A0A075C9B0_HUMAN Loading...

ATP synthase subunit a

AlphaFold DB , UniProt , Accession A0A075C9B0, Species HUMAN (Homo sapiens, Human), Gene ATP6, Length 226 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
1M54.8Low73.7Confident204 Ų20497.8 Ų97.8100%1.00553%0.528SS*.  0-33.20-75.5172.993.700113E3 N4M1-E3 PolarHBondContact O-N 3.41Å; M1-N4 PolarHBondContact O-N 3.06Å
2N52.5Low74.6Confident144 Ų14492.8 Ų92.877%0.7751%0.505SS*.Hα-helixtrans-60.7-38.9-178.1-80.719.5000115.4N4N2-N4 VanDerWaalsContact C-N 3.35Å; N2-N4 PolarHBondContact O-N 3.07Å
3E58.6Low75.6Confident153 Ų15393.5 Ų93.572%0.71551%0.513SS*.Hα-helixtrans-73.3-25-178.7-68.5-87.5138.600113.2M1 L5 F6 A7M1-E3 PolarHBondContact O-N 3.41Å; E3-L5 VanDerWaalsContact C-N 3.32Å; E3-L5 PolarHBondContact O-N 3.35Å; E3-F6 PolarHBondContact O-N 3.35Å; E3-A7 PolarHBondContact O-N 3.29Å
4N74.3Confident76.4Confident114 Ų11494.8 Ų94.861%0.6152%0.518SS*.Hα-helixtrans-71.4-28.5-172.6-66.87.1000112.5M1 N2M1-N4 PolarHBondContact O-N 3.06Å; N2-N4 VanDerWaalsContact C-N 3.35Å; N2-N4 PolarHBondContact O-N 3.07Å
5L76.1Confident77.1Confident45 Ų45100 Ų10024%0.23654%0.544CS..Hα-helixtrans-69.5-35.8179.3-68.4177.3000112.1E3 H172 L173E3-L5 VanDerWaalsContact C-N 3.32Å; E3-L5 PolarHBondContact O-N 3.35Å; L5-H172 VanDerWaalsContact CD2-CE1 3.4Å; L5-H172 WeakPolarHBondContact CD2-CE1 3.27Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.34Å; L5-L173 HydrophobicContact CD1-CD2 4.12Å; L5-L173 HydrophobicContact CD2-CD2 4.35Å
6F82Confident77.5Confident118 Ų11898.3 Ų98.352%0.51856%0.556SS.*Hα-helixtrans-93.9-8.8-176.8-66.8-75.8000113.7E3 S8 F9 L169E3-F6 PolarHBondContact O-N 3.35Å; F6-S8 PolarHBondContact O-N 2.93Å; F6-S8 VanDerWaalsContact O-N 3.14Å; F6-F9 AromaticContact CD1-CD2 3.98Å; F6-F9 HydrophobicContact CD1-CD2 3.98Å; F6-F9 HydrophobicContact CD1-CE2 4.35Å; F6-F9 PolarHBondContact O-N 2.96Å; F6-L169 HydrophobicContact CD1-CD2 4.36Å; F6-L169 HydrophobicContact CE1-CD1 4.09Å; F6-L169 HydrophobicContact CE1-CD2 3.99Å; F6-L169 HydrophobicContact CZ-CD2 4.42Å
7A80.6Confident78Confident54 Ų5499.8 Ų99.845%0.44656%0.562SS.*G310 helixtrans-55-33.2-179.700000113.1E3 F9 I10E3-A7 PolarHBondContact O-N 3.29Å; A7-F9 VanDerWaalsContact C-N 3.26Å; A7-F9 PolarHBondContact O-N 2.86Å; A7-I10 PolarHBondContact O-N 3.3Å
8S80.1Confident78.4Confident59 Ų5998.6 Ų98.641%0.41356%0.558SS.*G310 helixtrans-68.7-20.2176.957.10000114.1F6 F92F6-S8 PolarHBondContact O-N 2.93Å; F6-S8 VanDerWaalsContact O-N 3.14Å; S8-F92 WeakPolarHBondContact O-CD2 3.38Å
9F82.9Confident78.8Confident24 Ų2493.9 Ų93.911%0.10553%0.533CS..G310 helixtrans-93.7-9.2178-58.3-70.6000113F6 A7 A11 T96 Q97 T165 H168 L169F6-F9 AromaticContact CD1-CD2 3.98Å; F6-F9 HydrophobicContact CD1-CD2 3.98Å; F6-F9 HydrophobicContact CD1-CE2 4.35Å; F6-F9 PolarHBondContact O-N 2.96Å; A7-F9 VanDerWaalsContact C-N 3.26Å; A7-F9 PolarHBondContact O-N 2.86Å; F9-A11 PolarHBondContact O-N 3.45Å; F9-T96 HydrophobicContact CD1-CG2 3.82Å; F9-T96 HydrophobicContact CE1-CG2 3.7Å; F9-Q97 PolarHBondContact O-NE2 3.01Å; F9-T165 HydrophobicContact CD1-CG2 4.41Å; F9-T165 HydrophobicContact CE1-CG2 4.11Å; F9-H168 HydrophobicContact CE1-CB 4.1Å; F9-H168 HydrophobicContact CZ-CB 3.81Å; F9-L169 HydrophobicContact CE2-CD1 4.46Å; F9-L169 HydrophobicContact CE2-CD2 3.68Å; F9-L169 HydrophobicContact CE2-CG 3.77Å; F9-L169 HydrophobicContact CZ-CD2 4.32Å; F9-L169 HydrophobicContact CZ-CG 3.93Å
10I85.3Confident79.2Confident108 Ų10890.1 Ų90.155%0.55451%0.514SS*.SBendtrans-69.9130.3178.1-59.4175.2000108.6A7 P12A7-I10 PolarHBondContact O-N 3.3Å; I10-P12 WeakPolarHBondContact O-CD 3.46Å
11A83.8Confident79.5Confident53 Ų5389.7 Ų89.744%0.43851%0.513SS..PPolyproline II helixtrans-59.1120.6179.700000110.2F9 T13F9-A11 PolarHBondContact O-N 3.45Å; A11-T13 PolarHBondContact O-N 3.28Å
12P84.3Confident81Confident38 Ų3886.3 Ų86.325%0.24750%0.498CS..PPolyproline II helixtrans-71.2127-17426.7-33.1000110.1I10 A19 A20 I23 F92I10-P12 WeakPolarHBondContact O-CD 3.46Å; P12-A19 HydrophobicContact CB-CB 4.23Å; P12-A19 HydrophobicContact CG-CB 4.38Å; P12-A19 WeakPolarHBondContact O-CB 3.31Å; P12-A19 PolarHBondContact O-N 3.37Å; P12-A20 PolarHBondContact O-N 3.15Å; P12-I23 HydrophobicContact CG-CD1 3.67Å; P12-F92 HydrophobicContact CG-CB 4.41Å; P12-F92 HydrophobicContact CG-CD1 4.15Å; P12-F92 HydrophobicContact CG-CG 4.1Å
13T87.4Confident82.7Confident101 Ų10182.1 Ų82.162%0.6248%0.476SS*.EExtended strand (participates in β ladder)trans-118.8126.9170.354.50000108.6A11 L17A11-T13 PolarHBondContact O-N 3.28Å; T13-L17 CarbonylContact C-O 3.57Å; T13-L17 VanDerWaalsContact CA-O 3.27Å; T13-L17 WeakPolarHBondContact CA-O 3.31Å
14I87.6Confident84.1Confident112 Ų11277.3 Ų77.357%0.57445%0.454SS*.EExtended strand (participates in β ladder)trans-112.9122176.2-64172.9000106.3G16 L17 A19I14-G16 PolarHBondContact O-N 3.12Å; I14-G16 VanDerWaalsContact O-N 3.16Å; I14-L17 PolarHBondContact N-O 2.99Å; I14-L17 PolarHBondContact O-N 3.48Å; I14-A19 HydrophobicContact CB-CB 4.45Å; I14-A19 HydrophobicContact CD1-CB 3.88Å; I14-A19 HydrophobicContact CG1-CB 3.92Å
15L86.2Confident84.8Confident173 Ų17377.2 Ų77.291%0.90645%0.453SS*.THydrogen-bonded Turntrans54.233.6179.6-71.8149.3000113.5L17L15-L17 PolarHBondContact O-N 3.42Å
16G84Confident85.4Confident72 Ų7280 Ų8074%0.74246%0.463SS*.THydrogen-bonded Turntrans78.4-2.4-177.600000115.2I14I14-G16 PolarHBondContact O-N 3.12Å; I14-G16 VanDerWaalsContact O-N 3.16Å
17L85.3Confident85.7Confident125 Ų12574.5 Ų74.565%0.65444%0.44SS*.EExtended strand (participates in β ladder)trans-92.5140.1173.1-66.6168.1000110.8T13 I14 L15 A19T13-L17 CarbonylContact C-O 3.57Å; T13-L17 VanDerWaalsContact CA-O 3.27Å; T13-L17 WeakPolarHBondContact CA-O 3.31Å; I14-L17 PolarHBondContact N-O 2.99Å; I14-L17 PolarHBondContact O-N 3.48Å; L15-L17 PolarHBondContact O-N 3.42Å; L17-A19 PolarHBondContact O-N 3.45Å
18P85.8Confident85.9Confident77 Ų7775.1 Ų75.150%0.544%0.439SS..EExtended strand (participates in β ladder)trans-71.899.4178.629.4-33.4000110.5A20 V21P18-A20 PolarHBondContact O-N 3.17Å; P18-V21 HydrophobicContact CB-CG2 4.4Å; P18-V21 HydrophobicContact CG-CG2 4.17Å; P18-V21 PolarHBondContact O-N 3.3Å
19A86.3Confident86.3Confident10 Ų1078.6 Ų78.68%0.08345%0.452CS..THydrogen-bonded Turntrans-67.2-1817700000112.3P12 I14 L17 V21 L22 I23P12-A19 HydrophobicContact CB-CB 4.23Å; P12-A19 HydrophobicContact CG-CB 4.38Å; P12-A19 WeakPolarHBondContact O-CB 3.31Å; P12-A19 PolarHBondContact O-N 3.37Å; I14-A19 HydrophobicContact CB-CB 4.45Å; I14-A19 HydrophobicContact CD1-CB 3.88Å; I14-A19 HydrophobicContact CG1-CB 3.92Å; L17-A19 PolarHBondContact O-N 3.45Å; A19-V21 PolarHBondContact O-N 3.08Å; A19-V21 VanDerWaalsContact O-N 3.15Å; A19-L22 WeakPolarHBondContact O-CB 2.92Å; A19-L22 PolarHBondContact O-N 2.96Å; A19-L22 VanDerWaalsContact O-N 3.13Å; A19-I23 PolarHBondContact O-N 3.41Å
20A86.1Confident86.5Confident18 Ų1880.8 Ų80.815%0.14947%0.465CS..Hα-helixtrans-53.3-32.317300000113.3P12 P18 L22 I23 I24 F92P12-A20 PolarHBondContact O-N 3.15Å; P18-A20 PolarHBondContact O-N 3.17Å; A20-L22 PolarHBondContact O-N 3.14Å; A20-I23 PolarHBondContact O-N 2.89Å; A20-I24 VanDerWaalsContact O-CG1 3.28Å; A20-I24 WeakPolarHBondContact O-CG1 3.26Å; A20-I24 PolarHBondContact O-N 3.35Å; A20-F92 HydrophobicContact CB-CE1 4.39Å
21V85.9Confident86.6Confident81 Ų8178.4 Ų78.449%0.49145%0.453SS..Hα-helixtrans-64.4-42.3179.3179.90000111.5P18 A19 I23 I24 L25P18-V21 HydrophobicContact CB-CG2 4.4Å; P18-V21 HydrophobicContact CG-CG2 4.17Å; P18-V21 PolarHBondContact O-N 3.3Å; A19-V21 PolarHBondContact O-N 3.08Å; A19-V21 VanDerWaalsContact O-N 3.15Å; V21-I23 VanDerWaalsContact C-N 3.29Å; V21-I23 PolarHBondContact O-N 3.11Å; V21-I24 PolarHBondContact O-N 3.34Å; V21-L25 HydrophobicContact CG1-CD1 4.08Å; V21-L25 WeakPolarHBondContact O-CG 3.06Å; V21-L25 PolarHBondContact O-N 2.85Å
22L86.6Confident86.7Confident133 Ų13380.6 Ų80.670%0.69646%0.457SS*.Hα-helixtrans-62.2-40.3176.2-79.7156000111.3A19 A20 L25 F26A19-L22 WeakPolarHBondContact O-CB 2.92Å; A19-L22 PolarHBondContact O-N 2.96Å; A19-L22 VanDerWaalsContact O-N 3.13Å; A20-L22 PolarHBondContact O-N 3.14Å; L22-L25 PolarHBondContact O-N 3.36Å; L22-F26 PolarHBondContact O-N 3.41Å; L22-F26 VanDerWaalsContact O-N 3.17Å
23I87.9Confident86.8Confident57 Ų5785 Ų8529%0.29248%0.483SS..Hα-helixtrans-66.6-41.1179.8-57.9173.1000110.6P12 A19 A20 V21 L25 F26 P27 F92P12-I23 HydrophobicContact CG-CD1 3.67Å; A19-I23 PolarHBondContact O-N 3.41Å; A20-I23 PolarHBondContact O-N 2.89Å; V21-I23 VanDerWaalsContact C-N 3.29Å; V21-I23 PolarHBondContact O-N 3.11Å; I23-L25 VanDerWaalsContact C-N 3.3Å; I23-L25 PolarHBondContact O-N 2.93Å; I23-F26 WeakPolarHBondContact O-CB 3.45Å; I23-F26 PolarHBondContact O-N 3.36Å; I23-P27 WeakPolarHBondContact O-CD 3.24Å; I23-F92 HydrophobicContact CD1-CB 3.98Å; I23-F92 HydrophobicContact CD1-CD1 3.93Å; I23-F92 HydrophobicContact CD1-CG 4.34Å; I23-F92 HydrophobicContact CG2-CD1 4.48Å; I23-F92 WeakPolarHBondContact CG2-O 3.45Å
24I88.6Confident86.7Confident52 Ų5282 Ų8227%0.26747%0.466SS..Hα-helixtrans-66.3-32.7176.8-67.7164.1000111.8A20 V21 F26 P27 F78 P94 M100A20-I24 VanDerWaalsContact O-CG1 3.28Å; A20-I24 WeakPolarHBondContact O-CG1 3.26Å; A20-I24 PolarHBondContact O-N 3.35Å; V21-I24 PolarHBondContact O-N 3.34Å; I24-F26 VanDerWaalsContact C-N 3.34Å; I24-P27 WeakPolarHBondContact O-CD 3.39Å; I24-F78 HydrophobicContact CG2-CZ 4.32Å; I24-P94 HydrophobicContact CD1-CB 4.3Å; I24-P94 HydrophobicContact CG1-CB 3.73Å; I24-P94 HydrophobicContact CG1-CG 4.09Å; I24-M100 HydrophobicContact CD1-SD 4.5Å; I24-M100 HydrophobicContact CG2-CE 4.42Å
25L87.7Confident86.6Confident112 Ų11286.9 Ų86.959%0.58648%0.483SS*.Hα-helixtrans-80.2-13.1178.4-72.3171.8000114V21 L22 I23 P28V21-L25 HydrophobicContact CG1-CD1 4.08Å; V21-L25 WeakPolarHBondContact O-CG 3.06Å; V21-L25 PolarHBondContact O-N 2.85Å; L22-L25 PolarHBondContact O-N 3.36Å; I23-L25 VanDerWaalsContact C-N 3.3Å; I23-L25 PolarHBondContact O-N 2.93Å; L25-P28 WeakPolarHBondContact O-CD 3.46Å
26F89Confident86.6Confident103 Ų10387.5 Ų87.545%0.45248%0.475SS..Hα-helixtrans-70-44-176.8-170.2-98.1000114.9L22 I23 I24 L29 L30 L85L22-F26 PolarHBondContact O-N 3.41Å; L22-F26 VanDerWaalsContact O-N 3.17Å; I23-F26 WeakPolarHBondContact O-CB 3.45Å; I23-F26 PolarHBondContact O-N 3.36Å; I24-F26 VanDerWaalsContact C-N 3.34Å; F26-L29 VanDerWaalsContact O-CB 3.28Å; F26-L29 WeakPolarHBondContact O-CB 3.26Å; F26-L29 PolarHBondContact O-N 2.98Å; F26-L30 HydrophobicContact CE1-CD1 4.31Å; F26-L30 HydrophobicContact CE1-CD2 4.33Å; F26-L30 HydrophobicContact CE1-CG 4.39Å; F26-L85 HydrophobicContact CD1-CD2 3.28Å; F26-L85 HydrophobicContact CE1-CD2 3.49Å; F26-L85 VanDerWaalsContact CE1-CD2 3.49Å
27P88.5Confident86.4Confident3 Ų392.6 Ų92.62%0.01948%0.484CS..Hα-helixtrans-56.5-42.7179.9-1011.2000115.2I23 I24 L29 L30 T81 T82I23-P27 WeakPolarHBondContact O-CD 3.24Å; I24-P27 WeakPolarHBondContact O-CD 3.39Å; P27-L29 PolarHBondContact O-N 3.03Å; P27-L30 WeakPolarHBondContact O-CB 3.49Å; P27-L30 PolarHBondContact O-N 2.98Å; P27-L30 VanDerWaalsContact O-N 3.11Å; P27-T81 WeakPolarHBondContact CB-OG1 3.42Å; P27-T82 HydrophobicContact CB-CG2 4.13Å; P27-T82 HydrophobicContact CG-CG2 3.38Å
28P84.9Confident86.5Confident67 Ų6794 Ų9444%0.43549%0.49SS..Hα-helixtrans-55.4-33173.5-27.433.1000114.3L25 L30 I31L25-P28 WeakPolarHBondContact O-CD 3.46Å; P28-L30 PolarHBondContact O-N 3.32Å; P28-I31 PolarHBondContact O-N 3.28Å
29L88Confident86.6Confident131 Ų13191.6 Ų91.669%0.68647%0.473SS*.Hα-helixtrans-67.7-25.3-179.9-169.168.9000112.6F26 P27 I31F26-L29 VanDerWaalsContact O-CB 3.28Å; F26-L29 WeakPolarHBondContact O-CB 3.26Å; F26-L29 PolarHBondContact O-N 2.98Å; P27-L29 PolarHBondContact O-N 3.03Å; L29-I31 PolarHBondContact O-N 3.26Å
30L87.6Confident86.8Confident70 Ų7096.4 Ų96.437%0.36650%0.498SS..THydrogen-bonded Turntrans-73.4-16.7177.9-64.9175.1000113.3F26 P27 P28 L32 Q46 L85F26-L30 HydrophobicContact CE1-CD1 4.31Å; F26-L30 HydrophobicContact CE1-CD2 4.33Å; F26-L30 HydrophobicContact CE1-CG 4.39Å; P27-L30 WeakPolarHBondContact O-CB 3.49Å; P27-L30 PolarHBondContact O-N 2.98Å; P27-L30 VanDerWaalsContact O-N 3.11Å; P28-L30 PolarHBondContact O-N 3.32Å; L30-L32 WeakPolarHBondContact O-CD1 3.41Å; L30-L32 PolarHBondContact O-N 2.99Å; L30-Q46 PolarHBondContact O-NE2 3.47Å; L30-L85 HydrophobicContact CD1-CD1 3.47Å; L30-L85 VanDerWaalsContact CD1-CD1 3.47Å; L30-L85 HydrophobicContact CD1-CD2 3.91Å; L30-L85 HydrophobicContact CD1-CG 4.18Å
31I87.7Confident87Confident59 Ų59105.7 Ų105.730%0.30353%0.529SS..SBendtrans-89.495.4178.1-55.3164.6000107.3P28 L29 I77P28-I31 PolarHBondContact O-N 3.28Å; L29-I31 PolarHBondContact O-N 3.26Å; I31-I77 HydrophobicContact CD1-CG2 3.45Å; I31-I77 VanDerWaalsContact CD1-CG2 3.45Å; I31-I77 HydrophobicContact CG1-CG2 4.21Å
32L85.3Confident87.2Confident99 Ų99106.5 Ų106.552%0.51853%0.53SS..  trans-79.8136.6179.6-80.779.9000109.9L30 I43L30-L32 WeakPolarHBondContact O-CD1 3.41Å; L30-L32 PolarHBondContact O-N 2.99Å; L32-I43 HydrophobicContact CB-CD1 4.09Å; L32-I43 HydrophobicContact CB-CG1 3.94Å
33T85.9Confident87.4Confident131 Ų131100.9 Ų100.980%0.80450%0.5SS*.  trans-111.2142.5171.460.30000109.5
34S86.3Confident87.6Confident38 Ų38101.2 Ų101.227%0.26651%0.505SS..  trans-132.7148.3174.354.40000110.1N39S34-N39 WeakPolarHBondContact CB-OD1 3.49Å; S34-N39 PolarHBondContact OG-ND2 2.93Å; S34-N39 PolarHBondContact OG-OD1 3.33Å
35K85.7Confident87.7Confident214 Ų214102.7 Ų102.793%0.9352%0.517SS*.SBendtrans-87.7-10.9-179.9-62179.6-178.9177.90112.9
36Y85.9Confident87.9Confident186 Ų18699.3 Ų99.373%0.72950%0.498SS*.SBendtrans-84153.4-176-60.3-72.9000111.7N39Y36-N39 PolarHBondContact O-ND2 3.16Å; Y36-N39 PolarHBondContact O-OD1 2.99Å
37L79.5Confident88Confident178 Ų17898.9 Ų98.993%0.93250%0.497SS*.SBendtrans-72.7-39176.5-17173000111.4
38I86.9Confident88.2Confident155 Ų155106.9 Ų106.980%0.79553%0.527SS*.SBendtrans-101.6116175.4-58.2169.5000107.3
39N89Confident88.5Confident26 Ų26108.2 Ų108.214%0.13953%0.53CS..  trans-112.9168.6-172.1-68.2-31.1000112.4S34 Y36 I43 T44 Q47S34-N39 WeakPolarHBondContact CB-OD1 3.49Å; S34-N39 PolarHBondContact OG-ND2 2.93Å; S34-N39 PolarHBondContact OG-OD1 3.33Å; Y36-N39 PolarHBondContact O-ND2 3.16Å; Y36-N39 PolarHBondContact O-OD1 2.99Å; N39-I43 HydrophobicContact CB-CB 3.99Å; N39-I43 HydrophobicContact CB-CG2 3.91Å; N39-T44 HydrophobicContact CB-CG2 4.06Å; N39-Q47 PolarHBondContact ND2-NE2 3.31Å
40N90Very high88.7Confident111 Ų111104.6 Ų104.659%0.59451%0.511SS*.  trans-62.7152.2172-166.10.8000110.8L42 I43 T44N40-L42 PolarHBondContact O-N 2.96Å; N40-L42 VanDerWaalsContact O-N 3.1Å; N40-I43 HydrophobicContact CB-CD1 4.5Å; N40-I43 PolarHBondContact O-N 3.26Å; N40-T44 PolarHBondContact O-N 3.29Å
41R89.8Confident88.9Confident213 Ų213108.5 Ų108.580%0.80453%0.525SS*.Hα-helixtrans-51.7-36.4-178.8-63.9-178.2-178.4178.90.5113T44 T45R41-T44 WeakPolarHBondContact CA-OG1 3.18Å; R41-T44 PolarHBondContact O-OG1 3.46Å; R41-T45 WeakPolarHBondContact O-CG2 3.36Å; R41-T45 PolarHBondContact O-N 3.11Å; R41-T45 VanDerWaalsContact O-N 3.1Å; R41-T45 PolarHBondContact O-OG1 3.19Å
42L90.3Very high89.1Confident98 Ų98108.9 Ų108.951%0.51353%0.527SS..Hα-helixtrans-68.7-40.6179.5-140166.3000111.6N40 T45 Q46N40-L42 PolarHBondContact O-N 2.96Å; N40-L42 VanDerWaalsContact O-N 3.1Å; L42-T45 PolarHBondContact O-OG1 3.48Å; L42-Q46 HydrophobicContact CD2-CG 4.19Å; L42-Q46 WeakPolarHBondContact O-CB 3.12Å; L42-Q46 VanDerWaalsContact O-CG 3.25Å; L42-Q46 WeakPolarHBondContact O-CG 3.3Å; L42-Q46 PolarHBondContact O-N 2.84Å
