Å; E207-Y210 CarbonylContact O-C 3.32Å; E207-Y210 PolarHBondContact O-N 3.08Å; E207-R211 WeakPolarHBondContact O-CB 3.44Å; E207-R211 PolarHBondContact O-N 2.95Å
208E67.5Low66.8Low96 Ų96113.7 Ų113.745%0.44954%0.541SS..Hα-helixtrans-73.7-35.2179.7-172.8159.3-130.600112.1Y204 Y210 R211Y204-E208 HydrophobicContact CE1-CB 4.45Å; Y204-E208 WeakPolarHBondContact CE1-OE2 3.24Å; Y204-E208 VanDerWaalsContact O-CB 3.28Å; Y204-E208 WeakPolarHBondContact O-CB 3.44Å; Y204-E208 PolarHBondContact O-N 2.81Å; E208-Y210 VanDerWaalsContact C-N 3.33Å; E208-R211 WeakPolarHBondContact O-CB 3.39Å; E208-R211 PolarHBondContact O-N 2.96Å
209L59.8Low64.6Low148 Ų148112.9 Ų112.978%0.77555%0.55SS**Hα-helixtrans-66.3-34170-177.264.1000112.4A205A205-L209 VanDerWaalsContact O-CB 3.29Å; A205-L209 WeakPolarHBondContact O-CB 3.42Å; A205-L209 PolarHBondContact O-N 3.41Å
210Y56Low62.6Low201 Ų201123.5 Ų123.579%0.78859%0.59SS**Hα-helixtrans-84.9-10.8174.5-92.5-92.4000114.1E206 E207 E208 P212E206-Y210 WeakPolarHBondContact O-CD2 3.28Å; E206-Y210 PolarHBondContact O-N 2.78Å; E206-Y210 VanDerWaalsContact O-N 3.16Å; E207-Y210 CarbonylContact O-C 3.32Å; E207-Y210 PolarHBondContact O-N 3.08Å; E208-Y210 VanDerWaalsContact C-N 3.33Å; Y210-P212 VanDerWaalsContact O-CD 3.24Å; Y210-P212 WeakPolarHBondContact O-CD 3.35Å
211R52.9Low60.7Low189 Ų189129.9 Ų129.971%0.71362%0.622SS**SBendtrans-75.1111175.7-167.6-179-166.3108.51.1108.6E207 E208 H213E207-R211 WeakPolarHBondContact O-CB 3.44Å; E207-R211 PolarHBondContact O-N 2.95Å; E208-R211 WeakPolarHBondContact O-CB 3.39Å; E208-R211 PolarHBondContact O-N 2.96Å; R211-H213 PolarHBondContact O-N 3.45Å
212P49.3Very low58.6Low114 Ų114128.1 Ų128.174%0.7462%0.622SS**  trans-61.7115.1-173.4-2133.2000110.1Y210 P214Y210-P212 VanDerWaalsContact O-CD 3.24Å; Y210-P212 WeakPolarHBondContact O-CD 3.35Å; P212-P214 WeakPolarHBondContact O-CD 3.46Å; P212-P214 VanDerWaalsContact O-N 3.17Å
213H48.8Very low57Low125 Ų125133.8 Ų133.858%0.57965%0.654SS**  trans-61.9112.5176-91.432.9000109.6R211 A215 L216R211-H213 PolarHBondContact O-N 3.45Å; H213-A215 PolarHBondContact O-N 2.93Å; H213-A215 VanDerWaalsContact O-N 3.13Å; H213-L216 PolarHBondContact O-N 3.15Å
214P52.2Low55.2Low112 Ų112136.9 Ų136.973%0.72768%0.682SS**G310 helixtrans-66.4-17.7177.4-18.233.6000112.1P212 L216 Y217 R218P212-P214 WeakPolarHBondContact O-CD 3.46Å; P212-P214 VanDerWaalsContact O-N 3.17Å; P214-L216 VanDerWaalsContact C-N 3.33Å; P214-L216 PolarHBondContact O-N 3.33Å; P214-Y217 PolarHBondContact O-N 3.1Å; P214-R218 PolarHBondContact O-N 3.11Å
