Q9B185_HUMAN Loading...

ATP synthase subunit a

AlphaFold DB , UniProt , Accession Q9B185, 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
1M56.3Low73.6Confident201 Ų20197.7 Ų97.799%0.9953%0.528SS*.  0-38.90-75174.5113.600112.7E3 N4M1-E3 PolarHBondContact O-N 3.4Å; M1-N4 PolarHBondContact O-N 3.31Å
2N53.1Low74.4Confident145 Ų14592.8 Ų92.878%0.77550%0.504SS*.Hα-helixtrans-57.1-40.8-178.8-84.918.4000115.3
3E61.7Low75.3Confident156 Ų15693.2 Ų93.273%0.72951%0.512SS*.Hα-helixtrans-74.5-25.4-178.5-66.4-93.2140.100113.1M1 L5 F6 A7M1-E3 PolarHBondContact O-N 3.4Å; E3-L5 VanDerWaalsContact C-N 3.32Å; E3-L5 PolarHBondContact O-N 3.35Å; E3-F6 PolarHBondContact O-N 3.39Å; E3-A7 PolarHBondContact O-N 3.3Å
4N74.6Confident76.1Confident115 Ų11594.4 Ų94.462%0.61552%0.515SS*.Hα-helixtrans-71.8-27.9-172.2-65.87.8000112.4M1 F6M1-N4 PolarHBondContact O-N 3.31Å; N4-F6 VanDerWaalsContact C-N 3.34Å
5L74.3Confident76.6Confident46 Ų4699.8 Ų99.824%0.24154%0.542CS..Hα-helixtrans-69.2-34.7177.9-66.9177.6000112E3 H172 L173E3-L5 VanDerWaalsContact C-N 3.32Å; E3-L5 PolarHBondContact O-N 3.35Å; L5-H172 WeakPolarHBondContact CD2-CE1 3.38Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.06Å; L5-L173 HydrophobicContact CD1-CD2 4.11Å; L5-L173 HydrophobicContact CD2-CD2 4.42Å
6F81.7Confident77Confident117 Ų11797.9 Ų97.951%0.51355%0.554SS.*Hα-helixtrans-93.4-9.8-176.8-66.7-75.8000113.7E3 N4 S8 F9 L169E3-F6 PolarHBondContact O-N 3.39Å; N4-F6 VanDerWaalsContact C-N 3.34Å; F6-S8 PolarHBondContact O-N 3.05Å; F6-S8 VanDerWaalsContact O-N 3.14Å; F6-F9 HydrophobicContact CD1-CD2 4.01Å; F6-F9 HydrophobicContact CD1-CE2 4.38Å; F6-F9 PolarHBondContact O-N 3.33Å; F6-L169 HydrophobicContact CD1-CD2 4.41Å; F6-L169 HydrophobicContact CE1-CD1 4.14Å; F6-L169 HydrophobicContact CE1-CD2 4.04Å; F6-L169 HydrophobicContact CZ-CD2 4.47Å
7A79.7Confident77.4Confident56 Ų5699.5 Ų99.546%0.46356%0.56SS.*G310 helixtrans-55.3-32.7-179.400000113.2E3 F9 I10E3-A7 PolarHBondContact O-N 3.3Å; A7-F9 VanDerWaalsContact C-N 3.27Å; A7-F9 PolarHBondContact O-N 3.11Å; A7-I10 PolarHBondContact O-N 2.85Å
8S78.9Confident77.8Confident57 Ų5798.3 Ų98.340%0.39956%0.556SS.*G310 helixtrans-69.3-20.1176.856.80000114.2F6 F92F6-S8 PolarHBondContact O-N 3.05Å; F6-S8 VanDerWaalsContact O-N 3.14Å; S8-F92 WeakPolarHBondContact O-CD2 3.09Å