43I91.5Very high89.3Confident15 Ų15105.2 Ų105.28%0.07751%0.509CS..Hα-helixtrans-72-37178.6-60174.4000110.1L32 N39 N40 Q46 Q47L32-I43 HydrophobicContact CB-CD1 4.09Å; L32-I43 HydrophobicContact CB-CG1 3.94Å; N39-I43 HydrophobicContact CB-CB 3.99Å; N39-I43 HydrophobicContact CB-CG2 3.91Å; N40-I43 HydrophobicContact CB-CD1 4.5Å; N40-I43 PolarHBondContact O-N 3.26Å; I43-Q46 PolarHBondContact O-N 3.43Å; I43-Q47 HydrophobicContact CG2-CG 4.24Å; I43-Q47 WeakPolarHBondContact O-CB 3.23Å; I43-Q47 VanDerWaalsContact O-CG 3.26Å; I43-Q47 WeakPolarHBondContact O-CG 3.45Å; I43-Q47 PolarHBondContact O-N 3.25Å
44T91.8Very high89.5Confident64 Ų64100.5 Ų100.539%0.39348%0.481SS..Hα-helixtrans-67.1-39.6177.659.50000112.1N39 N40 R41 W48N39-T44 HydrophobicContact CB-CG2 4.06Å; N40-T44 PolarHBondContact O-N 3.29Å; R41-T44 WeakPolarHBondContact CA-OG1 3.18Å; R41-T44 PolarHBondContact O-OG1 3.46Å; T44-W48 VanDerWaalsContact O-CB 3.29Å; T44-W48 WeakPolarHBondContact O-CB 3.44Å; T44-W48 PolarHBondContact O-N 3.48Å
45T91.2Very high89.7Confident83 Ų83105.8 Ų105.851%0.50950%0.5SS..Hα-helixtrans-67-40.6174.256.90000111.9R41 L42 W48 L49R41-T45 WeakPolarHBondContact O-CG2 3.36Å; R41-T45 PolarHBondContact O-N 3.11Å; R41-T45 VanDerWaalsContact O-N 3.1Å; R41-T45 PolarHBondContact O-OG1 3.19Å; L42-T45 PolarHBondContact O-OG1 3.48Å; T45-W48 PolarHBondContact O-N 3.46Å; T45-L49 WeakPolarHBondContact O-CB 3.33Å; T45-L49 PolarHBondContact O-N 2.95Å
46Q91.3Very high89.8Confident41 Ų41101.6 Ų101.619%0.19248%0.483CS..Hα-helixtrans-59.7-50.7173.5-75.2176.5-12.100111.6L30 L42 I43 W48 L49 I50L30-Q46 PolarHBondContact O-NE2 3.47Å; L42-Q46 HydrophobicContact CD2-CG 4.19Å; L42-Q46 WeakPolarHBondContact O-CB 3.12Å; L42-Q46 VanDerWaalsContact O-CG 3.25Å; L42-Q46 WeakPolarHBondContact O-CG 3.3Å; L42-Q46 PolarHBondContact O-N 2.84Å; I43-Q46 PolarHBondContact O-N 3.43Å; Q46-W48 VanDerWaalsContact C-N 3.31Å; Q46-W48 PolarHBondContact O-N 3.45Å; Q46-L49 PolarHBondContact O-N 3.09Å; Q46-I50 VanDerWaalsContact O-CG1 3.24Å; Q46-I50 WeakPolarHBondContact O-CG1 3.46Å; Q46-I50 PolarHBondContact O-N 3.34Å
47Q90.9Very high89.8Confident94 Ų9493.5 Ų93.544%0.43945%0.452SS..Hα-helixtrans-61.3-38.8178.3-73.9174.9-11.200112.3N39 I43 I50 K51N39-Q47 PolarHBondContact ND2-NE2 3.31Å; I43-Q47 HydrophobicContact CG2-CG 4.24Å; I43-Q47 WeakPolarHBondContact O-CB 3.23Å; I43-Q47 VanDerWaalsContact O-CG 3.26Å; I43-Q47 WeakPolarHBondContact O-CG 3.45Å; I43-Q47 PolarHBondContact O-N 3.25Å; Q47-I50 PolarHBondContact O-N 2.98Å; Q47-K51 WeakPolarHBondContact O-CB 3.33Å; Q47-K51 PolarHBondContact O-N 2.83Å
48W92.5Very high90.1Very high171 Ų17186 Ų8665%0.64841%0.413SS*.Hα-helixtrans-63.6-44.6175.7-178.782.1000112T44 T45 Q46 K51 L52T44-W48 VanDerWaalsContact O-CB 3.29Å; T44-W48 WeakPolarHBondContact O-CB 3.44Å; T44-W48 PolarHBondContact O-N 3.48Å; T45-W48 PolarHBondContact O-N 3.46Å; Q46-W48 VanDerWaalsContact C-N 3.31Å; Q46-W48 PolarHBondContact O-N 3.45Å; W48-K51 PolarHBondContact O-N 3.44Å; W48-L52 HydrophobicContact CD2-CD1 3.74Å; W48-L52 HydrophobicContact CD2-CG 4.38Å; W48-L52 HydrophobicContact CE3-CD1 3.78Å; W48-L52 HydrophobicContact CH2-CD1 3.41Å; W48-L52 VanDerWaalsContact CH2-CD1 3.41Å; W48-L52 HydrophobicContact CZ2-CD1 3.38Å; W48-L52 HydrophobicContact CZ2-CG 4.43Å; W48-L52 HydrophobicContact CZ3-CD1 3.61Å; W48-L52 WeakPolarHBondContact O-CG 3.47Å; W48-L52 PolarHBondContact O-N 2.96Å
49L91.4Very high90Very high95 Ų9583.2 Ų83.250%0.49740%0.403SS..Hα-helixtrans-64.2-42.8177.7-162.9153.1000111.7T45 Q46 K51 L52 T53T45-L49 WeakPolarHBondContact O-CB 3.33Å; T45-L49 PolarHBondContact O-N 2.95Å; Q46-L49 PolarHBondContact O-N 3.09Å; L49-K51 VanDerWaalsContact C-N 3.34Å; L49-K51 PolarHBondContact O-N 3.01Å; L49-L52 PolarHBondContact O-N 3.26Å; L49-T53 HydrophobicContact CD2-CG2 3.96Å; L49-T53 WeakPolarHBondContact O-CG2 3.22Å; L49-T53 PolarHBondContact O-N 3.09Å; L49-T53 PolarHBondContact O-OG1 3.11Å
50I92.1Very high89.5Confident56 Ų5688.3 Ų88.329%0.28743%0.428SS..Hα-helixtrans-61.7-41.9175.2-66.1171.1000111.1Q46 Q47 T53 S54 V73 I77Q46-I50 VanDerWaalsContact O-CG1 3.24Å; Q46-I50 WeakPolarHBondContact O-CG1 3.46Å; Q46-I50 PolarHBondContact O-N 3.34Å; Q47-I50 PolarHBondContact O-N 2.98Å; I50-T53 WeakPolarHBondContact CA-OG1 3.4Å; I50-T53 PolarHBondContact O-OG1 3.43Å; I50-T53 VanDerWaalsContact O-OG1 3.06Å; I50-S54 VanDerWaalsContact O-CB 3.31Å; I50-S54 WeakPolarHBondContact O-CB 3.26Å; I50-S54 PolarHBondContact O-N 3.48Å; I50-S54 PolarHBondContact O-OG 2.87Å; I50-V73 HydrophobicContact CG2-CG1 3.89Å; I50-I77 HydrophobicContact CD1-CD1 4.04Å; I50-I77 HydrophobicContact CG1-CD1 3.69Å
51K91.8Very high89.3Confident152 Ų15283.3 Ų83.366%0.66140%0.401SS*.Hα-helixtrans-65.4-39.1177.9-174.9177.4-180178.40112.1Q47 W48 L49 S54 K55Q47-K51 WeakPolarHBondContact O-CB 3.33Å; Q47-K51 PolarHBondContact O-N 2.83Å; W48-K51 PolarHBondContact O-N 3.44Å; L49-K51 VanDerWaalsContact C-N 3.34Å; L49-K51 PolarHBondContact O-N 3.01Å; K51-S54 WeakPolarHBondContact CA-OG 3.26Å; K51-S54 PolarHBondContact O-OG 3.2Å; K51-S54 VanDerWaalsContact O-OG 3.04Å; K51-K55 VanDerWaalsContact O-CB 3.24Å; K51-K55 WeakPolarHBondContact O-CB 3.35Å; K51-K55 PolarHBondContact O-N 2.78Å
52L92.1Very high88.9Confident66 Ų6678.3 Ų78.335%0.34639%0.39SS..Hα-helixtrans-68.9-49.6178.7-74.6177.9000112.1W48 L49 K55 Q56W48-L52 HydrophobicContact CD2-CD1 3.74Å; W48-L52 HydrophobicContact CD2-CG 4.38Å; W48-L52 HydrophobicContact CE3-CD1 3.78Å; W48-L52 HydrophobicContact CH2-CD1 3.41Å; W48-L52 VanDerWaalsContact CH2-CD1 3.41Å; W48-L52 HydrophobicContact CZ2-CD1 3.38Å; W48-L52 HydrophobicContact CZ2-CG 4.43Å; W48-L52 HydrophobicContact CZ3-CD1 3.61Å; W48-L52 WeakPolarHBondContact O-CG 3.47Å; W48-L52 PolarHBondContact O-N 2.96Å; L49-L52 PolarHBondContact O-N 3.26Å; L52-K55 PolarHBondContact O-N 3.1Å; L52-Q56 WeakPolarHBondContact O-CG 3.4Å; L52-Q56 PolarHBondContact O-N 3.14Å
53T89.4Confident88.4Confident23 Ų2379.1 Ų79.114%0.14140%0.399CS..Hα-helixtrans-61.3-47.1179.849.60000111.5L49 I50 K55 Q56 M57L49-T53 HydrophobicContact CD2-CG2 3.96Å; L49-T53 WeakPolarHBondContact O-CG2 3.22Å; L49-T53 PolarHBondContact O-N 3.09Å; L49-T53 PolarHBondContact O-OG1 3.11Å; I50-T53 WeakPolarHBondContact CA-OG1 3.4Å; I50-T53 PolarHBondContact O-OG1 3.43Å; I50-T53 VanDerWaalsContact O-OG1 3.06Å; T53-K55 PolarHBondContact O-N 3.11Å; T53-Q56 PolarHBondContact O-N 3.34Å; T53-M57 WeakPolarHBondContact O-CG 3.41Å; T53-M57 PolarHBondContact O-N 3.47Å
54S90.2Very high87.9Confident31 Ų3184 Ų8422%0.21742%0.42CS..Hα-helixtrans-59.4-46.2174.655.70000112I50 K51 Q56 M57 M58I50-S54 VanDerWaalsContact O-CB 3.31Å; I50-S54 WeakPolarHBondContact O-CB 3.26Å; I50-S54 PolarHBondContact O-N 3.48Å; I50-S54 PolarHBondContact O-OG 2.87Å; K51-S54 WeakPolarHBondContact CA-OG 3.26Å; K51-S54 PolarHBondContact O-OG 3.2Å; K51-S54 VanDerWaalsContact O-OG 3.04Å; S54-Q56 PolarHBondContact O-N 3.41Å; S54-M57 PolarHBondContact O-N 3.11Å; S54-M58 VanDerWaalsContact O-CB 3.23Å; S54-M58 WeakPolarHBondContact O-CB 3.46Å; S54-M58 PolarHBondContact O-N 2.8Å
55K89.8Confident87.3Confident149 Ų14981 Ų8165%0.64840%0.401SS*.Hα-helixtrans-59.9-44.5179-174179.9178.7-175.10111.9K51 L52 T53 T59K51-K55 VanDerWaalsContact O-CB 3.24Å; K51-K55 WeakPolarHBondContact O-CB 3.35Å; K51-K55 PolarHBondContact O-N 2.78Å; L52-K55 PolarHBondContact O-N 3.1Å; T53-K55 PolarHBondContact O-N 3.11Å; K55-T59 WeakPolarHBondContact O-CG2 3Å; K55-T59 PolarHBondContact O-N 3.26Å
56Q87.7Confident87Confident127 Ų12783.3 Ų83.359%0.59340%0.401SS*.Hα-helixtrans-69.3-39.2-178.9-74.4-179.2-21.600113.2L52 T53 S54 T59L52-Q56 WeakPolarHBondContact O-CG 3.4Å; L52-Q56 PolarHBondContact O-N 3.14Å; T53-Q56 PolarHBondContact O-N 3.34Å; S54-Q56 PolarHBondContact O-N 3.41Å; Q56-T59 PolarHBondContact O-OG1 3.19Å
57M85.7Confident86.8Confident15 Ų1586.2 Ų86.27%0.07442%0.421CS..Hα-helixtrans-72.2-34.3177.6-70.7-171.1171.600112.2T53 S54 T59 H61 L72 I76 Y212 T215T53-M57 WeakPolarHBondContact O-CG 3.41Å; T53-M57 PolarHBondContact O-N 3.47Å; S54-M57 PolarHBondContact O-N 3.11Å; M57-T59 PolarHBondContact O-N 3.42Å; M57-H61 PolarHBondContact O-ND1 2.92Å; M57-L72 HydrophobicContact SD-CB 4.39Å; M57-I76 HydrophobicContact CE-CB 4.47Å; M57-I76 HydrophobicContact CE-CD1 3.64Å; M57-Y212 HydrophobicContact CE-CD2 4.45Å; M57-T215 WeakPolarHBondContact CE-OG1 3.41Å
58M86.6Confident86.6Confident22 Ų2283.9 Ų83.911%0.10841%0.408CS..Hα-helixtrans-80.5-15.3-173-140.558.756.900114.9S54 M60 H61 R66 S69S54-M58 VanDerWaalsContact O-CB 3.23Å; S54-M58 WeakPolarHBondContact O-CB 3.46Å; S54-M58 PolarHBondContact O-N 2.8Å; M58-M60 PolarHBondContact O-N 2.9Å; M58-H61 PolarHBondContact O-N 2.78Å; M58-H61 HydrophobicContact SD-CB 4.33Å; M58-R66 HydrophobicContact CG-CB 4.15Å; M58-R66 HydrophobicContact CG-CG 3.58Å; M58-R66 VanDerWaalsContact SD-CA 3.57Å; M58-R66 HydrophobicContact SD-CB 3.84Å; M58-R66 HydrophobicContact SD-CG 3.7Å; M58-S69 WeakPolarHBondContact CE-OG 3.37Å
59T85.4Confident86.4Confident95 Ų9577.3 Ų77.358%0.58339%0.389SS*.THydrogen-bonded Turntrans-62.3-31.3176.949.50000111.9K55 Q56 M57 H61K55-T59 WeakPolarHBondContact O-CG2 3Å; K55-T59 PolarHBondContact O-N 3.26Å; Q56-T59 PolarHBondContact O-OG1 3.19Å; M57-T59 PolarHBondContact O-N 3.42Å; T59-H61 VanDerWaalsContact C-N 3.34Å
60M79.1Confident86.4Confident134 Ų13479.9 Ų79.966%0.6640%0.402SS*.THydrogen-bonded Turntrans-81.5-10.5-178.5-54.6-109.883.700113M58 H223M58-M60 PolarHBondContact O-N 2.9Å; M60-H223 PolarHBondContact O-CE1 3.28Å; M60-H223 PolarHBondContact O-ND1 3.02Å
61H83.8Confident86.4Confident5 Ų580.6 Ų80.62%0.02341%0.405CS..  trans-111.2138.1-167.7-69.781.2000114.1M57 M58 T59 R66 S219M57-H61 PolarHBondContact O-ND1 2.92Å; M58-H61 PolarHBondContact O-N 2.78Å; M58-H61 HydrophobicContact SD-CB 4.33Å; T59-H61 VanDerWaalsContact C-N 3.34Å; H61-R66 HydrophobicContact CB-CG 4.42Å; H61-R66 PolarHBondContact O-NE 3.43Å; H61-S219 PolarHBondContact NE2-O 3.27Å
62N81.7Confident86.4Confident109 Ų10973.5 Ų73.558%0.58338%0.375SS*.  trans-70.9166.5168.2-79.6-19.9000112.2K64 G65 R66N62-K64 VanDerWaalsContact C-N 3.27Å; N62-K64 PolarHBondContact O-N 3.39Å; N62-K64 VanDerWaalsContact O-N 3.11Å; N62-G65 WeakPolarHBondContact O-CA 3.18Å; N62-G65 PolarHBondContact O-N 3.39Å; N62-R66 WeakPolarHBondContact O-CG 3.4Å; N62-R66 PolarHBondContact O-N 3.11Å
63T81.3Confident86.4Confident114 Ų11471 Ų7170%0.69936%0.362SS*.THydrogen-bonded Turntrans-51.1-38.9-174.453.70000114.4R66T63-R66 PolarHBondContact O-N 3.45Å
64K80.3Confident86.5Confident118 Ų11873.2 Ų73.251%0.51338%0.378SS..THydrogen-bonded Turntrans-66.2-45.7174.6-69.7-177.4-177.7175.70112.2N62 R66 T67N62-K64 VanDerWaalsContact C-N 3.27Å; N62-K64 PolarHBondContact O-N 3.39Å; N62-K64 VanDerWaalsContact O-N 3.11Å; K64-R66 PolarHBondContact O-N 3.46Å; K64-T67 WeakPolarHBondContact O-CB 3.32Å; K64-T67 PolarHBondContact O-N 2.93Å; K64-T67 PolarHBondContact O-OG1 3.35Å
65G79.3Confident86.5Confident0 Ų072.5 Ų72.50%037%0.372CS..G310 helixtrans-62.5-30.8176.200000112.7N62 T67 W68N62-G65 WeakPolarHBondContact O-CA 3.18Å; N62-G65 PolarHBondContact O-N 3.39Å; G65-T67 PolarHBondContact O-N 3.2Å; G65-T67 VanDerWaalsContact O-N 3.16Å; G65-W68 PolarHBondContact O-N 3.06Å; G65-W68 VanDerWaalsContact O-N 3.08Å
66R84.6Confident86.6Confident133 Ų13366.2 Ų66.250%0.50235%0.345SS..G310 helixtrans-63.4-21.1176.6-56.2-162177.3168.9-3.5114.3M58 H61 N62 T63 K64 W68 S69M58-R66 HydrophobicContact CG-CB 4.15Å; M58-R66 HydrophobicContact CG-CG 3.58Å; M58-R66 VanDerWaalsContact SD-CA 3.57Å; M58-R66 HydrophobicContact SD-CB 3.84Å; M58-R66 HydrophobicContact SD-CG 3.7Å; H61-R66 HydrophobicContact CB-CG 4.42Å; H61-R66 PolarHBondContact O-NE 3.43Å; N62-R66 WeakPolarHBondContact O-CG 3.4Å; N62-R66 PolarHBondContact O-N 3.11Å; T63-R66 PolarHBondContact O-N 3.45Å; K64-R66 PolarHBondContact O-N 3.46Å; R66-W68 PolarHBondContact O-N 3.34Å; R66-S69 WeakPolarHBondContact O-CB 3.31Å; R66-S69 PolarHBondContact O-N 3.27Å; R66-S69 VanDerWaalsContact O-N 3.08Å
67T86.9Confident86.8Confident102 Ų10261.6 Ų61.663%0.62632%0.324SS*.G310 helixtrans-63.4-25.617563.10000112.5K64 G65 S69K64-T67 WeakPolarHBondContact O-CB 3.32Å; K64-T67 PolarHBondContact O-N 2.93Å; K64-T67 PolarHBondContact O-OG1 3.35Å; G65-T67 PolarHBondContact O-N 3.2Å; G65-T67 VanDerWaalsContact O-N 3.16Å; T67-S69 PolarHBondContact O-N 2.89Å
68W87.8Confident87.1Confident44 Ų4463.1 Ų63.117%0.16733%0.331CS..G310 helixtrans-83.93.2177.2-75.155.2000113.5G65 R66 L70 M71 L72 M115 L222G65-W68 PolarHBondContact O-N 3.06Å; G65-W68 VanDerWaalsContact O-N 3.08Å; R66-W68 PolarHBondContact O-N 3.34Å; W68-L70 VanDerWaalsContact C-N 3.29Å; W68-L70 PolarHBondContact O-N 2.63Å; W68-M71 HydrophobicContact CD2-CE 3.7Å; W68-M71 HydrophobicContact CE3-CE 2.98Å; W68-M71 HydrophobicContact CH2-CE 3.61Å; W68-M71 HydrophobicContact CZ2-CE 4.25Å; W68-M71 HydrophobicContact CZ3-CE 2.95Å; W68-M71 PolarHBondContact O-N 2.94Å; W68-M71 VanDerWaalsContact O-N 3.1Å; W68-L72 PolarHBondContact O-N 3.48Å; W68-M115 HydrophobicContact CZ2-SD 3.93Å; W68-M115 PolarHBondContact NE1-SD 3.2Å; W68-L222 HydrophobicContact CB-CD1 4.47Å; W68-L222 HydrophobicContact CB-CD2 3.6Å; W68-L222 HydrophobicContact CD2-CD1 3.47Å; W68-L222 VanDerWaalsContact CD2-CD1 3.47Å; W68-L222 HydrophobicContact CD2-CD2 4.26Å; W68-L222 HydrophobicContact CE3-CD1 3.61Å; W68-L222 HydrophobicContact CG-CD1 3.81Å; W68-L222 HydrophobicContact CG-CD2 3.8Å; W68-L222 HydrophobicContact CG-CG 4.48Å; W68-L222 HydrophobicContact CH2-CD1 4.47Å; W68-L222 HydrophobicContact CZ2-CD1 4.33Å; W68-L222 HydrophobicContact CZ3-CD1 4.1Å
69S88.5Confident87.4Confident34 Ų3462.1 Ų62.124%0.23833%0.326CS..Hα-helixtrans-52.5-46.8-178.8178.30000113.3M58 R66 T67 M71 L72 V73M58-S69 WeakPolarHBondContact CE-OG 3.37Å; R66-S69 WeakPolarHBondContact O-CB 3.31Å; R66-S69 PolarHBondContact O-N 3.27Å; R66-S69 VanDerWaalsContact O-N 3.08Å; T67-S69 PolarHBondContact O-N 2.89Å; S69-M71 VanDerWaalsContact C-N 3.26Å; S69-M71 PolarHBondContact O-N 3.12Å; S69-L72 PolarHBondContact O-N 3.36Å; S69-V73 WeakPolarHBondContact O-CB 3.39Å; S69-V73 WeakPolarHBondContact O-CG2 3.41Å; S69-V73 PolarHBondContact O-N 3.08Å
70L91.4Very high87.6Confident149 Ų14959 Ų5978%0.7831%0.31SS*.Hα-helixtrans-60.3-44-176.8-172.182.6000109.9W68 S74W68-L70 VanDerWaalsContact C-N 3.29Å; W68-L70 PolarHBondContact O-N 2.63Å; L70-S74 WeakPolarHBondContact O-CB 3.35Å; L70-S74 PolarHBondContact O-N 3.4Å; L70-S74 PolarHBondContact O-OG 3.14Å
71M91.5Very high88.2Confident70 Ų7054 Ų5435%0.34529%0.287SS..Hα-helixtrans-66.2-49.6-178.3-171.7153.666.100111.7W68 S69 V73 S74 L75 L108W68-M71 HydrophobicContact CD2-CE 3.7Å; W68-M71 HydrophobicContact CE3-CE 2.98Å; W68-M71 HydrophobicContact CH2-CE 3.61Å; W68-M71 HydrophobicContact CZ2-CE 4.25Å; W68-M71 HydrophobicContact CZ3-CE 2.95Å; W68-M71 PolarHBondContact O-N 2.94Å; W68-M71 VanDerWaalsContact O-N 3.1Å; S69-M71 VanDerWaalsContact C-N 3.26Å; S69-M71 PolarHBondContact O-N 3.12Å; M71-V73 VanDerWaalsContact C-N 3.32Å; M71-V73 PolarHBondContact O-N 3.32Å; M71-S74 WeakPolarHBondContact CA-OG 3.39Å; M71-S74 PolarHBondContact O-N 3.47Å; M71-S74 PolarHBondContact O-OG 3.22Å; M71-L75 VanDerWaalsContact O-CB 3.26Å; M71-L75 WeakPolarHBondContact O-CB 3.2Å; M71-L75 PolarHBondContact O-N 3.49Å; M71-L108 HydrophobicContact CE-CD2 3.76Å; M71-L108 HydrophobicContact CG-CD2 3.93Å; M71-L108 HydrophobicContact SD-CD2 3.61Å