215A52.7Low53.6Low84 Ų84136.1 Ų136.169%0.69469%0.693SS**G310 helixtrans-64.9-27.4-177.800000114.5H213H213-A215 PolarHBondContact O-N 2.93Å; H213-A215 VanDerWaalsContact O-N 3.13Å
216L56Low52Low155 Ų155141.4 Ų141.481%0.81271%0.714SS**G310 helixtrans-94.2-8.9179.6-75.4172.4000114H213 P214H213-L216 PolarHBondContact O-N 3.15Å; P214-L216 VanDerWaalsContact C-N 3.33Å; P214-L216 PolarHBondContact O-N 3.33Å
217Y44.2Very low50.5Low217 Ų217147.7 Ų147.785%0.85174%0.736SS**SBendtrans-12124.1176.9-129.7-82.5000113.4P214 P219P214-Y217 PolarHBondContact O-N 3.1Å; Y217-P219 WeakPolarHBondContact O-CD 3.48Å
218R41.3Very low49.5Very low212 Ų212148.4 Ų148.480%0.875%0.752SS**SBendtrans-89.4110.4157.1-164.2-176.8-157.7-168.16107.1P214 R220P214-R218 PolarHBondContact O-N 3.11Å; R218-R220 PolarHBondContact O-N 3.22Å; R218-R220 VanDerWaalsContact O-N 3.08Å
219P42.8Very low48.4Very low106 Ų106148.1 Ų148.169%0.68877%0.774SS**  trans-53.6121.7165.2-22.233.4000107.6Y217 M221Y217-P219 WeakPolarHBondContact O-CD 3.48Å; P219-M221 PolarHBondContact O-N 3.2Å
220R43.5Very low47.9Very low231 Ų231149.3 Ų149.387%0.87278%0.776SS**  trans-71.984.4172.8-176.6-177.6175.399.51107R218 S222R218-R220 PolarHBondContact O-N 3.22Å; R218-R220 VanDerWaalsContact O-N 3.08Å; R220-S222 PolarHBondContact O-N 3.39Å
221M45.9Very low47.5Very low174 Ų174149.4 Ų149.486%0.85778%0.781SS**  trans-53.8109161.6-80.4179.9156.900106.7P219 D223P219-M221 PolarHBondContact O-N 3.2Å; M221-D223 PolarHBondContact O-N 3.28Å
222S41.8Very low46.9Very low86 Ų86148.4 Ų148.460%0.60179%0.789SS**  trans-84102.2177.848.90000108R220 C224R220-S222 PolarHBondContact O-N 3.39Å; S222-C224 PolarHBondContact O-N 3Å
223D50.8Low46.4Very low163 Ų163149.8 Ų149.887%0.87279%0.785SS**  trans-62.776.1158.4-71.5-43.3000108.7M221M221-D223 PolarHBondContact O-N 3.28Å
224C43.4Very low45.9Very low110 Ų110149 Ų14974%0.74379%0.791SS**  trans-17256.9-179.7-119.30000113.7S222S222-C224 PolarHBondContact O-N 3Å
225S45.4Very low45.5Very low98 Ų98150 Ų15069%0.68579%0.79SS**  trans169.588.7140.552.10000115Y227S225-Y227 PolarHBondContact O-N 2.83Å; S225-Y227 VanDerWaalsContact O-N 3.08Å
226D47.1Very low44.8Very low167 Ų167151 Ų15189%0.89379%0.792SS**SBendtrans-70.75.9167.9-83.7-48.6000114.5
227Y47.4Very low43.8Very low212 Ų212155.8 Ų155.883%0.83180%0.799SS**SBendtrans-139.275.6-174.6-85.4-83.7000113.1S225S225-Y227 PolarHBondContact O-N 2.83Å; S225-Y227 VanDerWaalsContact O-N 3.08Å
228S49.4Very low43.4Very low117 Ų117149.3 Ų149.382%0.81879%0.791SS**  trans-165.546.5156.3-80.70000112.2
229G44.4Very low44.3Very low89 Ų89145 Ų14592%0.91879%0.79SS**  trans-106.411.4176.600000114.7