9F82.3Confident78.2Confident21 Ų2194.1 Ų94.19%0.09254%0.535CS..G310 helixtrans-93.5-10.2178-58.2-70.3000112.8F6 A7 A11 T96 Q97 T165 H168 L169F6-F9 HydrophobicContact CD1-CD2 4.01Å; F6-F9 HydrophobicContact CD1-CE2 4.38Å; F6-F9 PolarHBondContact O-N 3.33Å; A7-F9 VanDerWaalsContact C-N 3.27Å; A7-F9 PolarHBondContact O-N 3.11Å; F9-A11 PolarHBondContact O-N 3.13Å; F9-T96 HydrophobicContact CD1-CG2 3.88Å; F9-T96 HydrophobicContact CE1-CG2 3.77Å; F9-Q97 PolarHBondContact O-NE2 3.33Å; F9-T165 HydrophobicContact CD1-CG2 4.46Å; F9-T165 HydrophobicContact CE1-CG2 4.18Å; F9-H168 HydrophobicContact CE1-CB 4.07Å; F9-H168 HydrophobicContact CZ-CB 3.81Å; F9-L169 HydrophobicContact CE2-CD1 4.47Å; F9-L169 HydrophobicContact CE2-CD2 3.67Å; F9-L169 HydrophobicContact CE2-CG 3.77Å; F9-L169 HydrophobicContact CZ-CD2 4.3Å; F9-L169 HydrophobicContact CZ-CG 3.92Å
10I84.3Confident78.6Confident110 Ų11090.4 Ų90.456%0.56452%0.516SS*.SBendtrans-69.7129.8178-59.2175.5000108.5A7 P12A7-I10 PolarHBondContact O-N 2.85Å; I10-P12 WeakPolarHBondContact O-CD 3.38Å
11A83Confident78.9Confident51 Ų5190 Ų9042%0.42152%0.515SS..PPolyproline II helixtrans-59120.8179.900000110.2F9 T13 F92F9-A11 PolarHBondContact O-N 3.13Å; A11-T13 PolarHBondContact O-N 3.36Å; A11-F92 HydrophobicContact CB-CZ 4.46Å
12P83Confident80.3Confident38 Ų3886.4 Ų86.425%0.24750%0.5CS..PPolyproline II helixtrans-70.8127.5-174.726.9-33.3000109.9I10 A19 I23 F92I10-P12 WeakPolarHBondContact O-CD 3.38Å; P12-A19 HydrophobicContact CB-CB 4.23Å; P12-A19 HydrophobicContact CG-CB 4.3Å; P12-A19 WeakPolarHBondContact O-CB 3.33Å; P12-A19 PolarHBondContact O-N 3.01Å; P12-I23 HydrophobicContact CG-CD1 3.61Å; P12-F92 HydrophobicContact CG-CB 4.38Å; P12-F92 HydrophobicContact CG-CD1 4.18Å; P12-F92 HydrophobicContact CG-CD2 4.47Å; P12-F92 HydrophobicContact CG-CG 4.09Å
13T86.4Confident82Confident99 Ų9981.9 Ų81.961%0.60748%0.475SS*.EExtended strand (participates in β ladder)trans-117.3126.6170.553.90000108.6A11 L17A11-T13 PolarHBondContact O-N 3.36Å; T13-L17 CarbonylContact C-O 3.58Å; T13-L17 VanDerWaalsContact CA-O 3.28Å; T13-L17 WeakPolarHBondContact CA-O 3.48Å
14I86.4Confident83.2Confident109 Ų10976.8 Ų76.856%0.55945%0.452SS*.EExtended strand (participates in β ladder)trans-112.5122.3175.6-63.3172.9000106.3G16 L17 A19I14-G16 PolarHBondContact O-N 2.95Å; I14-G16 VanDerWaalsContact O-N 3.13Å; I14-L17 PolarHBondContact N-O 3.35Å; I14-L17 PolarHBondContact O-N 2.93Å; I14-A19 HydrophobicContact CD1-CB 3.89Å; I14-A19 HydrophobicContact CG1-CB 3.96Å