72L91.1Very high88.6Confident4 Ų454 Ų542%0.02129%0.287CS..Hα-helixtrans-60-41.6179.1-68.3173.9000112.4M57 W68 S69 L75 I76 V218M57-L72 HydrophobicContact SD-CB 4.39Å; W68-L72 PolarHBondContact O-N 3.48Å; S69-L72 PolarHBondContact O-N 3.36Å; L72-L75 PolarHBondContact O-N 3.16Å; L72-I76 PolarHBondContact O-N 2.92Å; L72-I76 VanDerWaalsContact O-N 3.09Å; L72-V218 HydrophobicContact CD2-CB 4.29Å; L72-V218 HydrophobicContact CD2-CG1 3.87Å
73V92Very high89Confident14 Ų1448.9 Ų48.99%0.08526%0.26CS..Hα-helixtrans-69.3-41.9178.4173.70000111.1I50 S69 M71 L75 I76 I77I50-V73 HydrophobicContact CG2-CG1 3.89Å; S69-V73 WeakPolarHBondContact O-CB 3.39Å; S69-V73 WeakPolarHBondContact O-CG2 3.41Å; S69-V73 PolarHBondContact O-N 3.08Å; M71-V73 VanDerWaalsContact C-N 3.32Å; M71-V73 PolarHBondContact O-N 3.32Å; V73-L75 VanDerWaalsContact C-N 3.29Å; V73-L75 PolarHBondContact O-N 3.18Å; V73-I76 VanDerWaalsContact O-CG2 3.27Å; V73-I76 WeakPolarHBondContact O-CG2 3.44Å; V73-I77 HydrophobicContact CG1-CD1 3.76Å; V73-I77 VanDerWaalsContact O-CD1 3.28Å; V73-I77 WeakPolarHBondContact O-CD1 3.22Å; V73-I77 WeakPolarHBondContact O-CG1 3.3Å; V73-I77 PolarHBondContact O-N 3.33Å
74S91.8Very high89.5Confident68 Ų6848 Ų4848%0.47625%0.25SC..Hα-helixtrans-62.9-38.3175.769.60000112.1L70 M71 F78L70-S74 WeakPolarHBondContact O-CB 3.35Å; L70-S74 PolarHBondContact O-N 3.4Å; L70-S74 PolarHBondContact O-OG 3.14Å; M71-S74 WeakPolarHBondContact CA-OG 3.39Å; M71-S74 PolarHBondContact O-N 3.47Å; M71-S74 PolarHBondContact O-OG 3.22Å; S74-F78 VanDerWaalsContact O-CB 3.26Å; S74-F78 WeakPolarHBondContact O-CB 3.24Å; S74-F78 PolarHBondContact O-N 3.41Å
75L91.4Very high89.9Confident16 Ų1643.9 Ų43.98%0.08423%0.234CC..Hα-helixtrans-65.4-48.7-179.8-175.677000112M71 L72 V73 I77 F78 I79 L108 F214 T215M71-L75 VanDerWaalsContact O-CB 3.26Å; M71-L75 WeakPolarHBondContact O-CB 3.2Å; M71-L75 PolarHBondContact O-N 3.49Å; L72-L75 PolarHBondContact O-N 3.16Å; V73-L75 VanDerWaalsContact C-N 3.29Å; V73-L75 PolarHBondContact O-N 3.18Å; L75-I77 VanDerWaalsContact C-N 3.31Å; L75-I77 PolarHBondContact O-N 3.11Å; L75-F78 PolarHBondContact O-N 2.96Å; L75-I79 HydrophobicContact CD1-CD1 4.02Å; L75-I79 HydrophobicContact CG-CD1 3.92Å; L75-I79 WeakPolarHBondContact O-CG1 3.45Å; L75-I79 PolarHBondContact O-N 3.34Å; L75-L108 HydrophobicContact CD1-CD1 3.44Å; L75-L108 VanDerWaalsContact CD1-CD1 3.44Å; L75-L108 HydrophobicContact CD2-CD1 3.76Å; L75-L108 HydrophobicContact CG-CD1 4.24Å; L75-F214 HydrophobicContact CD1-CE1 4.03Å; L75-F214 HydrophobicContact CD2-CD1 3.87Å; L75-F214 HydrophobicContact CD2-CE1 3.78Å; L75-F214 HydrophobicContact CG-CD1 4.27Å; L75-F214 HydrophobicContact CG-CE1 4.15Å; L75-T215 HydrophobicContact CB-CG2 4.07Å; L75-T215 HydrophobicContact CD2-CG2 3.51Å; L75-T215 HydrophobicContact CG-CG2 3.73Å
76I91.9Very high90.3Very high18 Ų1844 Ų449%0.09223%0.234CC..Hα-helixtrans-63.6-41.1-179.7-170.5169000110.9M57 L72 V73 A80 A211 Y212 T215M57-I76 HydrophobicContact CE-CB 4.47Å; M57-I76 HydrophobicContact CE-CD1 3.64Å; L72-I76 PolarHBondContact O-N 2.92Å; L72-I76 VanDerWaalsContact O-N 3.09Å; V73-I76 VanDerWaalsContact O-CG2 3.27Å; V73-I76 WeakPolarHBondContact O-CG2 3.44Å; I76-A80 WeakPolarHBondContact O-CB 3.31Å; I76-A80 PolarHBondContact O-N 3.21Å; I76-A211 HydrophobicContact CG1-CB 4.49Å; I76-Y212 HydrophobicContact CD1-CD2 4.24Å; I76-T215 VanDerWaalsContact CA-CG2 3.47Å; I76-T215 HydrophobicContact CB-CG2 3.49Å; I76-T215 VanDerWaalsContact CB-CG2 3.49Å; I76-T215 HydrophobicContact CG1-CG2 4.17Å
77I91.9Very high90.4Very high30 Ų3039.4 Ų39.415%0.15422%0.22CC..Hα-helixtrans-67.3-42.2178.9-61163.4000110.2I31 I50 V73 L75 T81I31-I77 HydrophobicContact CD1-CG2 3.45Å; I31-I77 VanDerWaalsContact CD1-CG2 3.45Å; I31-I77 HydrophobicContact CG1-CG2 4.21Å; I50-I77 HydrophobicContact CD1-CD1 4.04Å; I50-I77 HydrophobicContact CG1-CD1 3.69Å; V73-I77 HydrophobicContact CG1-CD1 3.76Å; V73-I77 VanDerWaalsContact O-CD1 3.28Å; V73-I77 WeakPolarHBondContact O-CD1 3.22Å; V73-I77 WeakPolarHBondContact O-CG1 3.3Å; V73-I77 PolarHBondContact O-N 3.33Å; L75-I77 VanDerWaalsContact C-N 3.31Å; L75-I77 PolarHBondContact O-N 3.11Å; I77-T81 HydrophobicContact CG2-CG2 4.2Å; I77-T81 WeakPolarHBondContact O-CB 3.4Å; I77-T81 VanDerWaalsContact O-CG2 3.25Å; I77-T81 WeakPolarHBondContact O-CG2 3.45Å; I77-T81 PolarHBondContact O-N 3.49Å; I77-T81 PolarHBondContact O-OG1 3.43Å
78F91.4Very high90.4Very high47 Ų4739.4 Ų39.421%0.20622%0.215CC..Hα-helixtrans-62.5-48.8178.6-179.8-103.5000112.3I24 S74 L75 T81 T82 M100 M104I24-F78 HydrophobicContact CG2-CZ 4.32Å; S74-F78 VanDerWaalsContact O-CB 3.26Å; S74-F78 WeakPolarHBondContact O-CB 3.24Å; S74-F78 PolarHBondContact O-N 3.41Å; L75-F78 PolarHBondContact O-N 2.96Å; F78-T81 PolarHBondContact O-OG1 3.34Å; F78-T81 VanDerWaalsContact O-OG1 3.09Å; F78-T82 HydrophobicContact CD2-CG2 4.29Å; F78-T82 HydrophobicContact CE1-CG2 4.21Å; F78-T82 HydrophobicContact CE2-CG2 3.91Å; F78-T82 HydrophobicContact CZ-CG2 3.87Å; F78-T82 WeakPolarHBondContact O-CB 3.3Å; F78-T82 VanDerWaalsContact O-CG2 3.31Å; F78-T82 WeakPolarHBondContact O-CG2 3.32Å; F78-T82 PolarHBondContact O-N 3.32Å; F78-T82 PolarHBondContact O-OG1 3.06Å; F78-M100 HydrophobicContact CE1-CE 3.84Å; F78-M100 HydrophobicContact CZ-CE 3.87Å; F78-M104 HydrophobicContact CD1-SD 3.89Å; F78-M104 HydrophobicContact CE1-CE 4.11Å; F78-M104 HydrophobicContact CE1-SD 3.62Å
79I91.6Very high90.2Very high0 Ų042.5 Ų42.50%024%0.241CC..Hα-helixtrans-68.4-42.2-179.6-60168.7000110.6L75 T81 T82 N83 M104 L160 A211 F214L75-I79 HydrophobicContact CD1-CD1 4.02Å; L75-I79 HydrophobicContact CG-CD1 3.92Å; L75-I79 WeakPolarHBondContact O-CG1 3.45Å; L75-I79 PolarHBondContact O-N 3.34Å; I79-T81 PolarHBondContact O-N 3.01Å; I79-T82 WeakPolarHBondContact CA-OG1 3.06Å; I79-T82 PolarHBondContact O-OG1 3.19Å; I79-N83 WeakPolarHBondContact CG2-ND2 3.36Å; I79-N83 WeakPolarHBondContact O-CB 3.34Å; I79-N83 PolarHBondContact O-N 3.31Å; I79-N83 PolarHBondContact O-ND2 2.93Å; I79-M104 HydrophobicContact CG1-SD 4.49Å; I79-L160 HydrophobicContact CG2-CD1 4.03Å; I79-L160 HydrophobicContact CG2-CD2 4.14Å; I79-A211 HydrophobicContact CB-CB 4.02Å; I79-A211 HydrophobicContact CG2-CB 3.75Å; I79-F214 HydrophobicContact CD1-CB 4.26Å; I79-F214 HydrophobicContact CD1-CD1 3.32Å; I79-F214 HydrophobicContact CD1-CD2 4.33Å; I79-F214 HydrophobicContact CD1-CE1 3.66Å; I79-F214 HydrophobicContact CD1-CG 3.72Å; I79-F214 HydrophobicContact CD1-CZ 4.3Å
80A90.9Very high89.9Confident30 Ų3052.5 Ų52.525%0.24828%0.275CS..Hα-helixtrans-63.4-43.817900000112I76 L84 A211I76-A80 WeakPolarHBondContact O-CB 3.31Å; I76-A80 PolarHBondContact O-N 3.21Å; A80-L84 VanDerWaalsContact O-CB 3.27Å; A80-L84 WeakPolarHBondContact O-CB 3.36Å; A80-L84 PolarHBondContact O-N 2.91Å; A80-A211 HydrophobicContact CB-CB 3.92Å
81T91.4Very high89.6Confident30 Ų3047.2 Ų47.218%0.18425%0.251CS..Hα-helixtrans-68.8-47.517952.10000111.7P27 I77 F78 I79 N83 L84 L85P27-T81 WeakPolarHBondContact CB-OG1 3.42Å; I77-T81 HydrophobicContact CG2-CG2 4.2Å; I77-T81 WeakPolarHBondContact O-CB 3.4Å; I77-T81 VanDerWaalsContact O-CG2 3.25Å; I77-T81 WeakPolarHBondContact O-CG2 3.45Å; I77-T81 PolarHBondContact O-N 3.49Å; I77-T81 PolarHBondContact O-OG1 3.43Å; F78-T81 PolarHBondContact O-OG1 3.34Å; F78-T81 VanDerWaalsContact O-OG1 3.09Å; I79-T81 PolarHBondContact O-N 3.01Å; T81-N83 VanDerWaalsContact C-N 3.33Å; T81-N83 PolarHBondContact O-N 3.42Å; T81-L84 PolarHBondContact O-N 3.07Å; T81-L85 WeakPolarHBondContact O-CB 3.49Å; T81-L85 WeakPolarHBondContact O-CD1 3.27Å; T81-L85 PolarHBondContact O-N 3.19Å
82T91.3Very high89.3Confident4 Ų445.1 Ų45.13%0.02524%0.24CC..Hα-helixtrans-58.5-42.3177.448.30000112.8P27 F78 I79 G86P27-T82 HydrophobicContact CB-CG2 4.13Å; P27-T82 HydrophobicContact CG-CG2 3.38Å; F78-T82 HydrophobicContact CD2-CG2 4.29Å; F78-T82 HydrophobicContact CE1-CG2 4.21Å; F78-T82 HydrophobicContact CE2-CG2 3.91Å; F78-T82 HydrophobicContact CZ-CG2 3.87Å; F78-T82 WeakPolarHBondContact O-CB 3.3Å; F78-T82 VanDerWaalsContact O-CG2 3.31Å; F78-T82 WeakPolarHBondContact O-CG2 3.32Å; F78-T82 PolarHBondContact O-N 3.32Å; F78-T82 PolarHBondContact O-OG1 3.06Å; I79-T82 WeakPolarHBondContact CA-OG1 3.06Å; I79-T82 PolarHBondContact O-OG1 3.19Å; T82-G86 PolarHBondContact O-N 2.89Å; T82-G86 VanDerWaalsContact O-N 3.07Å
83N91.4Very high89Confident2 Ų245.1 Ų45.11%0.01124%0.24CC..Hα-helixtrans-68.2-42.1177.7-66.6-12.3000112.1I79 T81 G86 L87 T95 I164 A207I79-N83 WeakPolarHBondContact CG2-ND2 3.36Å; I79-N83 WeakPolarHBondContact O-CB 3.34Å; I79-N83 PolarHBondContact O-N 3.31Å; I79-N83 PolarHBondContact O-ND2 2.93Å; T81-N83 VanDerWaalsContact C-N 3.33Å; T81-N83 PolarHBondContact O-N 3.42Å; N83-G86 WeakPolarHBondContact O-CA 3.37Å; N83-G86 PolarHBondContact O-N 2.8Å; N83-G86 VanDerWaalsContact O-N 3.09Å; N83-L87 PolarHBondContact O-N 2.88Å; N83-T95 WeakPolarHBondContact OD1-CB 3.28Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.43Å; N83-T95 PolarHBondContact OD1-OG1 3.32Å; N83-I164 HydrophobicContact CB-CD1 4.33Å; N83-I164 VanDerWaalsContact CG-CD1 3.44Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.01Å; N83-A207 HydrophobicContact CB-CB 3.91Å; N83-A207 PolarHBondContact ND2-O 2.99Å
84L90.1Very high88.6Confident94 Ų9444.9 Ų44.949%0.49224%0.239SC..Hα-helixtrans-68.6-40.8-178.4-166.3117.6000112.2A80 T81 G86 L87A80-L84 VanDerWaalsContact O-CB 3.27Å; A80-L84 WeakPolarHBondContact O-CB 3.36Å; A80-L84 PolarHBondContact O-N 2.91Å; T81-L84 PolarHBondContact O-N 3.07Å; L84-G86 PolarHBondContact O-N 2.96Å; L84-L87 PolarHBondContact O-N 3.15Å
85L90.1Very high88.3Confident33 Ų3341.7 Ų41.717%0.17322%0.216CC..Hα-helixtrans-62.7-29.2170.8-88.184.7000112F26 L30 T81 L87 L88 S91F26-L85 HydrophobicContact CD1-CD2 3.28Å; F26-L85 HydrophobicContact CE1-CD2 3.49Å; F26-L85 VanDerWaalsContact CE1-CD2 3.49Å; L30-L85 HydrophobicContact CD1-CD1 3.47Å; L30-L85 VanDerWaalsContact CD1-CD1 3.47Å; L30-L85 HydrophobicContact CD1-CD2 3.91Å; L30-L85 HydrophobicContact CD1-CG 4.18Å; T81-L85 WeakPolarHBondContact O-CB 3.49Å; T81-L85 WeakPolarHBondContact O-CD1 3.27Å; T81-L85 PolarHBondContact O-N 3.19Å; L85-L87 VanDerWaalsContact C-N 3.27Å; L85-L87 PolarHBondContact O-N 2.84Å; L85-L88 WeakPolarHBondContact O-CB 3.37Å; L85-L88 WeakPolarHBondContact O-CG 3.21Å; L85-L88 PolarHBondContact O-N 3.38Å; L85-S91 PolarHBondContact O-OG 2.96Å
86G86.3Confident88Confident1 Ų141.4 Ų41.41%0.0122%0.215CC..Hα-helixtrans-59.8-33.3175.900000115.9T82 N83 L84 L88 S91 H168T82-G86 PolarHBondContact O-N 2.89Å; T82-G86 VanDerWaalsContact O-N 3.07Å; N83-G86 WeakPolarHBondContact O-CA 3.37Å; N83-G86 PolarHBondContact O-N 2.8Å; N83-G86 VanDerWaalsContact O-N 3.09Å; L84-G86 PolarHBondContact O-N 2.96Å; G86-L88 PolarHBondContact O-N 3.34Å; G86-S91 PolarHBondContact O-OG 3.33Å; G86-H168 PolarHBondContact O-CE1 3.09Å; G86-H168 PolarHBondContact O-NE2 3.07Å
87L87.2Confident87.9Confident38 Ų3843.9 Ų43.920%0.19923%0.226CC..THydrogen-bonded Turntrans-78.2-5.2-178.8-60.4174.9000113.1N83 L84 L85 M171 E203 I204 A207N83-L87 PolarHBondContact O-N 2.88Å; L84-L87 PolarHBondContact O-N 3.15Å; L85-L87 VanDerWaalsContact C-N 3.27Å; L85-L87 PolarHBondContact O-N 2.84Å; L87-M171 HydrophobicContact CD2-CE 4Å; L87-E203 HydrophobicContact CD1-CG 4.43Å; L87-E203 HydrophobicContact CD2-CB 4.18Å; L87-E203 HydrophobicContact CD2-CG 3.39Å; L87-I204 HydrophobicContact CD1-CB 4.2Å; L87-I204 HydrophobicContact CD1-CG1 3.62Å; L87-A207 HydrophobicContact CD1-CB 4.05Å
88L88.1Confident87.7Confident101 Ų10145.7 Ų45.753%0.52924%0.236SC..SBendtrans-66.7145.6174.7-65.3174.2000110.7L85 G86 Y90 S91L85-L88 WeakPolarHBondContact O-CB 3.37Å; L85-L88 WeakPolarHBondContact O-CG 3.21Å; L85-L88 PolarHBondContact O-N 3.38Å; G86-L88 PolarHBondContact O-N 3.34Å; L88-Y90 PolarHBondContact O-N 3.16Å; L88-S91 PolarHBondContact O-N 3.34Å; L88-S91 PolarHBondContact O-OG 3.01Å; L88-S91 VanDerWaalsContact O-OG 3.06Å
89P83Confident87.6Confident110 Ų11047.5 Ų47.571%0.71425%0.254SS*.THydrogen-bonded Turntrans-60.7133.9179.425.6-34000110.5S91P89-S91 PolarHBondContact O-N 2.95Å
90Y83.1Confident87.4Confident244 Ų24449.5 Ų49.596%0.95726%0.264SS*.THydrogen-bonded Turntrans60.115.7-179.8-53.7-74.9000115.8L88L88-Y90 PolarHBondContact O-N 3.16Å
91S84.9Confident87.4Confident38 Ų3848 Ų4827%0.26625%0.252SS..  trans-82.2144.1171.973.80000111.1L85 G86 L88 P89L85-S91 PolarHBondContact O-OG 2.96Å; G86-S91 PolarHBondContact O-OG 3.33Å; L88-S91 PolarHBondContact O-N 3.34Å; L88-S91 PolarHBondContact O-OG 3.01Å; L88-S91 VanDerWaalsContact O-OG 3.06Å; P89-S91 PolarHBondContact O-N 2.95Å
92F83.6Confident87.2Confident26 Ų2648.8 Ų48.811%0.11426%0.255CS..  trans-89.1124.1171.2171.9-95.1000109.2S8 P12 A20 I23 P94 Q97S8-F92 WeakPolarHBondContact O-CD2 3.38Å; P12-F92 HydrophobicContact CG-CB 4.41Å; P12-F92 HydrophobicContact CG-CD1 4.15Å; P12-F92 HydrophobicContact CG-CG 4.1Å; A20-F92 HydrophobicContact CB-CE1 4.39Å; I23-F92 HydrophobicContact CD1-CB 3.98Å; I23-F92 HydrophobicContact CD1-CD1 3.93Å; I23-F92 HydrophobicContact CD1-CG 4.34Å; I23-F92 HydrophobicContact CG2-CD1 4.48Å; I23-F92 WeakPolarHBondContact CG2-O 3.45Å; F92-P94 HydrophobicContact CE1-CB 4.41Å; F92-P94 WeakPolarHBondContact O-CD 3.41Å; F92-Q97 HydrophobicContact CZ-CG 4.15Å
93T84.8Confident87.1Confident3 Ų351.7 Ų51.72%0.01828%0.279CS..  trans-91.7109.9177.628.30000111.1T95 T96 I164T93-T95 PolarHBondContact O-N 2.94Å; T93-T96 PolarHBondContact O-N 3.48Å; T93-T96 PolarHBondContact O-OG1 3.43Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.36Å; T93-I164 HydrophobicContact CG2-CG2 4.23Å
94P83.8Confident86.9Confident9 Ų952.8 Ų52.86%0.05829%0.285CS..G310 helixtrans-63.8-23.6176.626-33.5000112.8I24 F92 T96 Q97 M100I24-P94 HydrophobicContact CD1-CB 4.3Å; I24-P94 HydrophobicContact CG1-CB 3.73Å; I24-P94 HydrophobicContact CG1-CG 4.09Å; F92-P94 HydrophobicContact CE1-CB 4.41Å; F92-P94 WeakPolarHBondContact O-CD 3.41Å; P94-T96 VanDerWaalsContact C-N 3.26Å; P94-T96 PolarHBondContact O-N 3.33Å; P94-Q97 PolarHBondContact O-N 3.07Å; P94-M100 WeakPolarHBondContact O-CB 3.26Å
95T86Confident86.7Confident1 Ų148.5 Ų48.51%0.00626%0.263CS..G310 helixtrans-75.7-7.1179.151.30000114.3N83 T93 Q97 N101 I164N83-T95 WeakPolarHBondContact OD1-CB 3.28Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.43Å; N83-T95 PolarHBondContact OD1-OG1 3.32Å; T93-T95 PolarHBondContact O-N 2.94Å; T95-Q97 VanDerWaalsContact C-N 3.32Å; T95-N101 PolarHBondContact O-ND2 3.24Å; T95-I164 VanDerWaalsContact OG1-CD1 3.31Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.47Å
96T86.3Confident86.7Confident10 Ų1050.8 Ų50.86%0.06127%0.274CS..G310 helixtrans-74.5-26.3169.3570000112.4F9 T93 P94 L98 T161 I164 T165F9-T96 HydrophobicContact CD1-CG2 3.82Å; F9-T96 HydrophobicContact CE1-CG2 3.7Å; T93-T96 PolarHBondContact O-N 3.48Å; T93-T96 PolarHBondContact O-OG1 3.43Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.36Å; P94-T96 VanDerWaalsContact C-N 3.26Å; P94-T96 PolarHBondContact O-N 3.33Å; T96-L98 PolarHBondContact O-N 3.15Å; T96-T161 WeakPolarHBondContact O-CG2 3.28Å; T96-I164 HydrophobicContact CG2-CB 4.38Å; T96-I164 HydrophobicContact CG2-CG2 3.68Å; T96-T165 HydrophobicContact CG2-CG2 3.74Å
97Q89.5Confident86.9Confident70 Ų7054.5 Ų54.533%0.32730%0.298SS..SBendtrans-78.5120.1178.5-64.6-62.2-32.700109.9F9 F92 P94 T95 S99 M100 N101F9-Q97 PolarHBondContact O-NE2 3.01Å; F92-Q97 HydrophobicContact CZ-CG 4.15Å; P94-Q97 PolarHBondContact O-N 3.07Å; T95-Q97 VanDerWaalsContact C-N 3.32Å; Q97-S99 PolarHBondContact O-N 2.97Å; Q97-M100 PolarHBondContact O-N 3.42Å; Q97-M100 VanDerWaalsContact O-N 3.11Å; Q97-N101 PolarHBondContact O-N 2.79Å