230Q49.8Very low44.4Very low174 Ų174146 Ų14681%0.81380%0.796SS**  trans-117134.6-170.2-147.6152.51700109.6
231F47.8Very low44Very low202 Ų202143.8 Ų143.889%0.88680%0.796SS**SBendtrans65.285.6-157.6-72.6-97.6000114.9
232L41.1Very low43.6Very low169 Ų169146.9 Ų146.989%0.88580%0.798SS**  -158.7109.3104.6-99173.2000109.3
233H37.4Very low43Very low143 Ų143146.5 Ų146.566%0.66281%0.808SS**  trans-99.3137.9166.9-155.749.4000108.5D235H233-D235 IonicContact CD2-OD1 3.69Å; H233-D235 IonicContact CD2-OD2 3.92Å; H233-D235 IonicContact NE2-OD1 3.51Å
234P39.9Very low42.2Very low108 Ų108150.1 Ų150.170%0.70181%0.809SS**  -118.3138.3128.2-6.125.7000111.2
235D44.2Very low41.9Very low134 Ų134150.2 Ų150.272%0.71781%0.811SS**  trans-64133.5-178.8-54-114.8000112.7H233H233-D235 IonicContact CD2-OD1 3.69Å; H233-D235 IonicContact CD2-OD2 3.92Å; H233-D235 IonicContact NE2-OD1 3.51Å
236S37.1Very low41.8Very low103 Ų103150.9 Ų150.972%0.7281%0.813SS**  trans-162.1104.2149.23.10000113.1
237W34.7Very low41.1Very low256 Ų256147.6 Ų147.697%0.9780%0.803SS**  trans67.5133.2159-100.5-99.5000121.5
238A36.1Very low40.5Very low81 Ų81144 Ų14467%0.66980%0.798SS**  trans-100.2165.117100000111.1
239P59.8Low39.6Very low121 Ų121144.6 Ų144.679%0.78680%0.797SS**  trans-95.6176.7-167.239.1-37.4000113.8
240P46Very low39.2Very low127 Ų127145.1 Ų145.183%0.82579%0.787SS**  trans-119.5154.5149.136.2-27.5000113.9
241Q34.3Very low38.8Very low185 Ų185141 Ų14186%0.86478%0.777SS**  trans-95.3171.6175.4-96.3-81-0.500112.5
242R36.9Very low38.2Very low239 Ų239138.1 Ų138.190%0.90277%0.771SS**  trans-58.1134.7-179.5173-172.7-72179.4-5.1114.3
243G30.7Very low38Very low78 Ų78137.5 Ų137.580%0.80477%0.767SS**  trans-151.2154173.300000114.1
244R33.6Very low37.7Very low240 Ų240134.5 Ų134.591%0.90676%0.762SS**  trans-99.6148.7-167.1-79.6173.4154.5142.1-9.9115.3
245S36.6Very low37.6Very low112 Ų112136.6 Ų136.678%0.78377%0.766SS**  trans56.1163135-65.10000120.5
246P42.9Very low37Very low111 Ų111137.8 Ų137.872%0.72177%0.767SS**  cis-138.2178.222.743.9-25.6000118.4
247S33.6Very low36.9Very low99 Ų99139.6 Ų139.669%0.69277%0.768SS**  trans43.7155.3151.877.20000121.1
248D33.8Very low36.7Very low135 Ų135133 Ų13372%0.72275%0.751SS**  cis-123166.419.4-55.9-50.3000111.9
249V31.4Very low36.5Very low130 Ų130136.9 Ų136.979%0.78876%0.756SS**  cis65.2130.643.3141.90000111.7
250S36.2Very low35.2Very low101 Ų101136.8 Ų136.871%0.70675%0.753SS**  cis-164.1176.55.3-107.70000109
251S40Very low35.6Very low87 Ų87136.6 Ų136.661%0.60875%0.752SS**  cis-174.4152.5-10.646.50000111.2
252D35.4Very low36.9Very low142 Ų142132.9 Ų132.976%0.75974%0.744SS**  trans61.8148.1145.8-73.5-55.4000125