15L84Confident83.8Confident176 Ų17677 Ų7792%0.92145%0.453SS*.THydrogen-bonded Turntrans54.332.1179.4-70.7150.8000113.6L17L15-L17 VanDerWaalsContact C-N 3.27Å; L15-L17 PolarHBondContact O-N 3.41Å
16G82.6Confident84.5Confident70 Ų7079.2 Ų79.272%0.72246%0.461SS*.THydrogen-bonded Turntrans80.2-2.6-177.700000115.2I14I14-G16 PolarHBondContact O-N 2.95Å; I14-G16 VanDerWaalsContact O-N 3.13Å
17L83.7Confident84.9Confident125 Ų12573.8 Ų73.865%0.65444%0.437SS*.EExtended strand (participates in β ladder)trans-93.2139.8173-67.8166.7000110.9T13 I14 L15 A19T13-L17 CarbonylContact C-O 3.58Å; T13-L17 VanDerWaalsContact CA-O 3.28Å; T13-L17 WeakPolarHBondContact CA-O 3.48Å; I14-L17 PolarHBondContact N-O 3.35Å; I14-L17 PolarHBondContact O-N 2.93Å; L15-L17 VanDerWaalsContact C-N 3.27Å; L15-L17 PolarHBondContact O-N 3.41Å; L17-A19 PolarHBondContact O-N 3.48Å
18P84.9Confident85.1Confident77 Ų7774.4 Ų74.450%0.544%0.436SS..EExtended strand (participates in β ladder)trans-71102.4177.528.8-33.3000110.5A20 V21P18-A20 PolarHBondContact O-N 2.97Å; P18-V21 HydrophobicContact CG-CG2 4.23Å; P18-V21 PolarHBondContact O-N 3.25Å
19A85.4Confident85.6Confident19 Ų1978 Ų7816%0.15745%0.451CS..THydrogen-bonded Turntrans-68.1-16176.700000112.4P12 I14 L17 V21 L22 I23P12-A19 HydrophobicContact CB-CB 4.23Å; P12-A19 HydrophobicContact CG-CB 4.3Å; P12-A19 WeakPolarHBondContact O-CB 3.33Å; P12-A19 PolarHBondContact O-N 3.01Å; I14-A19 HydrophobicContact CD1-CB 3.89Å; I14-A19 HydrophobicContact CG1-CB 3.96Å; L17-A19 PolarHBondContact O-N 3.48Å; A19-V21 PolarHBondContact O-N 3.48Å; A19-L22 PolarHBondContact O-N 3.04Å; A19-L22 VanDerWaalsContact O-N 3.11Å; A19-I23 PolarHBondContact O-N 3.43Å
20A85.4Confident85.8Confident19 Ų1980.7 Ų80.716%0.15747%0.465CS..Hα-helixtrans-53.2-34.1172.600000113.2P18 L22 I23 I24 F92P18-A20 PolarHBondContact O-N 2.97Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 3.25Å; A20-I23 PolarHBondContact O-N 2.75Å; A20-I24 WeakPolarHBondContact O-CD1 3.42Å; A20-I24 VanDerWaalsContact O-CG1 3.25Å; A20-I24 WeakPolarHBondContact O-CG1 3.22Å; A20-I24 PolarHBondContact O-N 2.98Å; A20-F92 HydrophobicContact CB-CE1 4.37Å
21V85.2Confident86Confident82 Ų8278.1 Ų78.150%0.49745%0.452SS..Hα-helixtrans-63.5-42179179.80000111.2P18 A19 I23 I24 L25P18-V21 HydrophobicContact CG-CG2 4.23Å; P18-V21 PolarHBondContact O-N 3.25Å; A19-V21 PolarHBondContact O-N 3.48Å; V21-I23 VanDerWaalsContact C-N 3.33Å; V21-I23 PolarHBondContact O-N 3.2Å; V21-I24 PolarHBondContact O-N 3.12Å; V21-L25 HydrophobicContact CG1-CD1 4.16Å; V21-L25 WeakPolarHBondContact O-CG 3.35Å; V21-L25 PolarHBondContact O-N 2.96Å; V21-L25 VanDerWaalsContact O-N 3.08Å