98L87.4Confident86.9Confident68 Ų6853.6 Ų53.636%0.35629%0.293SS..Hα-helixtrans-58.1-33.6178.6-176.964.3000112.2T96 M100 N101 L102 M154 A157 V158 T161T96-L98 PolarHBondContact O-N 3.15Å; L98-M100 VanDerWaalsContact C-N 3.32Å; L98-M100 PolarHBondContact O-N 3.34Å; L98-N101 PolarHBondContact O-N 3.3Å; L98-L102 VanDerWaalsContact O-CB 3.22Å; L98-L102 WeakPolarHBondContact O-CB 3.16Å; L98-L102 PolarHBondContact O-N 2.69Å; L98-M154 HydrophobicContact CD2-CE 4.09Å; L98-A157 HydrophobicContact CD1-CB 4.4Å; L98-V158 HydrophobicContact CD1-CG2 3.89Å; L98-T161 VanDerWaalsContact CA-CG2 3.44Å; L98-T161 HydrophobicContact CB-CG2 4.02Å; L98-T161 HydrophobicContact CD1-CG2 4Å
99S88.9Confident86.9Confident85 Ų8550.6 Ų50.659%0.59428%0.275SS*.Hα-helixtrans-56.3-44.1176.555.90000112.5Q97 A103Q97-S99 PolarHBondContact O-N 2.97Å; S99-A103 WeakPolarHBondContact O-CB 3.22Å; S99-A103 PolarHBondContact O-N 3.26Å
100M88.2Confident87Confident42 Ų4246.6 Ų46.621%0.20725%0.251CS..Hα-helixtrans-67.6-46.9-179-176.561.5-170.800111.4I24 F78 P94 Q97 L98 L102 A103 M104I24-M100 HydrophobicContact CD1-SD 4.5Å; I24-M100 HydrophobicContact CG2-CE 4.42Å; F78-M100 HydrophobicContact CE1-CE 3.84Å; F78-M100 HydrophobicContact CZ-CE 3.87Å; P94-M100 WeakPolarHBondContact O-CB 3.26Å; Q97-M100 PolarHBondContact O-N 3.42Å; Q97-M100 VanDerWaalsContact O-N 3.11Å; L98-M100 VanDerWaalsContact C-N 3.32Å; L98-M100 PolarHBondContact O-N 3.34Å; M100-L102 VanDerWaalsContact C-N 3.33Å; M100-L102 PolarHBondContact O-N 3.18Å; M100-A103 PolarHBondContact O-N 2.91Å; M100-M104 HydrophobicContact CE-CE 3.7Å; M100-M104 HydrophobicContact CE-CG 4.25Å; M100-M104 HydrophobicContact CE-SD 4.08Å; M100-M104 HydrophobicContact CG-CE 3.64Å; M100-M104 PolarHBondContact O-N 3.42Å; M100-M104 HydrophobicContact SD-CE 4.35Å
101N89.2Confident87.2Confident0 Ų036 Ų360%022%0.217CC..Hα-helixtrans-66.8-37.4-179.2-67-11.1000111.8T95 Q97 L98 M104 A105 A157 L160 T161T95-N101 PolarHBondContact O-ND2 3.24Å; Q97-N101 PolarHBondContact O-N 2.79Å; L98-N101 PolarHBondContact O-N 3.3Å; N101-M104 PolarHBondContact O-N 3.43Å; N101-A105 VanDerWaalsContact O-CB 3.31Å; N101-A105 WeakPolarHBondContact O-CB 3.5Å; N101-A105 PolarHBondContact O-N 2.76Å; N101-A157 HydrophobicContact CB-CB 3.92Å; N101-A157 PolarHBondContact ND2-O 2.83Å; N101-L160 HydrophobicContact CB-CD2 4.31Å; N101-L160 VanDerWaalsContact CG-CD2 3.42Å; N101-L160 WeakPolarHBondContact ND2-CB 3.28Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.21Å; N101-L160 WeakPolarHBondContact ND2-CG 3.15Å; N101-L160 VanDerWaalsContact OD1-CD2 3.28Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.37Å; N101-T161 HydrophobicContact CB-CG2 4.31Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.38Å; N101-T161 PolarHBondContact ND2-N 3.06Å
102L87.1Confident87.1Confident45 Ų4534.3 Ų34.324%0.23621%0.205CC..Hα-helixtrans-69.6-39.7176.9-165.864.5000111.7L98 M100 M104 A105 I106 M154 A157L98-L102 VanDerWaalsContact O-CB 3.22Å; L98-L102 WeakPolarHBondContact O-CB 3.16Å; L98-L102 PolarHBondContact O-N 2.69Å; M100-L102 VanDerWaalsContact C-N 3.33Å; M100-L102 PolarHBondContact O-N 3.18Å; L102-M104 PolarHBondContact O-N 3.37Å; L102-A105 PolarHBondContact O-N 2.84Å; L102-I106 HydrophobicContact CD1-CD1 3.67Å; L102-I106 HydrophobicContact CD1-CG1 3.74Å; L102-I106 HydrophobicContact CD2-CD1 4Å; L102-I106 HydrophobicContact CG-CD1 3.49Å; L102-I106 VanDerWaalsContact CG-CD1 3.49Å; L102-I106 HydrophobicContact CG-CG1 3.95Å; L102-I106 WeakPolarHBondContact O-CG1 3.49Å; L102-I106 PolarHBondContact O-N 3.18Å; L102-M154 HydrophobicContact CD1-SD 3.4Å; L102-M154 WeakPolarHBondContact CD1-SD 3.47Å; L102-M154 HydrophobicContact CD2-SD 4.16Å; L102-M154 HydrophobicContact CG-SD 4.42Å; L102-A157 HydrophobicContact CB-CB 4.45Å; L102-A157 HydrophobicContact CD1-CB 4.18Å
103A89.6Confident87.1Confident65 Ų6533.8 Ų33.854%0.53720%0.203SC..Hα-helixtrans-62.7-28.917400000112.8S99 M100 P107S99-A103 WeakPolarHBondContact O-CB 3.22Å; S99-A103 PolarHBondContact O-N 3.26Å; M100-A103 PolarHBondContact O-N 2.91Å; A103-P107 WeakPolarHBondContact O-CD 3.37Å; A103-P107 WeakPolarHBondContact O-CG 3.29Å
104M87.1Confident87.1Confident26 Ų2638.3 Ų38.313%0.12823%0.227CC..Hα-helixtrans-79.3-45.1170.9-70.7-172.7-93.300112.4F78 I79 M100 N101 L102 L108F78-M104 HydrophobicContact CD1-SD 3.89Å; F78-M104 HydrophobicContact CE1-CE 4.11Å; F78-M104 HydrophobicContact CE1-SD 3.62Å; I79-M104 HydrophobicContact CG1-SD 4.49Å; M100-M104 HydrophobicContact CE-CE 3.7Å; M100-M104 HydrophobicContact CE-CG 4.25Å; M100-M104 HydrophobicContact CE-SD 4.08Å; M100-M104 HydrophobicContact CG-CE 3.64Å; M100-M104 PolarHBondContact O-N 3.42Å; M100-M104 HydrophobicContact SD-CE 4.35Å; N101-M104 PolarHBondContact O-N 3.43Å; L102-M104 PolarHBondContact O-N 3.37Å; M104-L108 VanDerWaalsContact O-CD1 3.24Å; M104-L108 WeakPolarHBondContact O-CD1 3.37Å; M104-L108 WeakPolarHBondContact O-CG 3.1Å
105A87.7Confident87Confident3 Ų340.2 Ų40.23%0.02524%0.235CC..Hα-helixtrans-71.1-45-171.900000113.6N101 L102 L108 W109 A157 F214N101-A105 VanDerWaalsContact O-CB 3.31Å; N101-A105 WeakPolarHBondContact O-CB 3.5Å; N101-A105 PolarHBondContact O-N 2.76Å; L102-A105 PolarHBondContact O-N 2.84Å; A105-L108 PolarHBondContact O-N 3.48Å; A105-W109 VanDerWaalsContact O-CB 3.32Å; A105-W109 WeakPolarHBondContact O-CB 3.37Å; A105-W109 PolarHBondContact O-N 3.26Å; A105-A157 HydrophobicContact CB-CB 4.22Å; A105-F214 HydrophobicContact CB-CE2 4.33Å; A105-F214 HydrophobicContact CB-CZ 4.15Å
106I88.8Confident86.7Confident82 Ų8240.2 Ų40.242%0.42124%0.235SC..Hα-helixtrans-62-50.4-175.2-65.8176.6000111.8L102 L108 W109 A110L102-I106 HydrophobicContact CD1-CD1 3.67Å; L102-I106 HydrophobicContact CD1-CG1 3.74Å; L102-I106 HydrophobicContact CD2-CD1 4Å; L102-I106 HydrophobicContact CG-CD1 3.49Å; L102-I106 VanDerWaalsContact CG-CD1 3.49Å; L102-I106 HydrophobicContact CG-CG1 3.95Å; L102-I106 WeakPolarHBondContact O-CG1 3.49Å; L102-I106 PolarHBondContact O-N 3.18Å; I106-L108 PolarHBondContact O-N 3.05Å; I106-W109 PolarHBondContact O-N 3.37Å; I106-A110 WeakPolarHBondContact O-CB 3.4Å; I106-A110 PolarHBondContact O-N 3.39Å
107P89.9Confident86.3Confident79 Ų7943.6 Ų43.651%0.51325%0.249SC..Hα-helixtrans-65.1-37.6-178.2-23.836.7000113.2A103 G111A103-P107 WeakPolarHBondContact O-CD 3.37Å; A103-P107 WeakPolarHBondContact O-CG 3.29Å; P107-G111 PolarHBondContact O-N 3.21Å
108L88.5Confident85.8Confident18 Ų1850.5 Ų50.59%0.09427%0.272CS..Hα-helixtrans-65.7-46.7178.2-73.1168000111.6M71 L75 M104 A105 I106 G111 A112 F214 V218M71-L108 HydrophobicContact CE-CD2 3.76Å; M71-L108 HydrophobicContact CG-CD2 3.93Å; M71-L108 HydrophobicContact SD-CD2 3.61Å; L75-L108 HydrophobicContact CD1-CD1 3.44Å; L75-L108 VanDerWaalsContact CD1-CD1 3.44Å; L75-L108 HydrophobicContact CD2-CD1 3.76Å; L75-L108 HydrophobicContact CG-CD1 4.24Å; M104-L108 VanDerWaalsContact O-CD1 3.24Å; M104-L108 WeakPolarHBondContact O-CD1 3.37Å; M104-L108 WeakPolarHBondContact O-CG 3.1Å; A105-L108 PolarHBondContact O-N 3.48Å; I106-L108 PolarHBondContact O-N 3.05Å; L108-G111 PolarHBondContact O-N 2.91Å; L108-A112 PolarHBondContact O-N 3.03Å; L108-A112 VanDerWaalsContact O-N 3.09Å; L108-F214 HydrophobicContact CD1-CE1 4.17Å; L108-V218 HydrophobicContact CB-CG1 4.37Å
109W86.9Confident84.9Confident39 Ų3949.5 Ų49.515%0.14827%0.271CS..Hα-helixtrans-63.8-47.6175.8172.289.8000111.4A105 I106 G111 A112 V113 L149 L150 P153A105-W109 VanDerWaalsContact O-CB 3.32Å; A105-W109 WeakPolarHBondContact O-CB 3.37Å; A105-W109 PolarHBondContact O-N 3.26Å; I106-W109 PolarHBondContact O-N 3.37Å; W109-G111 VanDerWaalsContact C-N 3.28Å; W109-G111 PolarHBondContact O-N 3.26Å; W109-A112 PolarHBondContact O-N 3.08Å; W109-A112 VanDerWaalsContact O-N 3.14Å; W109-V113 HydrophobicContact CD2-CG2 4.08Å; W109-V113 HydrophobicContact CH2-CG2 4.4Å; W109-V113 HydrophobicContact CZ2-CG2 3.9Å; W109-V113 WeakPolarHBondContact O-CG2 3.49Å; W109-V113 PolarHBondContact O-N 2.67Å; W109-L149 HydrophobicContact CH2-CD2 4.16Å; W109-L149 HydrophobicContact CZ2-CD2 3.48Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.48Å; W109-L149 HydrophobicContact CZ2-CG 3.88Å; W109-L149 VanDerWaalsContact CZ2-O 3.26Å; W109-L149 WeakPolarHBondContact CZ2-O 3.46Å; W109-L149 PolarHBondContact NE1-O 2.98Å; W109-L150 HydrophobicContact CH2-CD2 3.7Å; W109-L150 HydrophobicContact CZ2-CD2 4.26Å; W109-P153 HydrophobicContact CB-CB 3.87Å; W109-P153 HydrophobicContact CB-CG 4.35Å; W109-P153 HydrophobicContact CD2-CB 4.29Å; W109-P153 HydrophobicContact CD2-CG 3.78Å; W109-P153 HydrophobicContact CE3-CG 4.3Å; W109-P153 HydrophobicContact CG-CB 3.81Å; W109-P153 HydrophobicContact CG-CG 3.78Å
110A86Confident84.1Confident25 Ų2549.7 Ų49.721%0.20726%0.261CS..Hα-helixtrans-60.3-41.2179.100000110.9I106 V113 I114I106-A110 WeakPolarHBondContact O-CB 3.4Å; I106-A110 PolarHBondContact O-N 3.39Å; A110-V113 PolarHBondContact O-N 3.1Å; A110-I114 VanDerWaalsContact O-CB 3.3Å; A110-I114 WeakPolarHBondContact O-CB 3.17Å; A110-I114 WeakPolarHBondContact O-CD1 3.48Å; A110-I114 WeakPolarHBondContact O-CG1 3.44Å; A110-I114 PolarHBondContact O-N 2.89Å
111G86.2Confident83.1Confident23 Ų2352.9 Ų52.924%0.23728%0.278CS..Hα-helixtrans-60.6-44.2175.100000113P107 L108 W109 M115P107-G111 PolarHBondContact O-N 3.21Å; L108-G111 PolarHBondContact O-N 2.91Å; W109-G111 VanDerWaalsContact C-N 3.28Å; W109-G111 PolarHBondContact O-N 3.26Å; G111-M115 VanDerWaalsContact O-CB 3.31Å; G111-M115 WeakPolarHBondContact O-CB 3.32Å; G111-M115 PolarHBondContact O-N 3.45Å
112A84.4Confident81.9Confident1 Ų161.9 Ų61.91%0.00832%0.317CS..Hα-helixtrans-63.6-45.617700000111.9L108 W109 M115 G116 L222L108-A112 PolarHBondContact O-N 3.03Å; L108-A112 VanDerWaalsContact O-N 3.09Å; W109-A112 PolarHBondContact O-N 3.08Å; W109-A112 VanDerWaalsContact O-N 3.14Å; A112-M115 PolarHBondContact O-N 3.28Å; A112-G116 PolarHBondContact O-N 3.43Å; A112-L222 HydrophobicContact CB-CD1 4.47Å
113V83.7Confident81Confident15 Ų1564.7 Ų64.79%0.09133%0.332CS..Hα-helixtrans-65-46.4178.8172.40000111.5W109 A110 M115 G116 F117W109-V113 HydrophobicContact CD2-CG2 4.08Å; W109-V113 HydrophobicContact CH2-CG2 4.4Å; W109-V113 HydrophobicContact CZ2-CG2 3.9Å; W109-V113 WeakPolarHBondContact O-CG2 3.49Å; W109-V113 PolarHBondContact O-N 2.67Å; A110-V113 PolarHBondContact O-N 3.1Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 3.17Å; V113-G116 PolarHBondContact O-N 2.84Å; V113-G116 VanDerWaalsContact O-N 3.14Å; V113-F117 HydrophobicContact CG1-CD2 3.64Å; V113-F117 HydrophobicContact CG1-CE2 3.36Å; V113-F117 VanDerWaalsContact O-CD2 3.23Å; V113-F117 WeakPolarHBondContact O-CD2 3.37Å; V113-F117 PolarHBondContact O-N 2.86Å
114I84.6Confident79.8Confident99 Ų9962.4 Ų62.451%0.50831%0.314SS..Hα-helixtrans-61.2-38.9176.9-68.4163.8000110.6A110 F117 R118A110-I114 VanDerWaalsContact O-CB 3.3Å; A110-I114 WeakPolarHBondContact O-CB 3.17Å; A110-I114 WeakPolarHBondContact O-CD1 3.48Å; A110-I114 WeakPolarHBondContact O-CG1 3.44Å; A110-I114 PolarHBondContact O-N 2.89Å; I114-F117 PolarHBondContact O-N 3.45Å; I114-R118 HydrophobicContact CG2-CG 4.43Å; I114-R118 WeakPolarHBondContact O-CB 3.49Å; I114-R118 VanDerWaalsContact O-CG 3.31Å; I114-R118 WeakPolarHBondContact O-CG 3.42Å; I114-R118 PolarHBondContact O-N 3.31Å
115M82Confident78.7Confident48 Ų4865.5 Ų65.524%0.23633%0.33CS..Hα-helixtrans-66.1-37.5176.1-173.1166178.700112.3W68 G111 A112 V113 R118 S119 L222 T226W68-M115 HydrophobicContact CZ2-SD 3.93Å; W68-M115 PolarHBondContact NE1-SD 3.2Å; G111-M115 VanDerWaalsContact O-CB 3.31Å; G111-M115 WeakPolarHBondContact O-CB 3.32Å; G111-M115 PolarHBondContact O-N 3.45Å; A112-M115 PolarHBondContact O-N 3.28Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 3.17Å; M115-R118 PolarHBondContact O-N 2.99Å; M115-S119 WeakPolarHBondContact O-CB 3.46Å; M115-S119 PolarHBondContact O-N 3.38Å; M115-S119 PolarHBondContact O-OG 3.44Å; M115-L222 HydrophobicContact SD-CD1 4.5Å; M115-T226 HydrophobicContact CE-CG2 4.38Å
116G78Confident77.4Confident1 Ų168 Ų681%0.0135%0.35CS..Hα-helixtrans-61.3-50.6172.600000112.7A112 V113 R118 S119 K120 N225A112-G116 PolarHBondContact O-N 3.43Å; V113-G116 PolarHBondContact O-N 2.84Å; V113-G116 VanDerWaalsContact O-N 3.14Å; G116-R118 VanDerWaalsContact C-N 3.32Å; G116-R118 PolarHBondContact O-N 3.21Å; G116-S119 PolarHBondContact O-N 3.35Å; G116-S119 PolarHBondContact O-OG 3.25Å; G116-K120 CarbonylContact O-C 3.6Å; G116-K120 PolarHBondContact O-N 3.23Å; G116-N225 VanDerWaalsContact CA-O 3.26Å; G116-N225 WeakPolarHBondContact CA-O 3.38Å
117F78.9Confident76.3Confident81 Ų8169.4 Ų69.436%0.35536%0.355SS..Hα-helixtrans-59.9-40.4175.5-76.9-62.8000112.3V113 I114 I121 A124 L125 F128V113-F117 HydrophobicContact CG1-CD2 3.64Å; V113-F117 HydrophobicContact CG1-CE2 3.36Å; V113-F117 VanDerWaalsContact O-CD2 3.23Å; V113-F117 WeakPolarHBondContact O-CD2 3.37Å; V113-F117 PolarHBondContact O-N 2.86Å; I114-F117 PolarHBondContact O-N 3.45Å; F117-I121 WeakPolarHBondContact O-CG1 3.26Å; F117-A124 HydrophobicContact CD1-CB 4.3Å; F117-A124 HydrophobicContact CE1-CB 4.39Å; F117-L125 HydrophobicContact CD1-CD1 4.25Å; F117-L125 HydrophobicContact CE1-CD1 3.9Å; F117-F128 HydrophobicContact CZ-CE2 4.48Å
118R78Confident75.1Confident215 Ų21567.5 Ų67.581%0.81134%0.339SS*.Hα-helixtrans-70.5-34.4179.1-73.9179.468.7-166.41.7113.6I114 M115 G116I114-R118 HydrophobicContact CG2-CG 4.43Å; I114-R118 WeakPolarHBondContact O-CB 3.49Å; I114-R118 VanDerWaalsContact O-CG 3.31Å; I114-R118 WeakPolarHBondContact O-CG 3.42Å; I114-R118 PolarHBondContact O-N 3.31Å; M115-R118 PolarHBondContact O-N 2.99Å; G116-R118 VanDerWaalsContact C-N 3.32Å; G116-R118 PolarHBondContact O-N 3.21Å
119S69.8Low73.9Confident47 Ų4769.8 Ų69.833%0.32935%0.351SS..Hα-helixtrans-89.7-39.3-172.370.50000113.6M115 G116 N225M115-S119 WeakPolarHBondContact O-CB 3.46Å; M115-S119 PolarHBondContact O-N 3.38Å; M115-S119 PolarHBondContact O-OG 3.44Å; G116-S119 PolarHBondContact O-N 3.35Å; G116-S119 PolarHBondContact O-OG 3.25Å; S119-N225 PolarHBondContact OG-O 3.48Å
120K71.5Confident72.7Confident89 Ų8971.3 Ų71.339%0.38737%0.366SS..  trans-146.770.9-176.3-67176.3-177.8161.30111.5G116 K122 N123 A124 T226G116-K120 CarbonylContact O-C 3.6Å; G116-K120 PolarHBondContact O-N 3.23Å; K120-K122 VanDerWaalsContact C-N 3.28Å; K120-K122 PolarHBondContact O-N 3.03Å; K120-N123 HydrophobicContact CB-CB 3.95Å; K120-N123 HydrophobicContact CD-CB 4.32Å; K120-N123 PolarHBondContact O-N 3.38Å; K120-N123 VanDerWaalsContact O-N 3.11Å; K120-A124 WeakPolarHBondContact O-CB 3.49Å; K120-A124 PolarHBondContact O-N 3Å; K120-T226 WeakPolarHBondContact CE-O 3.3Å; K120-T226 PolarHBondContact NZ-O 3.18Å; K120-T226 PolarHBondContact NZ-OXT 3.41Å
121I66.4Low71.5Confident110 Ų11079.8 Ų79.856%0.56440%0.401SS*.Hα-helixtrans-47.4-49.7177.7-60.6171000111.8F117 N123 A124 L125F117-I121 WeakPolarHBondContact O-CG1 3.26Å; I121-N123 PolarHBondContact O-N 2.68Å; I121-A124 PolarHBondContact O-N 3.14Å; I121-L125 HydrophobicContact CG2-CD1 3.77Å; I121-L125 WeakPolarHBondContact O-CD1 3.48Å; I121-L125 PolarHBondContact O-N 2.93Å
122K64.5Low70.4Confident189 Ų18982.6 Ų82.682%0.82243%0.43SS*.Hα-helixtrans-65.6-37.1-176-65.1-175.2-179.9-177.20113.3K120 A126K120-K122 VanDerWaalsContact C-N 3.28Å; K120-K122 PolarHBondContact O-N 3.03Å; K122-A126 VanDerWaalsContact O-CB 3.26Å; K122-A126 WeakPolarHBondContact O-CB 3.49Å; K122-A126 PolarHBondContact O-N 3.13Å