253I36.4Very low37.5Very low155 Ų155126.7 Ų126.780%0.79574%0.735SS**  trans68.1155.9143.4-76.9166.4000119.7
254S31.9Very low37.7Very low81 Ų81130.1 Ų130.157%0.56673%0.73SS**  -169.5170.4-54.772.20000108.9
255I39Very low37.7Very low152 Ų152125.4 Ų125.478%0.77972%0.718SS**  trans71.2143.2160-72.6168.8000114.3
256Q30.6Very low37.5Very low158 Ų158126 Ų12674%0.73872%0.717SS**  cis-153.3169.17.7-142.2170.56.900112.6
257L34.7Very low37.1Very low142 Ų142127 Ų12774%0.74372%0.716SS**  trans43.8136.9149.8-107.965.1000120.1
258N29.8Very low37Very low116 Ų116131.6 Ų131.662%0.6272%0.723SS**  cis-152.7-175.517.7-146.310.8000107.9
259Q32Very low36.8Very low163 Ų163128.9 Ų128.976%0.76273%0.727SS**  cis-149.31714.8-166.5157.2-24.300110.6
260T32.9Very low36.8Very low120 Ų120126.4 Ų126.474%0.73673%0.728SS**  trans-135.7175.7-166.263.10000111.7
261P54.4Low36.5Very low122 Ų122126.9 Ų126.979%0.79273%0.732SS**  -129-93.7-99.722.25.9000119.2
262P62.3Low36Very low107 Ų107128 Ų12870%0.69574%0.739SS**  trans-126.2-161.3-143.743.2-22.4000114.2
263P48.9Very low35.8Very low110 Ų110127.8 Ų127.871%0.71475%0.749SS**  -147.4-178.2117.538.2-22.8000113.4
264Q34.7Very low35.5Very low149 Ų149129.6 Ų129.670%0.69675%0.754SS**  cis-159.9135.9-39.3-100.4-178.1-86.200107.2
265Q35Very low35.5Very low141 Ų141130.4 Ų130.466%0.65977%0.765SS**  65.7156.4102.4-57177.6-14.300116.6
266T32.2Very low35.2Very low125 Ų125129.5 Ų129.577%0.76777%0.767SS**  -167.116950.642.10000112.2
267L33.7Very low36Very low132 Ų132127.6 Ų127.669%0.69177%0.769SS**  cis-177.1165.1-28.5-166.767.3000112.1
268K32.6Very low35.8Very low195 Ų195125.5 Ų125.585%0.84877%0.766SS**  trans83.5153.3162.8-59.6-179.8174.4177.40119
269G29.3Very low35.9Very low78 Ų78124.8 Ų124.880%0.80477%0.77SS**  cis140114.5-25.500000119.4
270G30.5Very low36Very low79 Ų79122.5 Ų122.581%0.81477%0.772SS**  trans93.8160.2159.400000118.3
271S30.3Very low35.9Very low111 Ų111120.5 Ų120.578%0.77678%0.775SS**  cis-172.3139.3-18.250.60000113.9
272S28.9Very low36.3Very low110 Ų110120.4 Ų120.477%0.76977%0.774SS**  trans49.4123.7151.260.80000123.5
273S30.9Very low34.9Very low138 Ų138120.3 Ų120.397%0.96578%0.776SS**  trans-170.4165.7136.9-85.50000113.7
274Q31.6Very low34.3Very low193 Ų193120.4 Ų120.490%0.90278%0.779SS**  trans-109.3137.4-153.5169.8-172.16.500115.3
275A30.3Very low34.2Very low97 Ų97117.8 Ų117.880%0.80278%0.784SS**  trans175.2158.6145.100000113
276T34.5Very low34.1Very low134 Ų134115.7 Ų115.782%0.82279%0.79SS**  trans-133176.8-178.650.50000110.7
277P46.2Very low33.9Very low118 Ų118113.7 Ų113.777%0.76678%0.782SS**  cis-101.5-143.2-10.541.3-29.7000109.9