22L86.1Confident86.2Confident126 Ų12678.4 Ų78.466%0.6645%0.45SS*.Hα-helixtrans-66.4-39.1179.1-167.3148.2000111A19 A20 L25 F26A19-L22 PolarHBondContact O-N 3.04Å; A19-L22 VanDerWaalsContact O-N 3.11Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 3.25Å; L22-L25 PolarHBondContact O-N 3.42Å; L22-F26 PolarHBondContact O-N 3.44Å
23I87.6Confident86.4Confident51 Ų5183 Ų8326%0.26248%0.478SS..Hα-helixtrans-65.1-41176.6-63.5157.9000111P12 A19 A20 V21 L25 F26 P27 F92P12-I23 HydrophobicContact CG-CD1 3.61Å; A19-I23 PolarHBondContact O-N 3.43Å; A20-I23 PolarHBondContact O-N 2.75Å; V21-I23 VanDerWaalsContact C-N 3.33Å; V21-I23 PolarHBondContact O-N 3.2Å; I23-L25 VanDerWaalsContact C-N 3.3Å; I23-L25 PolarHBondContact O-N 3.36Å; I23-F26 WeakPolarHBondContact O-CB 3.12Å; I23-F26 PolarHBondContact O-N 3.23Å; I23-P27 VanDerWaalsContact O-CD 3.28Å; I23-P27 WeakPolarHBondContact O-CD 3.3Å; I23-F92 HydrophobicContact CD1-CB 4.1Å; I23-F92 HydrophobicContact CD1-CD1 3.96Å; I23-F92 HydrophobicContact CD1-CG 4.39Å; I23-F92 HydrophobicContact CG2-CD1 4.43Å; I23-F92 WeakPolarHBondContact CG2-O 3.3Å
24I88.3Confident86.4Confident49 Ų4980.2 Ų80.225%0.25146%0.462SS..Hα-helixtrans-65.9-32.4176.9-68.7163.9000111.9A20 V21 F26 P27 F78 P94 M100A20-I24 WeakPolarHBondContact O-CD1 3.42Å; A20-I24 VanDerWaalsContact O-CG1 3.25Å; A20-I24 WeakPolarHBondContact O-CG1 3.22Å; A20-I24 PolarHBondContact O-N 2.98Å; V21-I24 PolarHBondContact O-N 3.12Å; I24-F26 VanDerWaalsContact C-N 3.34Å; I24-P27 WeakPolarHBondContact O-CD 3.45Å; I24-F78 HydrophobicContact CG2-CZ 4.31Å; I24-P94 HydrophobicContact CD1-CB 4.25Å; I24-P94 HydrophobicContact CG1-CB 3.69Å; I24-P94 HydrophobicContact CG1-CG 4.04Å; I24-M100 HydrophobicContact CD1-SD 4.33Å; I24-M100 HydrophobicContact CG2-CE 4.3Å
25L87.3Confident86.4Confident118 Ų11885.1 Ų85.162%0.61848%0.479SS*.Hα-helixtrans-81.1-11178.4-72.2172.3000114V21 L22 I23 P28V21-L25 HydrophobicContact CG1-CD1 4.16Å; V21-L25 WeakPolarHBondContact O-CG 3.35Å; V21-L25 PolarHBondContact O-N 2.96Å; V21-L25 VanDerWaalsContact O-N 3.08Å; L22-L25 PolarHBondContact O-N 3.42Å; I23-L25 VanDerWaalsContact C-N 3.3Å; I23-L25 PolarHBondContact O-N 3.36Å; L25-P28 WeakPolarHBondContact O-CD 2.93Å