123N67.6Low69.8Low103 Ų10384.2 Ų84.255%0.55144%0.44SS*.Hα-helixtrans-79.2-36.4-178-146.360.6000111.2K120 I121 A126 H127K120-N123 HydrophobicContact CB-CB 3.95Å; K120-N123 HydrophobicContact CD-CB 4.32Å; K120-N123 PolarHBondContact O-N 3.38Å; K120-N123 VanDerWaalsContact O-N 3.11Å; I121-N123 PolarHBondContact O-N 2.68Å; N123-A126 PolarHBondContact O-N 3.5Å; N123-H127 PolarHBondContact O-N 2.92Å; N123-H127 VanDerWaalsContact O-N 3.09Å
124A64.6Low69.3Low17 Ų1787.2 Ų87.214%0.1446%0.459CS..Hα-helixtrans-63-42.3172.900000111.5F117 K120 I121 H127F117-A124 HydrophobicContact CD1-CB 4.3Å; F117-A124 HydrophobicContact CE1-CB 4.39Å; K120-A124 WeakPolarHBondContact O-CB 3.49Å; K120-A124 PolarHBondContact O-N 3Å; I121-A124 PolarHBondContact O-N 3.14Å; A124-H127 PolarHBondContact O-N 2.86Å
125L63.8Low68.9Low92 Ų9288.2 Ų88.248%0.48247%0.471SS..Hα-helixtrans-70.8-32.8174.5-87.284000112.9F117 I121 H127 F128F117-L125 HydrophobicContact CD1-CD1 4.25Å; F117-L125 HydrophobicContact CE1-CD1 3.9Å; I121-L125 HydrophobicContact CG2-CD1 3.77Å; I121-L125 WeakPolarHBondContact O-CD1 3.48Å; I121-L125 PolarHBondContact O-N 2.93Å; L125-H127 VanDerWaalsContact C-N 3.28Å; L125-H127 PolarHBondContact O-N 3.23Å; L125-F128 PolarHBondContact O-N 3.25Å
126A62.1Low68.9Low54 Ų5490.9 Ų90.945%0.44649%0.491SS..Hα-helixtrans-67.3-28.1176.500000112.6K122 N123 F128 L129K122-A126 VanDerWaalsContact O-CB 3.26Å; K122-A126 WeakPolarHBondContact O-CB 3.49Å; K122-A126 PolarHBondContact O-N 3.13Å; N123-A126 PolarHBondContact O-N 3.5Å; A126-F128 PolarHBondContact O-N 3.31Å; A126-L129 PolarHBondContact O-N 3.45Å; A126-L129 VanDerWaalsContact O-N 3.08Å
127H65.4Low69.1Low113 Ų11395.9 Ų95.952%0.52352%0.517SS..THydrogen-bonded Turntrans-65.6-19.4176.1-157.3-63000113.1N123 A124 L125 L129N123-H127 PolarHBondContact O-N 2.92Å; N123-H127 VanDerWaalsContact O-N 3.09Å; A124-H127 PolarHBondContact O-N 2.86Å; L125-H127 VanDerWaalsContact C-N 3.28Å; L125-H127 PolarHBondContact O-N 3.23Å; H127-L129 PolarHBondContact O-N 3.38Å
128F63.2Low69.1Low38 Ų3894.3 Ų94.317%0.16751%0.512CS..THydrogen-bonded Turntrans-71-14.9173.1-68-58.6000113.5F117 L125 A126 L141 E145 T146F117-F128 HydrophobicContact CZ-CE2 4.48Å; L125-F128 PolarHBondContact O-N 3.25Å; A126-F128 PolarHBondContact O-N 3.31Å; F128-L141 WeakPolarHBondContact O-CD2 3.22Å; F128-E145 HydrophobicContact CD1-CB 4.25Å; F128-E145 HydrophobicContact CD1-CG 3.86Å; F128-T146 HydrophobicContact CD1-CG2 4.14Å; F128-T146 HydrophobicContact CE1-CG2 3.88Å; F128-T146 HydrophobicContact CZ-CG2 4.39Å
129L63.5Low69.2Low67 Ų6788.1 Ų88.135%0.35150%0.5SS..SBendtrans-122.3114.5176.8-9778.8000111A126 H127 Q131 I138 V142A126-L129 PolarHBondContact O-N 3.45Å; A126-L129 VanDerWaalsContact O-N 3.08Å; H127-L129 PolarHBondContact O-N 3.38Å; L129-Q131 PolarHBondContact O-N 3.17Å; L129-I138 HydrophobicContact CD1-CG2 4.09Å; L129-I138 HydrophobicContact CD2-CD1 4.23Å; L129-I138 HydrophobicContact CD2-CG1 4.31Å; L129-I138 HydrophobicContact CD2-CG2 3.77Å; L129-I138 HydrophobicContact CG-CG2 4.16Å; L129-V142 HydrophobicContact CD1-CG2 3.38Å
130P61.5Low69.9Low70 Ų7091.5 Ų91.546%0.45551%0.512SS..  trans-62.9138.5165.719.4-20.1000109.7G132 T133 L141P130-G132 PolarHBondContact O-N 3.3Å; P130-T133 HydrophobicContact CB-CG2 4.44Å; P130-T133 HydrophobicContact CG-CG2 3.69Å; P130-T133 WeakPolarHBondContact O-CG2 3.39Å; P130-L141 HydrophobicContact CG-CD1 3.79Å; P130-L141 HydrophobicContact CG-CD2 3.99Å
131Q62.5Low70.5Confident204 Ų20489.5 Ų89.595%0.95351%0.505SS*.THydrogen-bonded Turntrans-64.6128.3-178.8-63.1-168.5-0.600110.3L129L129-Q131 PolarHBondContact O-N 3.17Å
132G63.1Low71.2Confident81 Ų8186.4 Ų86.484%0.83549%0.491SS*.THydrogen-bonded Turntrans99.512.1175.600000116.3P130P130-G132 PolarHBondContact O-N 3.3Å
133T71.2Confident72.2Confident36 Ų3681.8 Ų81.822%0.22147%0.474CS..  trans-72.5135.3176.153.60000112.5P130 L141P130-T133 HydrophobicContact CB-CG2 4.44Å; P130-T133 HydrophobicContact CG-CG2 3.69Å; P130-T133 WeakPolarHBondContact O-CG2 3.39Å; T133-L141 HydrophobicContact CG2-CD1 3.88Å
134P74.2Confident73.1Confident77 Ų7781.3 Ų81.350%0.547%0.471SS..  trans-66140.9176.429.1-35.1000110.9P136 L137P134-P136 VanDerWaalsContact C-N 3.31Å; P134-P136 VanDerWaalsContact O-CD 3.31Å; P134-P136 WeakPolarHBondContact O-CD 3.36Å; P134-P136 VanDerWaalsContact O-N 3.07Å; P134-L137 HydrophobicContact CG-CB 4.43Å; P134-L137 HydrophobicContact CG-CD1 3.73Å; P134-L137 HydrophobicContact CG-CG 4.2Å; P134-L137 PolarHBondContact O-N 3.37Å
135T76.1Confident74Confident121 Ų12183.3 Ų83.374%0.74248%0.477SS*.THydrogen-bonded Turntrans-50.5-30.8-17249.50000116.9I138T135-I138 HydrophobicContact CG2-CD1 4.46Å
136P82Confident74.9Confident104 Ų10481.4 Ų81.468%0.67547%0.469SS*.THydrogen-bonded Turntrans-75.1-27.2179.1-13.729.3000114P134 P139P134-P136 VanDerWaalsContact C-N 3.31Å; P134-P136 VanDerWaalsContact O-CD 3.31Å; P134-P136 WeakPolarHBondContact O-CD 3.36Å; P134-P136 VanDerWaalsContact O-N 3.07Å; P136-P139 WeakPolarHBondContact O-CD 3.43Å
137L80.4Confident76Confident106 Ų10682.8 Ų82.856%0.55547%0.469SS*.THydrogen-bonded Turntrans-88-11-173.7-65.5177.1000113P134 M140 L141P134-L137 HydrophobicContact CG-CB 4.43Å; P134-L137 HydrophobicContact CG-CD1 3.73Å; P134-L137 HydrophobicContact CG-CG 4.2Å; P134-L137 PolarHBondContact O-N 3.37Å; L137-M140 PolarHBondContact O-N 3.14Å; L137-L141 PolarHBondContact O-N 3.49Å; L137-L141 VanDerWaalsContact O-N 3.11Å
138I79.5Confident76.9Confident48 Ų4879.9 Ų79.925%0.24646%0.461CS..Hα-helixtrans-55.6-49.2-176.6-63.9176.2000112.4L129 T135 M140 L141 V142L129-I138 HydrophobicContact CD1-CG2 4.09Å; L129-I138 HydrophobicContact CD2-CD1 4.23Å; L129-I138 HydrophobicContact CD2-CG1 4.31Å; L129-I138 HydrophobicContact CD2-CG2 3.77Å; L129-I138 HydrophobicContact CG-CG2 4.16Å; T135-I138 HydrophobicContact CG2-CD1 4.46Å; I138-M140 VanDerWaalsContact C-N 3.32Å; I138-M140 PolarHBondContact O-N 3.37Å; I138-L141 PolarHBondContact O-N 3.38Å; I138-V142 HydrophobicContact CG2-CG2 4.45Å; I138-V142 WeakPolarHBondContact O-CG2 3.31Å; I138-V142 PolarHBondContact O-N 3.41Å; I138-V142 VanDerWaalsContact O-N 3.15Å
139P79.9Confident77.8Confident85 Ų8580.2 Ų80.255%0.55246%0.464SS*.Hα-helixtrans-64.2-37.3-175.8-21.133.9000112.8P136 I143P136-P139 WeakPolarHBondContact O-CD 3.43Å; P139-I143 WeakPolarHBondContact O-CG1 3.26Å; P139-I143 PolarHBondContact O-N 3.18Å
140M83.9Confident78.8Confident117 Ų11782.2 Ų82.258%0.57648%0.475SS*.Hα-helixtrans-69-41.4178.8-173.764.2-172.800111.5L137 I138 I143 I144L137-M140 PolarHBondContact O-N 3.14Å; I138-M140 VanDerWaalsContact C-N 3.32Å; I138-M140 PolarHBondContact O-N 3.37Å; M140-I143 PolarHBondContact O-N 2.91Å; M140-I144 HydrophobicContact CE-CD1 3.98Å; M140-I144 HydrophobicContact CE-CG1 4.21Å; M140-I144 HydrophobicContact CG-CD1 4.12Å; M140-I144 WeakPolarHBondContact O-CG1 3.32Å; M140-I144 PolarHBondContact O-N 3.01Å; M140-I144 VanDerWaalsContact O-N 3.12Å
141L84.8Confident79.9Confident48 Ų4883.5 Ų83.525%0.25148%0.477SS..Hα-helixtrans-66.3-40.6-178.4-166.6150.9000111.9F128 P130 T133 L137 I138 I143 I144 E145F128-L141 WeakPolarHBondContact O-CD2 3.22Å; P130-L141 HydrophobicContact CG-CD1 3.79Å; P130-L141 HydrophobicContact CG-CD2 3.99Å; T133-L141 HydrophobicContact CG2-CD1 3.88Å; L137-L141 PolarHBondContact O-N 3.49Å; L137-L141 VanDerWaalsContact O-N 3.11Å; I138-L141 PolarHBondContact O-N 3.38Å; L141-I143 VanDerWaalsContact C-N 3.29Å; L141-I143 PolarHBondContact O-N 3.03Å; L141-I144 PolarHBondContact O-N 3.49Å; L141-E145 WeakPolarHBondContact O-CB 3.39Å; L141-E145 PolarHBondContact O-N 3.35Å
142V81.8Confident80.9Confident45 Ų4577.2 Ų77.227%0.27345%0.447SS..Hα-helixtrans-59.7-41175.7174.30000111.4L129 I138 E145 T146L129-V142 HydrophobicContact CD1-CG2 3.38Å; I138-V142 HydrophobicContact CG2-CG2 4.45Å; I138-V142 WeakPolarHBondContact O-CG2 3.31Å; I138-V142 PolarHBondContact O-N 3.41Å; I138-V142 VanDerWaalsContact O-N 3.15Å; V142-E145 PolarHBondContact O-N 2.89Å; V142-T146 HydrophobicContact CG1-CG2 4.36Å; V142-T146 WeakPolarHBondContact O-CB 2.98Å; V142-T146 VanDerWaalsContact O-CG2 3.26Å; V142-T146 WeakPolarHBondContact O-CG2 3.31Å; V142-T146 PolarHBondContact O-N 3.33Å; V142-T146 PolarHBondContact O-OG1 2.98Å
143I85.2Confident81.7Confident91 Ų9173.7 Ų73.747%0.46741%0.41SS..Hα-helixtrans-63.5-44.5176.9-66.1166.9000110.5P139 M140 L141 T146 I147P139-I143 WeakPolarHBondContact O-CG1 3.26Å; P139-I143 PolarHBondContact O-N 3.18Å; M140-I143 PolarHBondContact O-N 2.91Å; L141-I143 VanDerWaalsContact C-N 3.29Å; L141-I143 PolarHBondContact O-N 3.03Å; I143-T146 WeakPolarHBondContact CA-OG1 3.34Å; I143-T146 PolarHBondContact O-OG1 2.76Å; I143-I147 HydrophobicContact CG2-CD1 3.79Å; I143-I147 WeakPolarHBondContact O-CD1 3.04Å; I143-I147 VanDerWaalsContact O-CG1 3.24Å; I143-I147 WeakPolarHBondContact O-CG1 3.4Å; I143-I147 PolarHBondContact O-N 2.93Å
144I86.1Confident82.4Confident93 Ų9375.6 Ų75.648%0.47742%0.417SS..Hα-helixtrans-64.8-43.4179.3-64.2165.7000111M140 L141 I147 S148M140-I144 HydrophobicContact CE-CD1 3.98Å; M140-I144 HydrophobicContact CE-CG1 4.21Å; M140-I144 HydrophobicContact CG-CD1 4.12Å; M140-I144 WeakPolarHBondContact O-CG1 3.32Å; M140-I144 PolarHBondContact O-N 3.01Å; M140-I144 VanDerWaalsContact O-N 3.12Å; L141-I144 PolarHBondContact O-N 3.49Å; I144-I147 PolarHBondContact O-N 2.97Å; I144-S148 WeakPolarHBondContact O-CB 3.39Å; I144-S148 PolarHBondContact O-N 3.43Å
145E84.4Confident82.9Confident60 Ų6073.9 Ų73.928%0.2841%0.41SS..Hα-helixtrans-67.4-39.9-178.8-167.260.9-15700111.8F128 L141 V142 I147 S148 L149F128-E145 HydrophobicContact CD1-CB 4.25Å; F128-E145 HydrophobicContact CD1-CG 3.86Å; L141-E145 WeakPolarHBondContact O-CB 3.39Å; L141-E145 PolarHBondContact O-N 3.35Å; V142-E145 PolarHBondContact O-N 2.89Å; E145-I147 VanDerWaalsContact C-N 3.33Å; E145-I147 PolarHBondContact O-N 3.31Å; E145-S148 WeakPolarHBondContact O-CB 3.42Å; E145-S148 PolarHBondContact O-N 3.26Å; E145-L149 WeakPolarHBondContact O-CB 3.33Å; E145-L149 PolarHBondContact O-N 3.09Å
146T81.5Confident83.2Confident51 Ų5168.4 Ų68.431%0.31338%0.376SS..Hα-helixtrans-63.2-38.9174.152.30000112.3F128 V142 I143 L150F128-T146 HydrophobicContact CD1-CG2 4.14Å; F128-T146 HydrophobicContact CE1-CG2 3.88Å; F128-T146 HydrophobicContact CZ-CG2 4.39Å; V142-T146 HydrophobicContact CG1-CG2 4.36Å; V142-T146 WeakPolarHBondContact O-CB 2.98Å; V142-T146 VanDerWaalsContact O-CG2 3.26Å; V142-T146 WeakPolarHBondContact O-CG2 3.31Å; V142-T146 PolarHBondContact O-N 3.33Å; V142-T146 PolarHBondContact O-OG1 2.98Å; I143-T146 WeakPolarHBondContact CA-OG1 3.34Å; I143-T146 PolarHBondContact O-OG1 2.76Å; T146-L150 WeakPolarHBondContact O-CG 3.21Å; T146-L150 PolarHBondContact O-N 3.46Å
147I85.9Confident83.3Confident84 Ų8463.4 Ų63.443%0.43134%0.343SS..Hα-helixtrans-66.8-43.7173.6-67.9166.5000110.9I143 I144 E145 L149 L150 I151I143-I147 HydrophobicContact CG2-CD1 3.79Å; I143-I147 WeakPolarHBondContact O-CD1 3.04Å; I143-I147 VanDerWaalsContact O-CG1 3.24Å; I143-I147 WeakPolarHBondContact O-CG1 3.4Å; I143-I147 PolarHBondContact O-N 2.93Å; I144-I147 PolarHBondContact O-N 2.97Å; E145-I147 VanDerWaalsContact C-N 3.33Å; E145-I147 PolarHBondContact O-N 3.31Å; I147-L149 VanDerWaalsContact C-N 3.34Å; I147-L149 PolarHBondContact O-N 2.91Å; I147-L150 PolarHBondContact O-N 2.91Å; I147-L150 VanDerWaalsContact O-N 3.16Å; I147-I151 HydrophobicContact CG2-CD1 3.47Å; I147-I151 VanDerWaalsContact CG2-CD1 3.47Å; I147-I151 HydrophobicContact CG2-CG1 4.13Å; I147-I151 WeakPolarHBondContact O-CG1 3.01Å; I147-I151 PolarHBondContact O-N 3.07Å
148S84.3Confident83.6Confident52 Ų5261.3 Ų61.336%0.36434%0.335SS..Hα-helixtrans-57.4-46.5178.2-1770000111.7I144 E145 L150 I151 Q152I144-S148 WeakPolarHBondContact O-CB 3.39Å; I144-S148 PolarHBondContact O-N 3.43Å; E145-S148 WeakPolarHBondContact O-CB 3.42Å; E145-S148 PolarHBondContact O-N 3.26Å; S148-L150 VanDerWaalsContact C-N 3.28Å; S148-L150 PolarHBondContact O-N 2.93Å; S148-I151 PolarHBondContact O-N 3.32Å; S148-Q152 PolarHBondContact O-N 3.47Å; S148-Q152 VanDerWaalsContact O-N 3.11Å
149L82.8Confident84Confident45 Ų4563.9 Ų63.924%0.23634%0.341CS..Hα-helixtrans-59.8-36.7177.5-172.2117000112.1W109 E145 I147 P153W109-L149 HydrophobicContact CH2-CD2 4.16Å; W109-L149 HydrophobicContact CZ2-CD2 3.48Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.48Å; W109-L149 HydrophobicContact CZ2-CG 3.88Å; W109-L149 VanDerWaalsContact CZ2-O 3.26Å; W109-L149 WeakPolarHBondContact CZ2-O 3.46Å; W109-L149 PolarHBondContact NE1-O 2.98Å; E145-L149 WeakPolarHBondContact O-CB 3.33Å; E145-L149 PolarHBondContact O-N 3.09Å; I147-L149 VanDerWaalsContact C-N 3.34Å; I147-L149 PolarHBondContact O-N 2.91Å; L149-P153 WeakPolarHBondContact O-CD 3.36Å
150L83.1Confident84.1Confident108 Ų10859.8 Ų59.857%0.56532%0.315SS*.Hα-helixtrans-77.8-35.4177.5-71.7172.9000113.7W109 T146 I147 S148 P153W109-L150 HydrophobicContact CH2-CD2 3.7Å; W109-L150 HydrophobicContact CZ2-CD2 4.26Å; T146-L150 WeakPolarHBondContact O-CG 3.21Å; T146-L150 PolarHBondContact O-N 3.46Å; I147-L150 PolarHBondContact O-N 2.91Å; I147-L150 VanDerWaalsContact O-N 3.16Å; S148-L150 VanDerWaalsContact C-N 3.28Å; S148-L150 PolarHBondContact O-N 2.93Å; L150-P153 WeakPolarHBondContact O-CD 3.28Å; L150-P153 WeakPolarHBondContact O-CG 3.12Å
151I85.9Confident84.2Confident98 Ų9854.9 Ų54.950%0.50329%0.292SS..Hα-helixtrans-72.8-31.6-179.2-69.3173.7000111.2I147 S148 M154 A155I147-I151 HydrophobicContact CG2-CD1 3.47Å; I147-I151 VanDerWaalsContact CG2-CD1 3.47Å; I147-I151 HydrophobicContact CG2-CG1 4.13Å; I147-I151 WeakPolarHBondContact O-CG1 3.01Å; I147-I151 PolarHBondContact O-N 3.07Å; S148-I151 PolarHBondContact O-N 3.32Å; I151-M154 CarbonylContact O-C 3.6Å; I151-M154 WeakPolarHBondContact O-CB 3.45Å; I151-M154 PolarHBondContact O-N 2.92Å; I151-M154 VanDerWaalsContact O-N 3.11Å; I151-A155 HydrophobicContact CG2-CB 4.42Å; I151-A155 WeakPolarHBondContact O-CB 3.27Å; I151-A155 PolarHBondContact O-N 3.46Å
152Q83.3Confident84.3Confident71 Ų7154.6 Ų54.633%0.33230%0.296SS..Hα-helixtrans-50.4-52.9-177.8-111.2175.2-14.400116.1S148 M154 A155 L156 Y221S148-Q152 PolarHBondContact O-N 3.47Å; S148-Q152 VanDerWaalsContact O-N 3.11Å; Q152-M154 VanDerWaalsContact C-N 3.28Å; Q152-M154 PolarHBondContact O-N 2.96Å; Q152-A155 PolarHBondContact O-N 3.16Å; Q152-L156 PolarHBondContact O-N 2.99Å; Q152-Y221 HydrophobicContact CG-CE1 4.38Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.36Å; Q152-Y221 VanDerWaalsContact NE2-CE1 3.34Å; Q152-Y221 PolarHBondContact NE2-OH 3.07Å; Q152-Y221 PolarHBondContact OE1-OH 3.09Å
153P80.1Confident84.6Confident8 Ų855.3 Ų55.35%0.05230%0.298CS..Hα-helixtrans-64.5-34.5178.424.2-34.9000112.2W109 L149 L150 L156 A157W109-P153 HydrophobicContact CB-CB 3.87Å; W109-P153 HydrophobicContact CB-CG 4.35Å; W109-P153 HydrophobicContact CD2-CB 4.29Å; W109-P153 HydrophobicContact CD2-CG 3.78Å; W109-P153 HydrophobicContact CE3-CG 4.3Å; W109-P153 HydrophobicContact CG-CB 3.81Å; W109-P153 HydrophobicContact CG-CG 3.78Å; L149-P153 WeakPolarHBondContact O-CD 3.36Å; L150-P153 WeakPolarHBondContact O-CD 3.28Å; L150-P153 WeakPolarHBondContact O-CG 3.12Å; P153-L156 PolarHBondContact O-N 3.39Å; P153-A157 PolarHBondContact O-N 3.43Å; P153-A157 VanDerWaalsContact O-N 3.14Å