278S30.6Very low33.7Very low98 Ų98117.8 Ų117.869%0.68579%0.789SS**  cis-155.6160.2-1.639.60000107.7
279S33.2Very low33.5Very low101 Ų101117.5 Ų117.571%0.70679%0.791SS**  cis84.9127.718.781.80000117.6
280S32.1Very low33.6Very low115 Ų115121 Ų12180%0.80479%0.79SS**  cis-177.3136.1-16.8440000111.1
281G31Very low33.7Very low77 Ų77125.5 Ų125.579%0.79479%0.79SS**  trans81.4-176.414400000119.6
282P63.9Low34.9Very low120 Ų120125.6 Ų125.678%0.77979%0.788SS**  trans-130-178.4-153.842.2-27.2000114.7
283S33.2Very low35Very low106 Ų106125.4 Ų125.474%0.74179%0.793SS**  166.1140.5122.7-75.20000115.9
284S34.7Very low35Very low111 Ų111124.2 Ų124.278%0.77678%0.784SS**  trans57.4114.6135.1-56.80000124.6
285A32.7Very low35.1Very low95 Ų95120.5 Ų120.579%0.78578%0.78SS**  80.1139.4117.700000123.4
286A32.9Very low35.2Very low96 Ų96121.8 Ų121.879%0.79378%0.783SS**  trans68.2150.1154.900000118.8
287S29.1Very low35.1Very low84 Ų84120.7 Ų120.759%0.58778%0.781SS**  cis-174.4155.8-18.550.20000112.2
288Y28.9Very low34.4Very low218 Ų218121.1 Ų121.186%0.85578%0.781SS**  trans78.3159.2158.4-56.1-60.8000122.5
289Q28.7Very low34.6Very low189 Ų189121.5 Ų121.588%0.88378%0.784SS**  trans90.4155.8164.4-62.2-148.7-34.900120.3
290L32.2Very low34.6Very low151 Ų151121.7 Ų121.779%0.79179%0.785SS**  trans-123.3-177.7-159.5-70.175.4000111.6
291H32.7Very low34.6Very low174 Ų174120.6 Ų120.681%0.80678%0.778SS**  trans84.1156157.6-97.1-102.1000115.8
292P55.3Low34.8Very low113 Ų113127.4 Ų127.473%0.73478%0.781SS**  -135.2-179.4-116.439.6-20.3000114.4
293A30.2Very low34.3Very low105 Ų105126.7 Ų126.787%0.86878%0.776SS**  trans-139.6133.9163.300000111.1
294S32.1Very low34.4Very low113 Ų113130.6 Ų130.679%0.7978%0.783SS**  trans-105.6147.2169.353.70000109.9
295S33.1Very low35.1Very low116 Ų116130.6 Ų130.681%0.81178%0.78SS**  158.1136.6122.253.90000114
296S31.8Very low35Very low123 Ų123134.3 Ų134.386%0.8679%0.785SS**  trans-157.4137.7144.956.40000106.9
297S32.4Very low35.1Very low111 Ų111138 Ų13878%0.77679%0.786SS**  trans-145143.8-155.750.40000115.4
298T32.4Very low36.3Very low128 Ų128139.6 Ų139.679%0.78580%0.795SS**  trans-148.4119.7157.2470000106.3
299S33.6Very low36.3Very low105 Ų105132.8 Ų132.873%0.73479%0.791SS**  cis61.2133.548.6850000112.6
300S34.7Very low36.6Very low106 Ų106128.4 Ų128.474%0.74179%0.787SS**  cis-167.8170.4-2.1-114.10000109.4
301S30.3Very low36.6Very low92 Ų92128 Ų12864%0.64379%0.79SS**  cis-161.8136.31.3-106.80000112.2
302Y35.8Very low36.5Very low219 Ų219124.7 Ų124.786%0.85979%0.787SS**  trans50.8146.8142-71.5-88000125.6