26F88.7Confident86.5Confident94 Ų9485.7 Ų85.741%0.41247%0.47SS..Hα-helixtrans-71.3-42.7-176.3-171.5-99.3000114.8L22 I23 I24 L29 L30 L85L22-F26 PolarHBondContact O-N 3.44Å; I23-F26 WeakPolarHBondContact O-CB 3.12Å; I23-F26 PolarHBondContact O-N 3.23Å; I24-F26 VanDerWaalsContact C-N 3.34Å; F26-L29 VanDerWaalsContact O-CB 3.31Å; F26-L29 WeakPolarHBondContact O-CB 3.3Å; F26-L29 PolarHBondContact O-N 3.25Å; F26-L30 HydrophobicContact CD1-CD1 4.42Å; F26-L30 HydrophobicContact CE1-CD1 4.09Å; F26-L30 HydrophobicContact CE1-CD2 4.26Å; F26-L30 HydrophobicContact CE1-CG 4.25Å; F26-L30 HydrophobicContact CZ-CD2 4.4Å; F26-L85 HydrophobicContact CD1-CD2 3.32Å; F26-L85 HydrophobicContact CE1-CD2 3.56Å
27P88.9Confident86.4Confident3 Ų390.8 Ų90.82%0.01948%0.48CS..Hα-helixtrans-57.2-42.3179.8-14.720.2000115.1I23 I24 L29 L30 T81 T82I23-P27 VanDerWaalsContact O-CD 3.28Å; I23-P27 WeakPolarHBondContact O-CD 3.3Å; I24-P27 WeakPolarHBondContact O-CD 3.45Å; P27-L29 PolarHBondContact O-N 3.27Å; P27-L30 WeakPolarHBondContact O-CB 3.26Å; P27-L30 PolarHBondContact O-N 2.93Å; P27-T81 WeakPolarHBondContact CB-OG1 3.42Å; P27-T82 HydrophobicContact CB-CG2 4.29Å; P27-T82 HydrophobicContact CG-CG2 3.54Å
28P85.2Confident86.4Confident68 Ų6892.2 Ų92.244%0.44249%0.487SS..Hα-helixtrans-55.5-33173.4-27.133000114.3L25 L30 I31L25-P28 WeakPolarHBondContact O-CD 2.93Å; P28-L30 PolarHBondContact O-N 3.45Å; P28-I31 PolarHBondContact O-N 3.1Å
29L88.3Confident86.6Confident134 Ų13489.9 Ų89.970%0.70247%0.47SS*.Hα-helixtrans-68.1-25.1179.5-171.865.2000112.4F26 P27 I31F26-L29 VanDerWaalsContact O-CB 3.31Å; F26-L29 WeakPolarHBondContact O-CB 3.3Å; F26-L29 PolarHBondContact O-N 3.25Å; P27-L29 PolarHBondContact O-N 3.27Å; L29-I31 PolarHBondContact O-N 3.46Å
30L87.7Confident86.8Confident76 Ų7694.5 Ų94.540%0.39849%0.492SS..THydrogen-bonded Turntrans-75.6-5.8178.2-64.8176.1000113.8F26 P27 P28 P32 Q46 L85F26-L30 HydrophobicContact CD1-CD1 4.42Å; F26-L30 HydrophobicContact CE1-CD1 4.09Å; F26-L30 HydrophobicContact CE1-CD2 4.26Å; F26-L30 HydrophobicContact CE1-CG 4.25Å; F26-L30 HydrophobicContact CZ-CD2 4.4Å; P27-L30 WeakPolarHBondContact O-CB 3.26Å; P27-L30 PolarHBondContact O-N 2.93Å; P28-L30 PolarHBondContact O-N 3.45Å; L30-P32 VanDerWaalsContact C-CD 3.43Å; L30-P32 WeakPolarHBondContact O-CD 3.26Å; L30-Q46 PolarHBondContact O-NE2 2.98Å; L30-L85 HydrophobicContact CD1-CD1 3.44Å; L30-L85 VanDerWaalsContact CD1-CD1 3.44Å; L30-L85 HydrophobicContact CD1-CD2 3.77Å; L30-L85 HydrophobicContact CD1-CG 4.09Å