154M84.6Confident84.6Confident76 Ų7651.3 Ų51.337%0.37428%0.278SS..Hα-helixtrans-66.9-46175.5-170.266.3-174.200111.1L98 L102 I151 Q152 L156 A157 V158L98-M154 HydrophobicContact CD2-CE 4.09Å; L102-M154 HydrophobicContact CD1-SD 3.4Å; L102-M154 WeakPolarHBondContact CD1-SD 3.47Å; L102-M154 HydrophobicContact CD2-SD 4.16Å; L102-M154 HydrophobicContact CG-SD 4.42Å; I151-M154 CarbonylContact O-C 3.6Å; I151-M154 WeakPolarHBondContact O-CB 3.45Å; I151-M154 PolarHBondContact O-N 2.92Å; I151-M154 VanDerWaalsContact O-N 3.11Å; Q152-M154 VanDerWaalsContact C-N 3.28Å; Q152-M154 PolarHBondContact O-N 2.96Å; M154-L156 VanDerWaalsContact C-N 3.27Å; M154-L156 PolarHBondContact O-N 3.17Å; M154-A157 PolarHBondContact O-N 2.87Å; M154-V158 HydrophobicContact CE-CG2 4.09Å; M154-V158 HydrophobicContact CG-CG2 4.46Å; M154-V158 VanDerWaalsContact O-CG2 3.3Å; M154-V158 WeakPolarHBondContact O-CG2 3.16Å; M154-V158 PolarHBondContact O-N 3.04Å
155A85.6Confident84.7Confident41 Ų4148.7 Ų48.734%0.33927%0.266SS..Hα-helixtrans-61.2-37178.300000111.9I151 Q152 R159I151-A155 HydrophobicContact CG2-CB 4.42Å; I151-A155 WeakPolarHBondContact O-CB 3.27Å; I151-A155 PolarHBondContact O-N 3.46Å; Q152-A155 PolarHBondContact O-N 3.16Å; A155-R159 WeakPolarHBondContact O-CB 3.49Å; A155-R159 PolarHBondContact O-N 3.41Å
156L81.4Confident84.9Confident5 Ų548.4 Ų48.43%0.02627%0.274CS..Hα-helixtrans-63.6-47.8175.1-168.778.7000111.9Q152 P153 M154 R159 L160 F214 L217 V218Q152-L156 PolarHBondContact O-N 2.99Å; P153-L156 PolarHBondContact O-N 3.39Å; M154-L156 VanDerWaalsContact C-N 3.27Å; M154-L156 PolarHBondContact O-N 3.17Å; L156-R159 PolarHBondContact O-N 3.41Å; L156-L160 PolarHBondContact O-N 3.35Å; L156-F214 HydrophobicContact CD1-CB 4.48Å; L156-F214 HydrophobicContact CD1-CD2 4.08Å; L156-F214 HydrophobicContact CD1-CG 4.46Å; L156-F214 HydrophobicContact CD2-CD1 4.16Å; L156-F214 HydrophobicContact CD2-CD2 3.25Å; L156-F214 HydrophobicContact CD2-CE1 4.12Å; L156-F214 HydrophobicContact CD2-CE2 3.19Å; L156-F214 HydrophobicContact CD2-CG 3.74Å; L156-F214 HydrophobicContact CD2-CZ 3.65Å; L156-F214 HydrophobicContact CG-CD2 3.39Å; L156-F214 HydrophobicContact CG-CE2 3.63Å; L156-F214 HydrophobicContact CG-CG 4.14Å; L156-L217 HydrophobicContact CD1-CB 4.19Å; L156-L217 HydrophobicContact CD1-CD1 3.4Å; L156-L217 VanDerWaalsContact CD1-CD1 3.4Å; L156-L217 HydrophobicContact CD1-CG 4.42Å; L156-V218 HydrophobicContact CD2-CG2 4.36Å
157A84.5Confident85.2Confident0 Ų046.2 Ų46.20%026%0.262CS..Hα-helixtrans-62.8-44.7178.700000111.9L98 N101 L102 A105 P153 M154 R159 L160 T161L98-A157 HydrophobicContact CD1-CB 4.4Å; N101-A157 HydrophobicContact CB-CB 3.92Å; N101-A157 PolarHBondContact ND2-O 2.83Å; L102-A157 HydrophobicContact CB-CB 4.45Å; L102-A157 HydrophobicContact CD1-CB 4.18Å; A105-A157 HydrophobicContact CB-CB 4.22Å; P153-A157 PolarHBondContact O-N 3.43Å; P153-A157 VanDerWaalsContact O-N 3.14Å; M154-A157 PolarHBondContact O-N 2.87Å; A157-R159 VanDerWaalsContact C-N 3.34Å; A157-R159 PolarHBondContact O-N 3.49Å; A157-L160 PolarHBondContact O-N 2.87Å; A157-T161 PolarHBondContact O-N 3.34Å; A157-T161 VanDerWaalsContact O-N 3.12Å; A157-T161 PolarHBondContact O-OG1 3.41Å
158V87.5Confident85.4Confident61 Ų6143.7 Ų43.737%0.3725%0.248SC..Hα-helixtrans-63.5-38.9177.4172.80000111.4L98 M154 L160 T161 A162L98-V158 HydrophobicContact CD1-CG2 3.89Å; M154-V158 HydrophobicContact CE-CG2 4.09Å; M154-V158 HydrophobicContact CG-CG2 4.46Å; M154-V158 VanDerWaalsContact O-CG2 3.3Å; M154-V158 WeakPolarHBondContact O-CG2 3.16Å; M154-V158 PolarHBondContact O-N 3.04Å; V158-L160 VanDerWaalsContact C-N 3.33Å; V158-L160 PolarHBondContact O-N 3.11Å; V158-T161 WeakPolarHBondContact CA-OG1 3.43Å; V158-T161 PolarHBondContact O-N 2.93Å; V158-T161 PolarHBondContact O-OG1 3.4Å; V158-A162 WeakPolarHBondContact O-CB 3.21Å; V158-A162 PolarHBondContact O-N 3.26Å
159R87.6Confident85.6Confident102 Ų10243.2 Ų43.239%0.38524%0.241SC..Hα-helixtrans-61.2-42.7177.7-168.6-173.4-61.5155.11.5111.7A155 L156 A157 N163 Q210A155-R159 WeakPolarHBondContact O-CB 3.49Å; A155-R159 PolarHBondContact O-N 3.41Å; L156-R159 PolarHBondContact O-N 3.41Å; A157-R159 VanDerWaalsContact C-N 3.34Å; A157-R159 PolarHBondContact O-N 3.49Å; R159-N163 WeakPolarHBondContact O-CB 3.23Å; R159-N163 VanDerWaalsContact O-CG 3.28Å; R159-N163 PolarHBondContact O-N 3.24Å; R159-Q210 VanDerWaalsContact C-NE2 3.28Å; R159-Q210 VanDerWaalsContact CG-NE2 3.32Å
160L82.6Confident85.9Confident0 Ų045 Ų450%025%0.25CS..Hα-helixtrans-66.9-44.6179.5-178.667.8000110.8I79 N101 L156 A157 V158 I164 Q210 F214I79-L160 HydrophobicContact CG2-CD1 4.03Å; I79-L160 HydrophobicContact CG2-CD2 4.14Å; N101-L160 HydrophobicContact CB-CD2 4.31Å; N101-L160 VanDerWaalsContact CG-CD2 3.42Å; N101-L160 WeakPolarHBondContact ND2-CB 3.28Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.21Å; N101-L160 WeakPolarHBondContact ND2-CG 3.15Å; N101-L160 VanDerWaalsContact OD1-CD2 3.28Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.37Å; L156-L160 PolarHBondContact O-N 3.35Å; A157-L160 PolarHBondContact O-N 2.87Å; V158-L160 VanDerWaalsContact C-N 3.33Å; V158-L160 PolarHBondContact O-N 3.11Å; L160-I164 HydrophobicContact CD1-CD1 3.78Å; L160-I164 HydrophobicContact CG-CD1 4.22Å; L160-I164 WeakPolarHBondContact O-CG1 3.07Å; L160-I164 PolarHBondContact O-N 3.22Å; L160-Q210 VanDerWaalsContact CA-NE2 3.27Å; L160-Q210 HydrophobicContact CB-CG 4.29Å; L160-Q210 HydrophobicContact CD1-CB 4.34Å; L160-Q210 HydrophobicContact CD1-CG 3.37Å; L160-Q210 HydrophobicContact CG-CG 4.42Å; L160-F214 HydrophobicContact CD2-CD2 4.48Å
161T86.1Confident86.3Confident14 Ų1441.3 Ų41.39%0.08623%0.231CC..Hα-helixtrans-65.3-46.517747.70000112.3T96 L98 N101 A157 V158 N163 I164 T165T96-T161 WeakPolarHBondContact O-CG2 3.28Å; L98-T161 VanDerWaalsContact CA-CG2 3.44Å; L98-T161 HydrophobicContact CB-CG2 4.02Å; L98-T161 HydrophobicContact CD1-CG2 4Å; N101-T161 HydrophobicContact CB-CG2 4.31Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.38Å; N101-T161 PolarHBondContact ND2-N 3.06Å; A157-T161 PolarHBondContact O-N 3.34Å; A157-T161 VanDerWaalsContact O-N 3.12Å; A157-T161 PolarHBondContact O-OG1 3.41Å; V158-T161 WeakPolarHBondContact CA-OG1 3.43Å; V158-T161 PolarHBondContact O-N 2.93Å; V158-T161 PolarHBondContact O-OG1 3.4Å; T161-N163 PolarHBondContact O-N 2.8Å; T161-I164 PolarHBondContact O-N 3.18Å; T161-T165 VanDerWaalsContact O-CB 3.29Å; T161-T165 WeakPolarHBondContact O-CB 3.28Å; T161-T165 WeakPolarHBondContact O-CG2 3.41Å; T161-T165 PolarHBondContact O-N 3.23Å; T161-T165 PolarHBondContact O-OG1 2.98Å
162A85.4Confident86.5Confident42 Ų4240.8 Ų40.835%0.34723%0.226SC..Hα-helixtrans-63.8-44-172.300000111.1V158 T165 A166V158-A162 WeakPolarHBondContact O-CB 3.21Å; V158-A162 PolarHBondContact O-N 3.26Å; A162-T165 WeakPolarHBondContact CA-OG1 3.33Å; A162-T165 PolarHBondContact O-OG1 3.34Å; A162-A166 WeakPolarHBondContact O-CB 3.5Å; A162-A166 PolarHBondContact O-N 3.32Å
163N88.6Confident86.8Confident60 Ų6041.6 Ų41.632%0.32123%0.232SC..Hα-helixtrans-63.7-48.8-179.6-69.5-6000111.3R159 T161 G167 V206R159-N163 WeakPolarHBondContact O-CB 3.23Å; R159-N163 VanDerWaalsContact O-CG 3.28Å; R159-N163 PolarHBondContact O-N 3.24Å; T161-N163 PolarHBondContact O-N 2.8Å; N163-G167 PolarHBondContact O-N 3.37Å; N163-V206 HydrophobicContact CB-CG1 4.06Å
164I85.6Confident87.4Confident6 Ų642.7 Ų42.73%0.03124%0.238CC..Hα-helixtrans-70.9-40.3-176.5-59.1171.9000111.4N83 T93 T95 T96 L160 T161 H168N83-I164 HydrophobicContact CB-CD1 4.33Å; N83-I164 VanDerWaalsContact CG-CD1 3.44Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.01Å; T93-I164 HydrophobicContact CG2-CG2 4.23Å; T95-I164 VanDerWaalsContact OG1-CD1 3.31Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.47Å; T96-I164 HydrophobicContact CG2-CB 4.38Å; T96-I164 HydrophobicContact CG2-CG2 3.68Å; L160-I164 HydrophobicContact CD1-CD1 3.78Å; L160-I164 HydrophobicContact CG-CD1 4.22Å; L160-I164 WeakPolarHBondContact O-CG1 3.07Å; L160-I164 PolarHBondContact O-N 3.22Å; T161-I164 PolarHBondContact O-N 3.18Å; I164-H168 WeakPolarHBondContact O-CB 3.32Å; I164-H168 PolarHBondContact O-CD2 3.27Å; I164-H168 PolarHBondContact O-N 2.7Å
165T88.6Confident87.6Confident38 Ų3840.2 Ų40.223%0.23323%0.231CC..Hα-helixtrans-66.3-46.8177.152.50000111.7F9 T96 T161 A162 H168 L169F9-T165 HydrophobicContact CD1-CG2 4.41Å; F9-T165 HydrophobicContact CE1-CG2 4.11Å; T96-T165 HydrophobicContact CG2-CG2 3.74Å; T161-T165 VanDerWaalsContact O-CB 3.29Å; T161-T165 WeakPolarHBondContact O-CB 3.28Å; T161-T165 WeakPolarHBondContact O-CG2 3.41Å; T161-T165 PolarHBondContact O-N 3.23Å; T161-T165 PolarHBondContact O-OG1 2.98Å; A162-T165 WeakPolarHBondContact CA-OG1 3.33Å; A162-T165 PolarHBondContact O-OG1 3.34Å; T165-H168 PolarHBondContact O-N 3.09Å; T165-L169 WeakPolarHBondContact O-CB 3.25Å; T165-L169 WeakPolarHBondContact O-CG 3.4Å; T165-L169 PolarHBondContact O-N 3.06Å
166A87.9Confident87.8Confident54 Ų5441 Ų4145%0.44623%0.234SC..Hα-helixtrans-64.3-42.9178.700000111.4A162 L169 L170A162-A166 WeakPolarHBondContact O-CB 3.5Å; A162-A166 PolarHBondContact O-N 3.32Å; A166-L169 PolarHBondContact O-N 3.32Å; A166-L170 VanDerWaalsContact O-CB 3.28Å; A166-L170 WeakPolarHBondContact O-CB 2.97Å; A166-L170 PolarHBondContact O-N 3.26Å
167G88.6Confident88.1Confident6 Ų642.6 Ų42.66%0.06225%0.248CC..Hα-helixtrans-59.1-48.1176.500000112.7N163 L170 M171 E203N163-G167 PolarHBondContact O-N 3.37Å; G167-L170 PolarHBondContact O-N 3.03Å; G167-M171 WeakPolarHBondContact O-CG 3.38Å; G167-M171 PolarHBondContact O-N 3.27Å; G167-E203 WeakPolarHBondContact CA-OE2 3.34Å
168H88.5Confident88.4Confident31 Ų3143.5 Ų43.514%0.14425%0.253CS..Hα-helixtrans-62.5-42.9175.6-91.7-91.1000113.4F9 G86 I164 T165 L170 M171 H172F9-H168 HydrophobicContact CE1-CB 4.1Å; F9-H168 HydrophobicContact CZ-CB 3.81Å; G86-H168 PolarHBondContact O-CE1 3.09Å; G86-H168 PolarHBondContact O-NE2 3.07Å; I164-H168 WeakPolarHBondContact O-CB 3.32Å; I164-H168 PolarHBondContact O-CD2 3.27Å; I164-H168 PolarHBondContact O-N 2.7Å; T165-H168 PolarHBondContact O-N 3.09Å; H168-L170 VanDerWaalsContact C-N 3.33Å; H168-L170 PolarHBondContact O-N 3.37Å; H168-M171 PolarHBondContact O-N 3.46Å; H168-H172 PolarHBondContact O-N 2.73Å
169L88.8Confident88.5Confident42 Ų4246.7 Ų46.722%0.2227%0.268CS..Hα-helixtrans-61.9-42.9175.6-77.7169.9000111.4F6 F9 T165 A166 H172 L173F6-L169 HydrophobicContact CD1-CD2 4.36Å; F6-L169 HydrophobicContact CE1-CD1 4.09Å; F6-L169 HydrophobicContact CE1-CD2 3.99Å; F6-L169 HydrophobicContact CZ-CD2 4.42Å; F9-L169 HydrophobicContact CE2-CD1 4.46Å; F9-L169 HydrophobicContact CE2-CD2 3.68Å; F9-L169 HydrophobicContact CE2-CG 3.77Å; F9-L169 HydrophobicContact CZ-CD2 4.32Å; F9-L169 HydrophobicContact CZ-CG 3.93Å; T165-L169 WeakPolarHBondContact O-CB 3.25Å; T165-L169 WeakPolarHBondContact O-CG 3.4Å; T165-L169 PolarHBondContact O-N 3.06Å; A166-L169 PolarHBondContact O-N 3.32Å; L169-H172 PolarHBondContact O-N 2.95Å; L169-L173 WeakPolarHBondContact O-CG 3.24Å; L169-L173 PolarHBondContact O-N 3Å
170L90.6Very high88.5Confident81 Ų8144.2 Ų44.242%0.42427%0.269SS..Hα-helixtrans-67.4-42.4-179.2-154.3157000110.9A166 G167 H168 H172 L173 I174 L199A166-L170 VanDerWaalsContact O-CB 3.28Å; A166-L170 WeakPolarHBondContact O-CB 2.97Å; A166-L170 PolarHBondContact O-N 3.26Å; G167-L170 PolarHBondContact O-N 3.03Å; H168-L170 VanDerWaalsContact C-N 3.33Å; H168-L170 PolarHBondContact O-N 3.37Å; L170-H172 VanDerWaalsContact C-N 3.32Å; L170-H172 PolarHBondContact O-N 2.94Å; L170-L173 PolarHBondContact O-N 3.06Å; L170-I174 HydrophobicContact CD2-CD1 3.41Å; L170-I174 VanDerWaalsContact CD2-CD1 3.41Å; L170-I174 HydrophobicContact CD2-CG1 3.98Å; L170-I174 WeakPolarHBondContact O-CG1 3.13Å; L170-I174 PolarHBondContact O-N 2.95Å; L170-L199 HydrophobicContact CB-CD2 4.33Å; L170-L199 HydrophobicContact CD2-CD1 3.65Å; L170-L199 HydrophobicContact CD2-CD2 3.29Å; L170-L199 HydrophobicContact CD2-CG 4.09Å; L170-L199 HydrophobicContact CG-CD2 4.39Å
171M90.7Very high88.8Confident31 Ų3147.2 Ų47.215%0.15328%0.284CS..Hα-helixtrans-57.9-43.6171.9-76.2-172-67.600111.8L87 G167 H168 G175 L199 T200 E203L87-M171 HydrophobicContact CD2-CE 4Å; G167-M171 WeakPolarHBondContact O-CG 3.38Å; G167-M171 PolarHBondContact O-N 3.27Å; H168-M171 PolarHBondContact O-N 3.46Å; M171-G175 PolarHBondContact O-N 3.34Å; M171-L199 HydrophobicContact CB-CD2 4.26Å; M171-L199 HydrophobicContact CG-CD2 3.51Å; M171-L199 HydrophobicContact CG-CG 4.24Å; M171-T200 HydrophobicContact SD-CG2 3.9Å; M171-E203 HydrophobicContact CE-CG 4.17Å
172H89.5Confident88.8Confident87 Ų8749.5 Ų49.540%0.40330%0.301SS..Hα-helixtrans-68-41.7178.8-169.3-60.6000112.3L5 H168 L169 L170 G175 S176L5-H172 VanDerWaalsContact CD2-CE1 3.4Å; L5-H172 WeakPolarHBondContact CD2-CE1 3.27Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.34Å; H168-H172 PolarHBondContact O-N 2.73Å; L169-H172 PolarHBondContact O-N 2.95Å; L170-H172 VanDerWaalsContact C-N 3.32Å; L170-H172 PolarHBondContact O-N 2.94Å; H172-G175 PolarHBondContact O-N 2.89Å; H172-S176 WeakPolarHBondContact O-CB 3.45Å; H172-S176 PolarHBondContact O-N 2.99Å; H172-S176 PolarHBondContact O-OG 2.86Å
173L90.3Very high88.9Confident89 Ų8953.4 Ų53.447%0.46632%0.32SS..Hα-helixtrans-63.5-48178.4-73.7171.8000111.2L5 L169 L170 G175 S176 A177L5-L173 HydrophobicContact CD1-CD2 4.12Å; L5-L173 HydrophobicContact CD2-CD2 4.35Å; L169-L173 WeakPolarHBondContact O-CG 3.24Å; L169-L173 PolarHBondContact O-N 3Å; L170-L173 PolarHBondContact O-N 3.06Å; L173-G175 VanDerWaalsContact C-N 3.34Å; L173-G175 PolarHBondContact O-N 2.98Å; L173-S176 PolarHBondContact O-N 3.47Å; L173-S176 PolarHBondContact O-OG 3.34Å; L173-A177 PolarHBondContact O-N 2.84Å
174I91.4Very high88.9Confident31 Ų3155.6 Ų55.616%0.15933%0.331CS..Hα-helixtrans-64.4-40.9176.4-64.8-173.1000110.6L170 S176 A177 T178 I192 I195 L196 L199L170-I174 HydrophobicContact CD2-CD1 3.41Å; L170-I174 VanDerWaalsContact CD2-CD1 3.41Å; L170-I174 HydrophobicContact CD2-CG1 3.98Å; L170-I174 WeakPolarHBondContact O-CG1 3.13Å; L170-I174 PolarHBondContact O-N 2.95Å; I174-S176 VanDerWaalsContact C-N 3.32Å; I174-S176 PolarHBondContact O-N 2.91Å; I174-A177 WeakPolarHBondContact O-CB 3.45Å; I174-A177 PolarHBondContact O-N 3.46Å; I174-A177 VanDerWaalsContact O-N 3.14Å; I174-T178 HydrophobicContact CG2-CG2 4.38Å; I174-T178 WeakPolarHBondContact O-CG2 3.31Å; I174-T178 PolarHBondContact O-N 3.5Å; I174-T178 PolarHBondContact O-OG1 2.96Å; I174-I192 HydrophobicContact CG2-CG2 3.81Å; I174-I195 HydrophobicContact CD1-CG2 4.02Å; I174-L196 HydrophobicContact CB-CD1 4.19Å; I174-L196 HydrophobicContact CG2-CB 3.91Å; I174-L196 HydrophobicContact CG2-CD1 3.97Å; I174-L196 HydrophobicContact CG2-CG 4.49Å; I174-L199 HydrophobicContact CD1-CD2 4.21Å
175G90.2Very high89Confident23 Ų2359.8 Ų59.824%0.23735%0.353CS..Hα-helixtrans-61.3-37175.100000113.6M171 H172 L173 T178 L179M171-G175 PolarHBondContact O-N 3.34Å; H172-G175 PolarHBondContact O-N 2.89Å; L173-G175 VanDerWaalsContact C-N 3.34Å; L173-G175 PolarHBondContact O-N 2.98Å; G175-T178 PolarHBondContact O-OG1 3.43Å; G175-L179 PolarHBondContact O-N 3.27Å
176S88.8Confident88.9Confident58 Ų5865 Ų6541%0.40638%0.379SS..Hα-helixtrans-70.4-35.4173.771.50000112.2H172 L173 I174 L179 A180H172-S176 WeakPolarHBondContact O-CB 3.45Å; H172-S176 PolarHBondContact O-N 2.99Å; H172-S176 PolarHBondContact O-OG 2.86Å; L173-S176 PolarHBondContact O-N 3.47Å; L173-S176 PolarHBondContact O-OG 3.34Å; I174-S176 VanDerWaalsContact C-N 3.32Å; I174-S176 PolarHBondContact O-N 2.91Å; S176-L179 PolarHBondContact O-N 3.5Å; S176-A180 WeakPolarHBondContact O-CB 3.3Å; S176-A180 PolarHBondContact O-N 3.3Å