303P53Low35.3Very low105 Ų105126.6 Ų126.668%0.68280%0.797SS**  trans-113.5-178.9175.344-35000114.3
304H35.3Very low35.4Very low189 Ų189129.3 Ų129.388%0.87580%0.796SS**  trans-160.7146.8148.3-106.5-74.2000112.7
305P51.1Low35.2Very low110 Ų110130.1 Ų130.171%0.71480%0.796SS**  trans-108.8161.817639.5-33000113.8
306L30.2Very low35Very low173 Ų173135.4 Ų135.491%0.90680%0.799SS**  trans-165.4151.8160.1-107.8162.7000113.1
307H35.3Very low35.1Very low173 Ų173135.8 Ų135.880%0.80180%0.795SS**  trans-130173.3167.9-126.1-94.4000105.9
308P53.2Low35.8Very low119 Ų119135.8 Ų135.877%0.77379%0.793SS**  cis-132.1-175-1.143-27000114.1
309G30Very low35.8Very low75 Ų75138 Ų13877%0.77379%0.794SS**  trans-171.7145.1164.300000112
310A34.7Very low35.6Very low97 Ų97137.8 Ų137.880%0.80280%0.798SS**  trans-151.7126.7-178.700000112.9
311T31.6Very low35.6Very low141 Ų141140.5 Ų140.587%0.86580%0.803SS**  trans-163.2132.8153.96.40000113.6
312S30.9Very low35.6Very low105 Ų105141.1 Ų141.173%0.73482%0.815SS**  trans18.6131.6145.7-49.20000122.5
313T30.3Very low35.4Very low154 Ų154139.6 Ų139.695%0.94582%0.815SS**  -158.4159.3114.47.80000111.4
314L31.4Very low34.3Very low161 Ų161140 Ų14084%0.84382%0.82SS**  trans-148.8119.3-166.5-174.9164.6000112
315T28.3Very low34.1Very low130 Ų130140 Ų14080%0.79882%0.82SS**  trans-169.9157.8169.8330000109.5
316R28.3Very low33Very low228 Ų228139.7 Ų139.786%0.8682%0.821SS**  cis-169133.7-25.9-173.6178.3-155.11556.3108.1
317V34.7Very low33Very low131 Ų131138.6 Ų138.679%0.79481%0.811SS**  trans-91.5147.2174.9-162.80000109.9
318P46.1Very low33.5Very low111 Ų111136.2 Ų136.272%0.72181%0.811SS**  -147.6153.9114.636.8-20.1000117.1
319H32.3Very low32.5Very low174 Ų174138.3 Ų138.381%0.80681%0.81SS**  trans-16151.3164.1-57.5-89.5000122.9
320A30.8Very low32.6Very low100 Ų100140.5 Ų140.583%0.82681%0.813SS**  trans-148.4150.9130.400000111.3
321L33.4Very low32.6Very low163 Ų163141.6 Ų141.685%0.85382%0.816SS**  trans-111.7156.2168.7-80.482.9000110
322A31.1Very low32.8Very low106 Ų106138.1 Ų138.188%0.87681%0.808SS**  trans-148.4152162.200000111.6
323H32.5Very low33.4Very low186 Ų186139 Ų13986%0.86181%0.811SS**  trans-102.8151.3-176.6-86.3-90.6000113.6
324S29.2Very low34.1Very low115 Ų115137.4 Ų137.480%0.80480%0.803SS**  trans-150.2116.1139.344.40000106.7
325Q30Very low34.4Very low187 Ų187135.8 Ų135.887%0.87480%0.802SS**  60.2131.166.8-74.5-163.8-13.700114.3
326S28.7Very low34.8Very low104 Ų104138.7 Ų138.773%0.72781%0.807SS**  trans-147.1159.8-163.452.90000112.6