31I88.2Confident87Confident56 Ų56103.6 Ų103.629%0.28752%0.523SS..SBendtrans-107.682.2-179.2-53.7164000108.3P28 L29 I77P28-I31 PolarHBondContact O-N 3.1Å; L29-I31 PolarHBondContact O-N 3.46Å; I31-I77 HydrophobicContact CD1-CG2 3.39Å; I31-I77 HydrophobicContact CG1-CG2 4.47Å
32P87Confident87.2Confident57 Ų57103.7 Ų103.737%0.3752%0.52SS..  trans-67.1141.3178.427.7-34000110.7L30 L42 I43L30-P32 VanDerWaalsContact C-CD 3.43Å; L30-P32 WeakPolarHBondContact O-CD 3.26Å; P32-L42 HydrophobicContact CG-CD2 3.55Å; P32-I43 HydrophobicContact CB-CD1 4.44Å; P32-I43 HydrophobicContact CB-CG1 4.49Å; P32-I43 HydrophobicContact CG-CD1 4.44Å; P32-I43 HydrophobicContact CG-CG1 4Å
33T87Confident87.5Confident136 Ų13698.5 Ų98.583%0.83449%0.492SS*.  trans-107.9142.2171.258.70000109.5
34S87.3Confident87.6Confident40 Ų4099.1 Ų99.128%0.2850%0.499SS..  trans-126.1146.4173.856.70000110.7N39 I43S34-N39 WeakPolarHBondContact CB-OD1 3.42Å; S34-N39 PolarHBondContact OG-ND2 3.28Å; S34-N39 PolarHBondContact OG-OD1 3.12Å; S34-I43 WeakPolarHBondContact OG-CD1 3.2Å
35K85.9Confident87.8Confident212 Ų212100.9 Ų100.992%0.92251%0.512SS*.  trans-87.7-11.7178-62.5-180-179.1177.70113.1
36Y86.9Confident88Confident187 Ų18797.3 Ų97.373%0.73349%0.492SS*.SBendtrans-82.1154.5-174.8-59.8-71.6000111.8N39Y36-N39 PolarHBondContact O-ND2 3.03Å; Y36-N39 PolarHBondContact O-OD1 3.49Å
37L78.7Confident88Confident177 Ų17797.4 Ų97.493%0.92749%0.494SS*.SBendtrans-73.6-39.3176.7-169.475.2000111.4
38I85.3Confident88.2Confident155 Ų155105.3 Ų105.380%0.79552%0.523SS*.SBendtrans-100.3114.6174.9-60.7165.4000107.4
39N89.1Confident88.5Confident28 Ų28106.5 Ų106.515%0.1553%0.526CS..  trans-109.4167.7-172.1-69.2-29000112.5S34 Y36 I43 T44 Q47S34-N39 WeakPolarHBondContact CB-OD1 3.42Å; S34-N39 PolarHBondContact OG-ND2 3.28Å; S34-N39 PolarHBondContact OG-OD1 3.12Å; Y36-N39 PolarHBondContact O-ND2 3.03Å; Y36-N39 PolarHBondContact O-OD1 3.49Å; N39-I43 HydrophobicContact CB-CB 3.96Å; N39-I43 HydrophobicContact CB-CG2 3.84Å; N39-T44 HydrophobicContact CB-CG2 4.11Å; N39-Q47 PolarHBondContact ND2-NE2 3.05Å
40N89.1Confident88.7Confident116 Ų116103 Ų10362%0.6251%0.507SS*.  trans-64.1153.2172.2-165.30.4000110.9L42 I43 T44N40-L42 PolarHBondContact O-N 3.28Å; N40-L42 VanDerWaalsContact O-N 3.15Å; N40-I43 PolarHBondContact O-N 3.4Å; N40-T44 PolarHBondContact O-N 2.99Å