177A88.5Confident89Confident38 Ų3866.9 Ų66.931%0.31439%0.386SS..Hα-helixtrans-69.2-41176.100000112L173 I174 L179 A180 M181L173-A177 PolarHBondContact O-N 2.84Å; I174-A177 WeakPolarHBondContact O-CB 3.45Å; I174-A177 PolarHBondContact O-N 3.46Å; I174-A177 VanDerWaalsContact O-N 3.14Å; A177-L179 VanDerWaalsContact C-N 3.3Å; A177-L179 PolarHBondContact O-N 3.31Å; A177-A180 PolarHBondContact O-N 3.34Å; A177-M181 WeakPolarHBondContact O-CB 3.32Å; A177-M181 WeakPolarHBondContact O-CG 3.43Å; A177-M181 PolarHBondContact O-N 3.31Å
178T90.5Very high88.9Confident19 Ų1968.4 Ų68.412%0.11740%0.396CS..Hα-helixtrans-60.7-42.4174.156.40000110.9I174 G175 M181 S182 I192I174-T178 HydrophobicContact CG2-CG2 4.38Å; I174-T178 WeakPolarHBondContact O-CG2 3.31Å; I174-T178 PolarHBondContact O-N 3.5Å; I174-T178 PolarHBondContact O-OG1 2.96Å; G175-T178 PolarHBondContact O-OG1 3.43Å; T178-M181 PolarHBondContact O-N 2.89Å; T178-S182 WeakPolarHBondContact O-CB 3.4Å; T178-S182 PolarHBondContact O-N 3.42Å; T178-I192 HydrophobicContact CG2-CB 3.88Å; T178-I192 HydrophobicContact CG2-CG2 3.37Å
179L89.6Confident89.1Confident129 Ų12968 Ų6868%0.67540%0.396SS*.Hα-helixtrans-66.2-42.3179.2-163.3137.3000111.7G175 S176 A177 S182G175-L179 PolarHBondContact O-N 3.27Å; S176-L179 PolarHBondContact O-N 3.5Å; A177-L179 VanDerWaalsContact C-N 3.3Å; A177-L179 PolarHBondContact O-N 3.31Å; L179-S182 WeakPolarHBondContact O-CB 3.42Å; L179-S182 PolarHBondContact O-N 3.37Å; L179-S182 PolarHBondContact O-OG 3.35Å
180A88.6Confident89.2Confident49 Ų4971.8 Ų71.841%0.40542%0.416SS..Hα-helixtrans-67-35.2175.200000113.4S176 A177 T183S176-A180 WeakPolarHBondContact O-CB 3.3Å; S176-A180 PolarHBondContact O-N 3.3Å; A177-A180 PolarHBondContact O-N 3.34Å; A180-T183 PolarHBondContact O-OG1 3.35Å
181M87.5Confident89.3Confident63 Ų6373 Ų7331%0.3142%0.421SS..Hα-helixtrans-76.9-24.1178.5-69.1-64.6113.200112.9A177 T178 T183 I184 N185 T189 I192A177-M181 WeakPolarHBondContact O-CB 3.32Å; A177-M181 WeakPolarHBondContact O-CG 3.43Å; A177-M181 PolarHBondContact O-N 3.31Å; T178-M181 PolarHBondContact O-N 2.89Å; M181-T183 PolarHBondContact O-N 3.04Å; M181-I184 HydrophobicContact CE-CD1 3.64Å; M181-I184 PolarHBondContact O-N 3.01Å; M181-I184 HydrophobicContact SD-CD1 4.24Å; M181-N185 PolarHBondContact O-N 3.46Å; M181-N185 VanDerWaalsContact O-N 3.07Å; M181-T189 PolarHBondContact O-OG1 3.27Å; M181-T189 VanDerWaalsContact O-OG1 3.09Å; M181-I192 HydrophobicContact CB-CD1 4.2Å; M181-I192 HydrophobicContact CG-CD1 3.66Å
182S87.3Confident89.5Confident63 Ų6373.4 Ų73.444%0.44142%0.424SS..Hα-helixtrans-58.6-30.5179.375.70000112.9T178 L179 T189T178-S182 WeakPolarHBondContact O-CB 3.4Å; T178-S182 PolarHBondContact O-N 3.42Å; L179-S182 WeakPolarHBondContact O-CB 3.42Å; L179-S182 PolarHBondContact O-N 3.37Å; L179-S182 PolarHBondContact O-OG 3.35Å; S182-T189 WeakPolarHBondContact CA-OG1 3.41Å; S182-T189 PolarHBondContact N-OG1 3.07Å
183T87.3Confident89.6Confident123 Ų12374.5 Ų74.576%0.75543%0.428SS*.THydrogen-bonded Turntrans-82.8-16.4178.257.50000113.5A180 M181A180-T183 PolarHBondContact O-OG1 3.35Å; M181-T183 PolarHBondContact O-N 3.04Å
184I87.6Confident89.8Confident106 Ų10673.9 Ų73.954%0.54443%0.428SS..THydrogen-bonded Turntrans-98.6-59.4-174.1-58.3171.5000110.3M181M181-I184 HydrophobicContact CE-CD1 3.64Å; M181-I184 PolarHBondContact O-N 3.01Å; M181-I184 HydrophobicContact SD-CD1 4.24Å
185N88.6Confident89.9Confident94 Ų9476.4 Ų76.450%0.50344%0.441SS..  trans-147.8124.7-173.5-85.9-21.2000111.6M181 S188 T189M181-N185 PolarHBondContact O-N 3.46Å; M181-N185 VanDerWaalsContact O-N 3.07Å; N185-S188 VanDerWaalsContact CB-OG 3.25Å; N185-S188 WeakPolarHBondContact CB-OG 3.49Å; N185-S188 PolarHBondContact O-OG 2.88Å; N185-T189 PolarHBondContact O-N 3.39Å; N185-T189 PolarHBondContact O-OG1 3.31Å
186L87Confident90.1Very high147 Ų14776.8 Ų76.877%0.7744%0.437SS*.Hα-helixtrans-62.9-45178-154.888.8000114.2S188 T189 L190L186-S188 PolarHBondContact O-N 2.99Å; L186-T189 WeakPolarHBondContact O-CB 3.45Å; L186-T189 PolarHBondContact O-N 2.98Å; L186-L190 PolarHBondContact O-N 2.61Å
187P88.9Confident90.3Very high94 Ų9477.7 Ų77.761%0.6144%0.437SS*.Hα-helixtrans-69.3-37.3-174.525.1-32.9000112.9T189 L190 I191P187-T189 VanDerWaalsContact C-N 3.32Å; P187-T189 PolarHBondContact O-N 2.92Å; P187-L190 PolarHBondContact O-N 2.98Å; P187-I191 PolarHBondContact O-N 2.87Å
188S87.6Confident90.6Very high38 Ų3881.6 Ų81.627%0.26645%0.452SS..Hα-helixtrans-66.6-34.8174.451.70000112.1N185 L186 L190 I191 I192N185-S188 VanDerWaalsContact CB-OG 3.25Å; N185-S188 WeakPolarHBondContact CB-OG 3.49Å; N185-S188 PolarHBondContact O-OG 2.88Å; L186-S188 PolarHBondContact O-N 2.99Å; S188-L190 VanDerWaalsContact C-N 3.32Å; S188-L190 PolarHBondContact O-N 2.96Å; S188-I191 PolarHBondContact O-N 3.3Å; S188-I192 WeakPolarHBondContact O-CG1 3.5Å; S188-I192 PolarHBondContact O-N 3.37Å; S188-I192 VanDerWaalsContact O-N 3.16Å
189T91.9Very high90.7Very high24 Ų2481.8 Ų81.815%0.14745%0.452CS..Hα-helixtrans-61.6-41.5175.2-590000111.4M181 S182 N185 L186 P187 I191 I192 F193M181-T189 PolarHBondContact O-OG1 3.27Å; M181-T189 VanDerWaalsContact O-OG1 3.09Å; S182-T189 WeakPolarHBondContact CA-OG1 3.41Å; S182-T189 PolarHBondContact N-OG1 3.07Å; N185-T189 PolarHBondContact O-N 3.39Å; N185-T189 PolarHBondContact O-OG1 3.31Å; L186-T189 WeakPolarHBondContact O-CB 3.45Å; L186-T189 PolarHBondContact O-N 2.98Å; P187-T189 VanDerWaalsContact C-N 3.32Å; P187-T189 PolarHBondContact O-N 2.92Å; T189-I191 VanDerWaalsContact C-N 3.3Å; T189-I191 PolarHBondContact O-N 3.4Å; T189-I192 PolarHBondContact O-N 2.98Å; T189-F193 VanDerWaalsContact O-CB 3.3Å; T189-F193 WeakPolarHBondContact O-CB 3.43Å; T189-F193 PolarHBondContact O-N 3.14Å
190L91.3Very high90.8Very high120 Ų12078.1 Ų78.163%0.62844%0.435SS*.Hα-helixtrans-59.9-41.7177.7-15891.2000111.6L186 P187 S188 F193 T194L186-L190 PolarHBondContact O-N 2.61Å; P187-L190 PolarHBondContact O-N 2.98Å; S188-L190 VanDerWaalsContact C-N 3.32Å; S188-L190 PolarHBondContact O-N 2.96Å; L190-F193 PolarHBondContact O-N 2.98Å; L190-T194 WeakPolarHBondContact O-CG2 3.24Å; L190-T194 PolarHBondContact O-N 3.34Å
191I93Very high91.1Very high106 Ų10680.7 Ų80.754%0.54444%0.441SS..Hα-helixtrans-64.9-44.4179.1-62.4166.7000111.2P187 S188 T189 F193 T194 I195P187-I191 PolarHBondContact O-N 2.87Å; S188-I191 PolarHBondContact O-N 3.3Å; T189-I191 VanDerWaalsContact C-N 3.3Å; T189-I191 PolarHBondContact O-N 3.4Å; I191-F193 VanDerWaalsContact C-N 3.3Å; I191-F193 PolarHBondContact O-N 2.75Å; I191-T194 PolarHBondContact O-N 3.45Å; I191-T194 PolarHBondContact O-OG1 3.22Å; I191-I195 HydrophobicContact CG2-CD1 4.38Å; I191-I195 WeakPolarHBondContact O-CG1 3.35Å; I191-I195 PolarHBondContact O-N 3.45Å
192I93Very high91.3Very high40 Ų4082.3 Ų82.321%0.20545%0.45CS..Hα-helixtrans-70.4-33.7179.5-56.9167.7000110.2I174 T178 M181 S188 T189 I195 L196I174-I192 HydrophobicContact CG2-CG2 3.81Å; T178-I192 HydrophobicContact CG2-CB 3.88Å; T178-I192 HydrophobicContact CG2-CG2 3.37Å; M181-I192 HydrophobicContact CB-CD1 4.2Å; M181-I192 HydrophobicContact CG-CD1 3.66Å; S188-I192 WeakPolarHBondContact O-CG1 3.5Å; S188-I192 PolarHBondContact O-N 3.37Å; S188-I192 VanDerWaalsContact O-N 3.16Å; T189-I192 PolarHBondContact O-N 2.98Å; I192-I195 WeakPolarHBondContact O-CB 3.27Å; I192-I195 PolarHBondContact O-N 3.39Å; I192-L196 PolarHBondContact O-N 2.95Å
193F92.6Very high91.5Very high110 Ų11080 Ų8048%0.48243%0.432SS..Hα-helixtrans-65.7-39.2175.3-173.8-106000112.7T189 L190 I191 I195 L196 I197T189-F193 VanDerWaalsContact O-CB 3.3Å; T189-F193 WeakPolarHBondContact O-CB 3.43Å; T189-F193 PolarHBondContact O-N 3.14Å; L190-F193 PolarHBondContact O-N 2.98Å; I191-F193 VanDerWaalsContact C-N 3.3Å; I191-F193 PolarHBondContact O-N 2.75Å; F193-I195 VanDerWaalsContact C-N 3.32Å; F193-I195 PolarHBondContact O-N 3.41Å; F193-L196 HydrophobicContact CD2-CD2 4.47Å; F193-L196 WeakPolarHBondContact O-CB 3.43Å; F193-L196 PolarHBondContact O-N 2.88Å; F193-I197 HydrophobicContact CD1-CD1 3.85Å; F193-I197 HydrophobicContact CE1-CD1 3.49Å; F193-I197 VanDerWaalsContact CE1-CD1 3.49Å; F193-I197 HydrophobicContact CE1-CG1 4.26Å; F193-I197 HydrophobicContact CZ-CD1 4.1Å; F193-I197 HydrophobicContact CZ-CG1 4.45Å; F193-I197 PolarHBondContact O-N 3.21Å
194T93.8Very high91.7Very high76 Ų7678 Ų7847%0.46642%0.417SS..Hα-helixtrans-64.8-37.2173.656.90000111.8L190 I191 L196 I197 L198L190-T194 WeakPolarHBondContact O-CG2 3.24Å; L190-T194 PolarHBondContact O-N 3.34Å; I191-T194 PolarHBondContact O-N 3.45Å; I191-T194 PolarHBondContact O-OG1 3.22Å; T194-L196 VanDerWaalsContact C-N 3.35Å; T194-I197 PolarHBondContact O-N 3.48Å; T194-L198 PolarHBondContact O-N 2.99Å
195I94.6Very high91.9Very high84 Ų8475.2 Ų75.243%0.43141%0.409SS..Hα-helixtrans-61.8-42.6172.8-65.1166.8000111I174 I191 I192 F193 I197 L198 L199I174-I195 HydrophobicContact CD1-CG2 4.02Å; I191-I195 HydrophobicContact CG2-CD1 4.38Å; I191-I195 WeakPolarHBondContact O-CG1 3.35Å; I191-I195 PolarHBondContact O-N 3.45Å; I192-I195 WeakPolarHBondContact O-CB 3.27Å; I192-I195 PolarHBondContact O-N 3.39Å; F193-I195 VanDerWaalsContact C-N 3.32Å; F193-I195 PolarHBondContact O-N 3.41Å; I195-I197 PolarHBondContact O-N 3.38Å; I195-L198 PolarHBondContact O-N 3.26Å; I195-L199 WeakPolarHBondContact O-CB 3.25Å; I195-L199 PolarHBondContact O-N 2.88Å
196L93.6Very high92Very high32 Ų3272.5 Ų72.517%0.16840%0.396CS..Hα-helixtrans-59.7-45.4176.4-177.366.4000111.5I174 I192 F193 T194 L198 L199 T200I174-L196 HydrophobicContact CB-CD1 4.19Å; I174-L196 HydrophobicContact CG2-CB 3.91Å; I174-L196 HydrophobicContact CG2-CD1 3.97Å; I174-L196 HydrophobicContact CG2-CG 4.49Å; I192-L196 PolarHBondContact O-N 2.95Å; F193-L196 HydrophobicContact CD2-CD2 4.47Å; F193-L196 WeakPolarHBondContact O-CB 3.43Å; F193-L196 PolarHBondContact O-N 2.88Å; T194-L196 VanDerWaalsContact C-N 3.35Å; L196-L198 PolarHBondContact O-N 2.82Å; L196-L199 WeakPolarHBondContact O-CB 3.45Å; L196-L199 PolarHBondContact O-N 3.5Å; L196-T200 WeakPolarHBondContact O-CG2 3.26Å; L196-T200 PolarHBondContact O-N 3.35Å
197I93.3Very high92.2Very high77 Ų7765.7 Ų65.740%0.39536%0.361SS..Hα-helixtrans-59.8-47.8176.2-67.9165.8000110.5F193 T194 I195 L199 T200 I201F193-I197 HydrophobicContact CD1-CD1 3.85Å; F193-I197 HydrophobicContact CE1-CD1 3.49Å; F193-I197 VanDerWaalsContact CE1-CD1 3.49Å; F193-I197 HydrophobicContact CE1-CG1 4.26Å; F193-I197 HydrophobicContact CZ-CD1 4.1Å; F193-I197 HydrophobicContact CZ-CG1 4.45Å; F193-I197 PolarHBondContact O-N 3.21Å; T194-I197 PolarHBondContact O-N 3.48Å; I195-I197 PolarHBondContact O-N 3.38Å; I197-L199 VanDerWaalsContact C-N 3.27Å; I197-L199 PolarHBondContact O-N 2.83Å; I197-T200 PolarHBondContact O-N 2.99Å; I197-T200 VanDerWaalsContact O-N 3.15Å; I197-T200 PolarHBondContact O-OG1 2.99Å; I197-I201 HydrophobicContact CG2-CD1 4.11Å; I197-I201 WeakPolarHBondContact O-CG1 3.4Å; I197-I201 PolarHBondContact O-N 3.38Å; I197-I201 VanDerWaalsContact O-N 3.12Å
198L95.1Very high92.2Very high119 Ų11966.6 Ų66.662%0.62336%0.36SS*.Hα-helixtrans-59.6-40.7179.3-175.563.8000111.7T194 I195 L196 I201 L202T194-L198 PolarHBondContact O-N 2.99Å; I195-L198 PolarHBondContact O-N 3.26Å; L196-L198 PolarHBondContact O-N 2.82Å; L198-I201 PolarHBondContact O-N 2.88Å; L198-L202 PolarHBondContact O-N 3.18Å
199L93.7Very high92.4Very high24 Ų2469.4 Ų69.413%0.12637%0.371CS..Hα-helixtrans-62.6-43.1175.9-174.676.9000112L170 M171 I174 I195 L196 I197 I201 L202 E203L170-L199 HydrophobicContact CB-CD2 4.33Å; L170-L199 HydrophobicContact CD2-CD1 3.65Å; L170-L199 HydrophobicContact CD2-CD2 3.29Å; L170-L199 HydrophobicContact CD2-CG 4.09Å; L170-L199 HydrophobicContact CG-CD2 4.39Å; M171-L199 HydrophobicContact CB-CD2 4.26Å; M171-L199 HydrophobicContact CG-CD2 3.51Å; M171-L199 HydrophobicContact CG-CG 4.24Å; I174-L199 HydrophobicContact CD1-CD2 4.21Å; I195-L199 WeakPolarHBondContact O-CB 3.25Å; I195-L199 PolarHBondContact O-N 2.88Å; L196-L199 WeakPolarHBondContact O-CB 3.45Å; L196-L199 PolarHBondContact O-N 3.5Å; I197-L199 VanDerWaalsContact C-N 3.27Å; I197-L199 PolarHBondContact O-N 2.83Å; L199-I201 VanDerWaalsContact C-N 3.29Å; L199-I201 PolarHBondContact O-N 3.05Å; L199-L202 HydrophobicContact CD1-CD2 4.5Å; L199-L202 WeakPolarHBondContact O-CB 3.38Å; L199-L202 PolarHBondContact O-N 3.45Å; L199-E203 PolarHBondContact O-N 3.43Å
200T91.7Very high92.2Very high52 Ų5268.7 Ų68.732%0.31937%0.366SS..Hα-helixtrans-62-38.2177.760.60000112.1M171 L196 I197 E203 I204M171-T200 HydrophobicContact SD-CG2 3.9Å; L196-T200 WeakPolarHBondContact O-CG2 3.26Å; L196-T200 PolarHBondContact O-N 3.35Å; I197-T200 PolarHBondContact O-N 2.99Å; I197-T200 VanDerWaalsContact O-N 3.15Å; I197-T200 PolarHBondContact O-OG1 2.99Å; T200-E203 PolarHBondContact O-N 3.15Å; T200-I204 VanDerWaalsContact O-CG1 3.28Å; T200-I204 WeakPolarHBondContact O-CG1 3.35Å; T200-I204 PolarHBondContact O-N 3.11Å
201I93.1Very high92.2Very high102 Ų10263 Ų6352%0.52334%0.336SS..Hα-helixtrans-64.9-43.3175.6-64.9167.7000110.4I197 L198 L199 E203 I204 A205I197-I201 HydrophobicContact CG2-CD1 4.11Å; I197-I201 WeakPolarHBondContact O-CG1 3.4Å; I197-I201 PolarHBondContact O-N 3.38Å; I197-I201 VanDerWaalsContact O-N 3.12Å; L198-I201 PolarHBondContact O-N 2.88Å; L199-I201 VanDerWaalsContact C-N 3.29Å; L199-I201 PolarHBondContact O-N 3.05Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 3.34Å; I201-I204 PolarHBondContact O-N 3.16Å; I201-A205 PolarHBondContact O-N 3.01Å; I201-A205 VanDerWaalsContact O-N 3.16Å
202L92.3Very high92.1Very high98 Ų9863 Ų6351%0.51333%0.33SS..Hα-helixtrans-59.4-45.7175.7179.467.7000111L198 L199 I204 A205 V206L198-L202 PolarHBondContact O-N 3.18Å; L199-L202 HydrophobicContact CD1-CD2 4.5Å; L199-L202 WeakPolarHBondContact O-CB 3.38Å; L199-L202 PolarHBondContact O-N 3.45Å; L202-I204 PolarHBondContact O-N 3.48Å; L202-A205 WeakPolarHBondContact O-CB 3.45Å; L202-A205 PolarHBondContact O-N 2.8Å; L202-A205 VanDerWaalsContact O-N 3.11Å; L202-V206 HydrophobicContact CD1-CG2 4.38Å; L202-V206 HydrophobicContact CG-CG2 4.34Å; L202-V206 WeakPolarHBondContact O-CG2 3.46Å; L202-V206 PolarHBondContact O-N 3.26Å
203E91.1Very high91.9Very high13 Ų1363.1 Ų63.16%0.06133%0.332CS..Hα-helixtrans-66.6-37.4-177.1-161.465.5-160.100112L87 G167 M171 L199 T200 I201 A205 V206 A207L87-E203 HydrophobicContact CD1-CG 4.43Å; L87-E203 HydrophobicContact CD2-CB 4.18Å; L87-E203 HydrophobicContact CD2-CG 3.39Å; G167-E203 WeakPolarHBondContact CA-OE2 3.34Å; M171-E203 HydrophobicContact CE-CG 4.17Å; L199-E203 PolarHBondContact O-N 3.43Å; T200-E203 PolarHBondContact O-N 3.15Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 3.34Å; E203-A205 VanDerWaalsContact C-N 3.3Å; E203-A205 PolarHBondContact O-N 3.28Å; E203-V206 PolarHBondContact O-N 2.91Å; E203-A207 VanDerWaalsContact O-CB 3.3Å; E203-A207 WeakPolarHBondContact O-CB 3.5Å; E203-A207 PolarHBondContact O-N 3.36Å
204I91.3Very high91.7Very high83 Ų8357.9 Ų57.943%0.42631%0.31SS..Hα-helixtrans-59.3-43171.8-67.5164.8000110.6L87 T200 I201 L202 L208L87-I204 HydrophobicContact CD1-CB 4.2Å; L87-I204 HydrophobicContact CD1-CG1 3.62Å; T200-I204 VanDerWaalsContact O-CG1 3.28Å; T200-I204 WeakPolarHBondContact O-CG1 3.35Å; T200-I204 PolarHBondContact O-N 3.11Å; I201-I204 PolarHBondContact O-N 3.16Å; L202-I204 PolarHBondContact O-N 3.48Å; I204-L208 PolarHBondContact O-N 2.93Å