327H31.3Very low35.2Very low150 Ų150133.5 Ų133.569%0.69481%0.805SS**  trans68.1160.7172.8-75.2-49.8000116.5H329H327-H329 AromaticContact CE1-CD2 3.76Å; H327-H329 AromaticContact CE1-NE2 3.46Å; H327-H329 PolarHBondContact CE1-NE2 3.28Å; H327-H329 AromaticContact ND1-CD2 3.6Å; H327-H329 AromaticContact ND1-NE2 3.72Å
328P44.5Very low35.6Very low124 Ų124135.1 Ų135.181%0.80581%0.809SS**  cis-116.7174.614.941.4-30000117.1
329H32.3Very low35.5Very low163 Ų163135.3 Ų135.376%0.75581%0.81SS**  trans-77.3161.5174.8-70.8-99.8000112.9H327H327-H329 AromaticContact CE1-CD2 3.76Å; H327-H329 AromaticContact CE1-NE2 3.46Å; H327-H329 PolarHBondContact CE1-NE2 3.28Å; H327-H329 AromaticContact ND1-CD2 3.6Å; H327-H329 AromaticContact ND1-NE2 3.72Å
330S33.3Very low35.9Very low120 Ų120136.3 Ų136.384%0.83982%0.817SS**  trans-119.9154.4158.4-169.80000109.9
331S33.7Very low36.6Very low121 Ų121138.2 Ų138.285%0.84682%0.818SS**  trans-100.2142.6-166.749.30000114.1
332G35.8Very low37.8Very low68 Ų68134.5 Ų134.570%0.70181%0.811SS**  trans-127.7156.6169.400000111.5
333P43.8Very low38.6Very low124 Ų124135 Ų13581%0.80581%0.806SS**PPolyproline II helixtrans-77.1157-174.431.7-35.8000113.4
334P44.1Very low39.4Very low119 Ų119132.2 Ų132.277%0.77380%0.804SS**PPolyproline II helixtrans-79.7148.8-174.932.3-36000113.7
335P37.4Very low40.4Very low127 Ų127132.2 Ų132.283%0.82580%0.804SS**PPolyproline II helixtrans-74.2162.4168.332.7-34.8000112.2
336Q37.3Very low41.3Very low192 Ų192128.2 Ų128.290%0.89780%0.803SS**PPolyproline II helixtrans-81.5153.2-171.9-66.3166.5-15.800113
337S37Very low42.8Very low119 Ų119129.7 Ų129.783%0.83281%0.807SS**PPolyproline II helixtrans-79.7139.1176.945.40000112.7
338L43.5Very low44.2Very low165 Ų165127.6 Ų127.686%0.86481%0.807SS**  trans-120150.2166.2-75.8170.6000109.5
339P43.6Very low44.8Very low115 Ų115127.2 Ų127.275%0.74780%0.804SS**PPolyproline II helixtrans-76.2145.3-167.929.9-35.6000113.3V341P339-V341 PolarHBondContact O-N 2.85Å
340M41.3Very low45.6Very low195 Ų195124.2 Ų124.296%0.96180%0.799SS**PPolyproline II helixtrans-66.7127.9169.6-82.2-168.6-83.100111.2
341V44.2Very low46.5Very low139 Ų139127.4 Ų127.484%0.84280%0.801SS**PPolyproline II helixtrans-91130164.51780000108.2P339P339-V341 PolarHBondContact O-N 2.85Å
342A59Low47.1Very low85 Ų85131.5 Ų131.570%0.70280%0.799SS**PPolyproline II helixtrans-74.8144.217900000111.7
343P47.1Very low47.6Very low118 Ų118136.9 Ų136.977%0.76681%0.805SS**PPolyproline II helixtrans-72.2145178.229.9-34.9000111.9
344P49.7Very low47.8Very low126 Ų126137.3 Ų137.382%0.81881%0.806SS**PPolyproline II helixtrans-71.3153.1175.630.5-35000112.2
345S51.4Low47.7Very low116 Ų116139.8 Ų139.881%0.81181%0.807SS**PPolyproline II helixtrans-68.6146.2-177.5-51.60000113.4
346A47.6Very low48Very low103 Ų103140.4 Ų140.485%0.85181%0.808SS**PPolyproline II helixtrans-68.7136.5179.100000112.7
347V60.9Low48.4Very low134 Ų134142.5 Ų142.581%0.81281%0.808SS**PPolyproline II helixtrans-93.9129.1173.9179.70000109.2
348P61.5Low48.7Very low107 Ų107145.7 Ų145.770%0.69581%0.812SS**PPolyproline II helixtrans-74.4148.1177.230.6-34.6000112
349P56.8Low48.6Very low115 Ų115142.9 Ų142.975%0.74781%0.807SS**PPolyproline II helixtrans-73.1152.8-179.530.7-35.7000112.6
350P49.3Very low48.8Very low100 Ų100142.2 Ų142.265%0.64981%0.811SS**PPolyproline II helixtrans-74.5140.4-179.930.4-35.1000112.7Y352P350-Y352 HydrophobicContact CG-CE2 4.23Å
351H51.4Low49Very low188 Ų188138.4 Ų138.487%0.8780%0.803SS**PPolyproline II helixtrans-72.4127169.2-87.3-79.3000111.4
352Y46Very low49.7Very low207 Ų207137.7 Ų137.781%0.81280%0.801SS**PPolyproline II helixtrans-96.4126.2166.3-75.5-88.3000110.5P350 T354P350-Y352 HydrophobicContact CG-CE2 4.23Å; Y352-T354 PolarHBondContact O-N 2.74Å
353H45.8Very low48.8Very low180 Ų180143.6 Ų143.683%0.83384%0.835SS**PPolyproline II helixtrans-79.1116.6174.3-83.2-77.3000111.4H355H353-H355 PolarHBondContact O-N 3.16Å
354T48.4Very low48.9Very low133 Ų133144.9 Ų144.982%0.81684%0.839SS**  trans-8684.5175.8460000112.2Y352Y352-T354 PolarHBondContact O-N 2.74Å
355H42.7Very low48.9Very low171 Ų171145.9 Ų145.979%0.79284%0.84SS**  trans-142.798172.5-90.8-87.3000113.8H353H353-H355 PolarHBondContact O-N 3.16Å
356T42.4Very low48.7Very low140 Ų140147.6 Ų147.686%0.85984%0.841SS**  -161.7119.7128.218.60000109.8
357R46.5Very low48.8Very low237 Ų237150.2 Ų150.289%0.89484%0.841SS**  trans-108.6102.6173.6-176.1-173.4-167.6-177.75.4107.4S359R357-S359 PolarHBondContact O-N 3.46Å
358M42.6Very low48.1Very low185 Ų185151.2 Ų151.291%0.91184%0.843SS**PPolyproline II helixtrans-75.8116.3174.8-76.3-176.2170.800109.6
359S42.3Very low47.2Very low107 Ų107154.1 Ų154.175%0.74885%0.853SS**PPolyproline II helixtrans-76139.9176-60.80000110.9R357R357-S359 PolarHBondContact O-N 3.46Å
360A47.6Very low46.5Very low101 Ų101156.9 Ų156.984%0.83586%0.86SS**PPolyproline II helixtrans-71.8136.6163.600000110
361S46.5Very low46.2Very low115 Ų115161.3 Ų161.380%0.80488%0.876SS**PPolyproline II helixtrans-102.3124.2173.454.30000110.6
362P57.1Low45.8Very low123 Ų123159.1 Ų159.180%0.79988%0.877SS**PPolyproline II helixtrans-88.4126.4170.733.2-30000111.2
363C41.9Very low45.8Very low210 Ų210154.7 Ų154.7100%1.41988%0.883SS**  trans-154.20159.7-85.30000107.2

Retrieved 363 of 363 residues in 526 ms (Link to these results)