205A92.3Very high91.5Very high46 Ų4654.3 Ų54.338%0.3829%0.287SS..Hα-helixtrans-65.7-45.5177.200000111.7I201 L202 E203 A207 L208 I209I201-A205 PolarHBondContact O-N 3.01Å; I201-A205 VanDerWaalsContact O-N 3.16Å; L202-A205 WeakPolarHBondContact O-CB 3.45Å; L202-A205 PolarHBondContact O-N 2.8Å; L202-A205 VanDerWaalsContact O-N 3.11Å; E203-A205 VanDerWaalsContact C-N 3.3Å; E203-A205 PolarHBondContact O-N 3.28Å; A205-A207 VanDerWaalsContact C-N 3.35Å; A205-A207 PolarHBondContact O-N 2.96Å; A205-L208 PolarHBondContact O-N 3.07Å; A205-I209 WeakPolarHBondContact O-CB 3.42Å; A205-I209 VanDerWaalsContact O-CG1 3.27Å; A205-I209 WeakPolarHBondContact O-CG1 3.28Å; A205-I209 PolarHBondContact O-N 3.1Å
206V91.9Very high91.2Very high38 Ų3853.1 Ų53.123%0.2328%0.282CS..Hα-helixtrans-61.3-42.6178172.90000111.1N163 L202 E203 L208 I209 Q210N163-V206 HydrophobicContact CB-CG1 4.06Å; L202-V206 HydrophobicContact CD1-CG2 4.38Å; L202-V206 HydrophobicContact CG-CG2 4.34Å; L202-V206 WeakPolarHBondContact O-CG2 3.46Å; L202-V206 PolarHBondContact O-N 3.26Å; E203-V206 PolarHBondContact O-N 2.91Å; V206-L208 VanDerWaalsContact C-N 3.31Å; V206-L208 PolarHBondContact O-N 3.1Å; V206-I209 PolarHBondContact O-N 2.92Å; V206-Q210 WeakPolarHBondContact O-CB 3.44Å; V206-Q210 PolarHBondContact O-N 2.99Å
207A89.7Confident90.9Very high4 Ų453.4 Ų53.43%0.03328%0.283CS..Hα-helixtrans-57.3-41.5178.200000112.9N83 L87 E203 A205 A211N83-A207 HydrophobicContact CB-CB 3.91Å; N83-A207 PolarHBondContact ND2-O 2.99Å; L87-A207 HydrophobicContact CD1-CB 4.05Å; E203-A207 VanDerWaalsContact O-CB 3.3Å; E203-A207 WeakPolarHBondContact O-CB 3.5Å; E203-A207 PolarHBondContact O-N 3.36Å; A205-A207 VanDerWaalsContact C-N 3.35Å; A205-A207 PolarHBondContact O-N 2.96Å; A207-A211 PolarHBondContact O-N 3.37Å
208L89.4Confident90.5Very high112 Ų11250 Ų5059%0.58627%0.266SS*.Hα-helixtrans-76.1-45.5179.1-168.7151.2000111.9I204 A205 V206 Q210 A211 Y212I204-L208 PolarHBondContact O-N 2.93Å; A205-L208 PolarHBondContact O-N 3.07Å; V206-L208 VanDerWaalsContact C-N 3.31Å; V206-L208 PolarHBondContact O-N 3.1Å; L208-Q210 VanDerWaalsContact C-N 3.26Å; L208-Q210 PolarHBondContact O-N 3.25Å; L208-A211 PolarHBondContact O-N 2.91Å; L208-Y212 PolarHBondContact O-N 2.65Å
209I91.2Very high90.2Very high97 Ų9744.9 Ų44.950%0.49724%0.24SC..Hα-helixtrans-60.2-40.6178.1-68.8166.7000110.4A205 V206 A211 Y212 V213A205-I209 WeakPolarHBondContact O-CB 3.42Å; A205-I209 VanDerWaalsContact O-CG1 3.27Å; A205-I209 WeakPolarHBondContact O-CG1 3.28Å; A205-I209 PolarHBondContact O-N 3.1Å; V206-I209 PolarHBondContact O-N 2.92Å; I209-A211 PolarHBondContact O-N 3.37Å; I209-Y212 WeakPolarHBondContact O-CB 3.48Å; I209-Y212 PolarHBondContact O-N 3.42Å; I209-Y212 VanDerWaalsContact O-N 3.16Å; I209-V213 HydrophobicContact CG2-CG2 4.05Å; I209-V213 WeakPolarHBondContact O-CG2 3.39Å; I209-V213 PolarHBondContact O-N 3.01Å
210Q89.4Confident89.7Confident10 Ų1047.5 Ų47.55%0.04725%0.254CS..Hα-helixtrans-67.5-36.9-177.5-174.263.96.800112.3R159 L160 V206 L208 Y212 F214R159-Q210 VanDerWaalsContact C-NE2 3.28Å; R159-Q210 VanDerWaalsContact CG-NE2 3.32Å; L160-Q210 VanDerWaalsContact CA-NE2 3.27Å; L160-Q210 HydrophobicContact CB-CG 4.29Å; L160-Q210 HydrophobicContact CD1-CB 4.34Å; L160-Q210 HydrophobicContact CD1-CG 3.37Å; L160-Q210 HydrophobicContact CG-CG 4.42Å; V206-Q210 WeakPolarHBondContact O-CB 3.44Å; V206-Q210 PolarHBondContact O-N 2.99Å; L208-Q210 VanDerWaalsContact C-N 3.26Å; L208-Q210 PolarHBondContact O-N 3.25Å; Q210-Y212 VanDerWaalsContact C-N 3.32Å; Q210-F214 VanDerWaalsContact O-CB 3.32Å; Q210-F214 WeakPolarHBondContact O-CB 3.47Å; Q210-F214 PolarHBondContact O-N 3.45Å
211A90.1Very high89.2Confident1 Ų145.9 Ų45.91%0.00824%0.242CC..Hα-helixtrans-62.7-40.5171.800000111.8I76 I79 A80 A207 L208 I209 T215I76-A211 HydrophobicContact CG1-CB 4.49Å; I79-A211 HydrophobicContact CB-CB 4.02Å; I79-A211 HydrophobicContact CG2-CB 3.75Å; A80-A211 HydrophobicContact CB-CB 3.92Å; A207-A211 PolarHBondContact O-N 3.37Å; L208-A211 PolarHBondContact O-N 2.91Å; I209-A211 PolarHBondContact O-N 3.37Å; A211-T215 WeakPolarHBondContact O-CG2 3.45Å; A211-T215 PolarHBondContact O-N 2.67Å; A211-T215 PolarHBondContact O-OG1 2.89Å
212Y90.3Very high88.7Confident106 Ų10641.1 Ų41.142%0.41622%0.217SC..Hα-helixtrans-66-48.9176175.5-101.9000112.5M57 I76 L208 I209 Q210 F214 T215 L216M57-Y212 HydrophobicContact CE-CD2 4.45Å; I76-Y212 HydrophobicContact CD1-CD2 4.24Å; L208-Y212 PolarHBondContact O-N 2.65Å; I209-Y212 WeakPolarHBondContact O-CB 3.48Å; I209-Y212 PolarHBondContact O-N 3.42Å; I209-Y212 VanDerWaalsContact O-N 3.16Å; Q210-Y212 VanDerWaalsContact C-N 3.32Å; Y212-F214 VanDerWaalsContact C-N 3.31Å; Y212-F214 PolarHBondContact O-N 2.98Å; Y212-T215 PolarHBondContact O-N 3.36Å; Y212-T215 PolarHBondContact O-OG1 3.48Å; Y212-L216 HydrophobicContact CE1-CD1 3.69Å; Y212-L216 HydrophobicContact CE2-CD1 4.37Å; Y212-L216 VanDerWaalsContact O-CB 3.26Å; Y212-L216 WeakPolarHBondContact O-CB 3.41Å; Y212-L216 PolarHBondContact O-N 2.96Å; Y212-L216 VanDerWaalsContact OH-CD1 3.32Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.35Å
213V90.3Very high88.2Confident41 Ų4140.4 Ų40.425%0.24821%0.211CC..Hα-helixtrans-62.9-38.6179.7172.20000111.3I209 L217I209-V213 HydrophobicContact CG2-CG2 4.05Å; I209-V213 WeakPolarHBondContact O-CG2 3.39Å; I209-V213 PolarHBondContact O-N 3.01Å; V213-L217 HydrophobicContact CG1-CD1 3.89Å; V213-L217 WeakPolarHBondContact O-CB 3.43Å; V213-L217 WeakPolarHBondContact O-CG 3.29Å; V213-L217 PolarHBondContact O-N 3.29Å
214F87.9Confident87.6Confident1 Ų143.2 Ų43.20%0.00423%0.227CC..Hα-helixtrans-57.7-52.7175.6-172.8-80.1000111.6L75 I79 A105 L108 L156 L160 Q210 Y212 L217 V218L75-F214 HydrophobicContact CD1-CE1 4.03Å; L75-F214 HydrophobicContact CD2-CD1 3.87Å; L75-F214 HydrophobicContact CD2-CE1 3.78Å; L75-F214 HydrophobicContact CG-CD1 4.27Å; L75-F214 HydrophobicContact CG-CE1 4.15Å; I79-F214 HydrophobicContact CD1-CB 4.26Å; I79-F214 HydrophobicContact CD1-CD1 3.32Å; I79-F214 HydrophobicContact CD1-CD2 4.33Å; I79-F214 HydrophobicContact CD1-CE1 3.66Å; I79-F214 HydrophobicContact CD1-CG 3.72Å; I79-F214 HydrophobicContact CD1-CZ 4.3Å; A105-F214 HydrophobicContact CB-CE2 4.33Å; A105-F214 HydrophobicContact CB-CZ 4.15Å; L108-F214 HydrophobicContact CD1-CE1 4.17Å; L156-F214 HydrophobicContact CD1-CB 4.48Å; L156-F214 HydrophobicContact CD1-CD2 4.08Å; L156-F214 HydrophobicContact CD1-CG 4.46Å; L156-F214 HydrophobicContact CD2-CD1 4.16Å; L156-F214 HydrophobicContact CD2-CD2 3.25Å; L156-F214 HydrophobicContact CD2-CE1 4.12Å; L156-F214 HydrophobicContact CD2-CE2 3.19Å; L156-F214 HydrophobicContact CD2-CG 3.74Å; L156-F214 HydrophobicContact CD2-CZ 3.65Å; L156-F214 HydrophobicContact CG-CD2 3.39Å; L156-F214 HydrophobicContact CG-CE2 3.63Å; L156-F214 HydrophobicContact CG-CG 4.14Å; L160-F214 HydrophobicContact CD2-CD2 4.48Å; Q210-F214 VanDerWaalsContact O-CB 3.32Å; Q210-F214 WeakPolarHBondContact O-CB 3.47Å; Q210-F214 PolarHBondContact O-N 3.45Å; Y212-F214 VanDerWaalsContact C-N 3.31Å; Y212-F214 PolarHBondContact O-N 2.98Å; F214-L217 PolarHBondContact O-N 3.31Å; F214-V218 HydrophobicContact CD1-CG2 4.41Å; F214-V218 HydrophobicContact CE1-CG2 4.22Å; F214-V218 WeakPolarHBondContact O-CG2 3.5Å; F214-V218 PolarHBondContact O-N 3.47Å
215T89.4Confident86.8Confident0 Ų040.7 Ų40.70%021%0.214CC..Hα-helixtrans-71.4-35.3-177.151.90000112.6M57 L75 I76 A211 Y212 V218 S219M57-T215 WeakPolarHBondContact CE-OG1 3.41Å; L75-T215 HydrophobicContact CB-CG2 4.07Å; L75-T215 HydrophobicContact CD2-CG2 3.51Å; L75-T215 HydrophobicContact CG-CG2 3.73Å; I76-T215 VanDerWaalsContact CA-CG2 3.47Å; I76-T215 HydrophobicContact CB-CG2 3.49Å; I76-T215 VanDerWaalsContact CB-CG2 3.49Å; I76-T215 HydrophobicContact CG1-CG2 4.17Å; A211-T215 WeakPolarHBondContact O-CG2 3.45Å; A211-T215 PolarHBondContact O-N 2.67Å; A211-T215 PolarHBondContact O-OG1 2.89Å; Y212-T215 PolarHBondContact O-N 3.36Å; Y212-T215 PolarHBondContact O-OG1 3.48Å; T215-V218 PolarHBondContact O-N 3.34Å; T215-S219 WeakPolarHBondContact O-CB 3.48Å; T215-S219 PolarHBondContact O-N 3.49Å
216L88.6Confident85.6Confident60 Ų6039.7 Ų39.731%0.31420%0.204SC..Hα-helixtrans-62.5-45.7174.7-175.5148000111.6Y212 V218 S219 L220Y212-L216 HydrophobicContact CE1-CD1 3.69Å; Y212-L216 HydrophobicContact CE2-CD1 4.37Å; Y212-L216 VanDerWaalsContact O-CB 3.26Å; Y212-L216 WeakPolarHBondContact O-CB 3.41Å; Y212-L216 PolarHBondContact O-N 2.96Å; Y212-L216 VanDerWaalsContact OH-CD1 3.32Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.35Å; L216-V218 PolarHBondContact O-N 3.05Å; L216-S219 CarbonylContact O-C 3.59Å; L216-S219 WeakPolarHBondContact O-CB 3.21Å; L216-S219 PolarHBondContact O-N 3.23Å; L216-S219 VanDerWaalsContact O-N 3.14Å; L216-S219 PolarHBondContact O-OG 3.47Å; L216-L220 PolarHBondContact O-N 3.2Å
217L86.8Confident85.3Confident37 Ų3739.8 Ų39.819%0.19420%0.202CC..Hα-helixtrans-63.1-42.9178.1-77.6166.7000111.8L156 V213 F214 S219 L220 Y221L156-L217 HydrophobicContact CD1-CB 4.19Å; L156-L217 HydrophobicContact CD1-CD1 3.4Å; L156-L217 VanDerWaalsContact CD1-CD1 3.4Å; L156-L217 HydrophobicContact CD1-CG 4.42Å; V213-L217 HydrophobicContact CG1-CD1 3.89Å; V213-L217 WeakPolarHBondContact O-CB 3.43Å; V213-L217 WeakPolarHBondContact O-CG 3.29Å; V213-L217 PolarHBondContact O-N 3.29Å; F214-L217 PolarHBondContact O-N 3.31Å; L217-S219 VanDerWaalsContact C-N 3.27Å; L217-S219 PolarHBondContact O-N 3.16Å; L217-L220 PolarHBondContact O-N 3Å; L217-Y221 HydrophobicContact CB-CE2 4.18Å; L217-Y221 WeakPolarHBondContact O-CD2 3.47Å; L217-Y221 WeakPolarHBondContact O-CE2 3.49Å; L217-Y221 PolarHBondContact O-N 2.79Å
218V86.3Confident85.1Confident6 Ų641.7 Ų41.74%0.03621%0.211CC..Hα-helixtrans-59.1-41.1173176.70000111.3L72 L108 L156 F214 T215 L216 Y221 L222L72-V218 HydrophobicContact CD2-CB 4.29Å; L72-V218 HydrophobicContact CD2-CG1 3.87Å; L108-V218 HydrophobicContact CB-CG1 4.37Å; L156-V218 HydrophobicContact CD2-CG2 4.36Å; F214-V218 HydrophobicContact CD1-CG2 4.41Å; F214-V218 HydrophobicContact CE1-CG2 4.22Å; F214-V218 WeakPolarHBondContact O-CG2 3.5Å; F214-V218 PolarHBondContact O-N 3.47Å; T215-V218 PolarHBondContact O-N 3.34Å; L216-V218 PolarHBondContact O-N 3.05Å; V218-Y221 PolarHBondContact O-N 2.99Å; V218-L222 PolarHBondContact O-N 3.23Å
219S86.9Confident84.9Confident12 Ų1237.8 Ų37.88%0.08419%0.19CC..Hα-helixtrans-66.5-37.9177.385.60000112.2H61 T215 L216 L217 L222 H223H61-S219 PolarHBondContact NE2-O 3.27Å; T215-S219 WeakPolarHBondContact O-CB 3.48Å; T215-S219 PolarHBondContact O-N 3.49Å; L216-S219 CarbonylContact O-C 3.59Å; L216-S219 WeakPolarHBondContact O-CB 3.21Å; L216-S219 PolarHBondContact O-N 3.23Å; L216-S219 VanDerWaalsContact O-N 3.14Å; L216-S219 PolarHBondContact O-OG 3.47Å; L217-S219 VanDerWaalsContact C-N 3.27Å; L217-S219 PolarHBondContact O-N 3.16Å; S219-L222 WeakPolarHBondContact O-CB 3.33Å; S219-L222 PolarHBondContact O-N 2.81Å; S219-H223 PolarHBondContact O-N 3.5Å
220L84.9Confident84.5Confident78 Ų7834.3 Ų34.341%0.40817%0.172SC..Hα-helixtrans-65.8-42176.5-171148.3000111L216 L217 L222 H223 D224L216-L220 PolarHBondContact O-N 3.2Å; L217-L220 PolarHBondContact O-N 3Å; L220-L222 VanDerWaalsContact C-N 3.27Å; L220-L222 PolarHBondContact O-N 3.29Å; L220-H223 WeakPolarHBondContact O-CA 3.38Å; L220-H223 WeakPolarHBondContact O-CB 3.44Å; L220-H223 PolarHBondContact O-N 3.33Å; L220-H223 VanDerWaalsContact O-N 3.07Å; L220-D224 WeakPolarHBondContact CD2-OD2 3.25Å; L220-D224 PolarHBondContact O-N 3.12Å
221Y80.7Confident84.2Confident19 Ų1935.8 Ų35.88%0.07518%0.18CC..Hα-helixtrans-61.1-38.4172.5-60.7-49.1000112.4Q152 L217 V218 H223 N225Q152-Y221 HydrophobicContact CG-CE1 4.38Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.36Å; Q152-Y221 VanDerWaalsContact NE2-CE1 3.34Å; Q152-Y221 PolarHBondContact NE2-OH 3.07Å; Q152-Y221 PolarHBondContact OE1-OH 3.09Å; L217-Y221 HydrophobicContact CB-CE2 4.18Å; L217-Y221 WeakPolarHBondContact O-CD2 3.47Å; L217-Y221 WeakPolarHBondContact O-CE2 3.49Å; L217-Y221 PolarHBondContact O-N 2.79Å; V218-Y221 PolarHBondContact O-N 2.99Å; Y221-H223 VanDerWaalsContact C-N 3.31Å; Y221-N225 VanDerWaalsContact O-CB 3.3Å; Y221-N225 WeakPolarHBondContact O-CB 3.45Å; Y221-N225 PolarHBondContact O-N 3.2Å; Y221-N225 VanDerWaalsContact O-N 3.1Å; Y221-N225 PolarHBondContact O-ND2 3.38Å
222L82.1Confident83.8Confident1 Ų138.1 Ų38.11%0.00519%0.192CC..Hα-helixtrans-64-41175.3-16682.5000110.8W68 A112 M115 V218 S219 L220 N225 T226W68-L222 HydrophobicContact CB-CD1 4.47Å; W68-L222 HydrophobicContact CB-CD2 3.6Å; W68-L222 HydrophobicContact CD2-CD1 3.47Å; W68-L222 VanDerWaalsContact CD2-CD1 3.47Å; W68-L222 HydrophobicContact CD2-CD2 4.26Å; W68-L222 HydrophobicContact CE3-CD1 3.61Å; W68-L222 HydrophobicContact CG-CD1 3.81Å; W68-L222 HydrophobicContact CG-CD2 3.8Å; W68-L222 HydrophobicContact CG-CG 4.48Å; W68-L222 HydrophobicContact CH2-CD1 4.47Å; W68-L222 HydrophobicContact CZ2-CD1 4.33Å; W68-L222 HydrophobicContact CZ3-CD1 4.1Å; A112-L222 HydrophobicContact CB-CD1 4.47Å; M115-L222 HydrophobicContact SD-CD1 4.5Å; V218-L222 PolarHBondContact O-N 3.23Å; S219-L222 WeakPolarHBondContact O-CB 3.33Å; S219-L222 PolarHBondContact O-N 2.81Å; L220-L222 VanDerWaalsContact C-N 3.27Å; L220-L222 PolarHBondContact O-N 3.29Å; L222-N225 PolarHBondContact O-N 3.46Å; L222-T226 HydrophobicContact CG-CG2 4.3Å; L222-T226 WeakPolarHBondContact O-CB 3.43Å; L222-T226 WeakPolarHBondContact O-CG2 3.41Å; L222-T226 PolarHBondContact O-N 3.41Å; L222-T226 VanDerWaalsContact O-N 3.11Å; L222-T226 PolarHBondContact O-OG1 3.26Å
223H81.7Confident83.3Confident83 Ų8333.3 Ų33.338%0.38418%0.176SC..Hα-helixtrans-61.1-49.8176.5-173.586.2000111.6M60 S219 L220 Y221 N225 T226M60-H223 PolarHBondContact O-CE1 3.28Å; M60-H223 PolarHBondContact O-ND1 3.02Å; S219-H223 PolarHBondContact O-N 3.5Å; L220-H223 WeakPolarHBondContact O-CA 3.38Å; L220-H223 WeakPolarHBondContact O-CB 3.44Å; L220-H223 PolarHBondContact O-N 3.33Å; L220-H223 VanDerWaalsContact O-N 3.07Å; Y221-H223 VanDerWaalsContact C-N 3.31Å; H223-N225 PolarHBondContact O-N 3.49Å; H223-T226 PolarHBondContact O-N 2.97Å; H223-T226 PolarHBondContact O-OG1 3.34Å
224D78.6Confident82.8Confident73 Ų7332.7 Ų32.739%0.3917%0.17SC..Hα-helixtrans-62.6-31.2-179.6-64.6-16.3000112.5L220L220-D224 WeakPolarHBondContact CD2-OD2 3.25Å; L220-D224 PolarHBondContact O-N 3.12Å
225N73.7Confident82.4Confident29 Ų2935.3 Ų35.316%0.15518%0.184CC..THydrogen-bonded Turntrans-91.4-2.2-179.5-74.7-73.1000114.5G116 S119 Y221 L222 H223G116-N225 VanDerWaalsContact CA-O 3.26Å; G116-N225 WeakPolarHBondContact CA-O 3.38Å; S119-N225 PolarHBondContact OG-O 3.48Å; Y221-N225 VanDerWaalsContact O-CB 3.3Å; Y221-N225 WeakPolarHBondContact O-CB 3.45Å; Y221-N225 PolarHBondContact O-N 3.2Å; Y221-N225 VanDerWaalsContact O-N 3.1Å; Y221-N225 PolarHBondContact O-ND2 3.38Å; L222-N225 PolarHBondContact O-N 3.46Å; H223-N225 PolarHBondContact O-N 3.49Å
226T68.8Low81.7Confident26 Ų2638.5 Ų38.516%0.1620%0.2CC..  trans-1080-177.8510000115.1M115 K120 L222 H223M115-T226 HydrophobicContact CE-CG2 4.38Å; K120-T226 WeakPolarHBondContact CE-O 3.3Å; K120-T226 PolarHBondContact NZ-O 3.18Å; K120-T226 PolarHBondContact NZ-OXT 3.41Å; L222-T226 HydrophobicContact CG-CG2 4.3Å; L222-T226 WeakPolarHBondContact O-CB 3.43Å; L222-T226 WeakPolarHBondContact O-CG2 3.41Å; L222-T226 PolarHBondContact O-N 3.41Å; L222-T226 VanDerWaalsContact O-N 3.11Å; L222-T226 PolarHBondContact O-OG1 3.26Å; H223-T226 PolarHBondContact O-N 2.97Å; H223-T226 PolarHBondContact O-OG1 3.34Å

Retrieved 226 of 226 residues in 199.6 ms (Link to these results)