41R89.3Confident88.8Confident211 Ų211106.6 Ų106.680%0.79652%0.519SS*.Hα-helixtrans-52-39-178.7-64.7-177.2-179.8-177.50.2112.8T44 T45R41-T44 WeakPolarHBondContact CA-OG1 3.49Å; R41-T44 PolarHBondContact O-N 3.22Å; R41-T44 PolarHBondContact O-OG1 3.36Å; R41-T45 WeakPolarHBondContact O-CG2 3.41Å; R41-T45 PolarHBondContact O-N 2.9Å; R41-T45 PolarHBondContact O-OG1 3.13Å
42L89.6Confident89Confident84 Ų84107.2 Ų107.244%0.4452%0.523SS..Hα-helixtrans-62.7-47.5177.6-173.4153.4000110.9P32 N40 T44 T45 Q46P32-L42 HydrophobicContact CG-CD2 3.55Å; N40-L42 PolarHBondContact O-N 3.28Å; N40-L42 VanDerWaalsContact O-N 3.15Å; L42-T44 PolarHBondContact O-N 3.08Å; L42-T45 PolarHBondContact O-N 3.48Å; L42-T45 PolarHBondContact O-OG1 3.33Å; L42-Q46 HydrophobicContact CD2-CG 4.2Å; L42-Q46 WeakPolarHBondContact O-CG 3.44Å; L42-Q46 PolarHBondContact O-N 2.86Å
43I91.5Very high89.1Confident16 Ų16105.6 Ų105.68%0.08251%0.512CS..Hα-helixtrans-67.1-37.4-179.8-60174.2000110.8P32 S34 N39 N40 Q46 Q47P32-I43 HydrophobicContact CB-CD1 4.44Å; P32-I43 HydrophobicContact CB-CG1 4.49Å; P32-I43 HydrophobicContact CG-CD1 4.44Å; P32-I43 HydrophobicContact CG-CG1 4Å; S34-I43 WeakPolarHBondContact OG-CD1 3.2Å; N39-I43 HydrophobicContact CB-CB 3.96Å; N39-I43 HydrophobicContact CB-CG2 3.84Å; N40-I43 PolarHBondContact O-N 3.4Å; I43-Q46 PolarHBondContact O-N 3.42Å; I43-Q47 HydrophobicContact CG2-CG 4.23Å; I43-Q47 WeakPolarHBondContact O-CB 3.01Å; I43-Q47 VanDerWaalsContact O-CG 3.27Å; I43-Q47 WeakPolarHBondContact O-CG 3.42Å; I43-Q47 PolarHBondContact O-N 2.84Å
44T91.3Very high89.2Confident64 Ų64100.5 Ų100.539%0.39348%0.482SS..Hα-helixtrans-66.1-41.1177.160.30000111.9N39 N40 R41 L42 Q47 W48N39-T44 HydrophobicContact CB-CG2 4.11Å; N40-T44 PolarHBondContact O-N 2.99Å; R41-T44 WeakPolarHBondContact CA-OG1 3.49Å; R41-T44 PolarHBondContact O-N 3.22Å; R41-T44 PolarHBondContact O-OG1 3.36Å; L42-T44 PolarHBondContact O-N 3.08Å; T44-Q47 PolarHBondContact O-N 3.31Å; T44-W48 VanDerWaalsContact O-CB 3.32Å; T44-W48 WeakPolarHBondContact O-CB 3.33Å; T44-W48 PolarHBondContact O-N 3.1Å
45T91.1Very high89.3Confident86 Ų86106.3 Ų106.353%0.52850%0.502SS..Hα-helixtrans-65.2-39.8174.459.70000112.3R41 L42 W48 L49R41-T45 WeakPolarHBondContact O-CG2 3.41Å; R41-T45 PolarHBondContact O-N 2.9Å; R41-T45 PolarHBondContact O-OG1 3.13Å; L42-T45 PolarHBondContact O-N 3.48Å; L42-T45 PolarHBondContact O-OG1 3.33Å; T45-W48 PolarHBondContact O-N 3.43Å; T45-L49 WeakPolarHBondContact O-CB 3.2Å; T45-L49 PolarHBondContact O-N 3.34Å
46Q91.1Very high89.3Confident43 Ų43102 Ų10220%0.20149%0.485CS..Hα-helixtrans-62.5-49.2174.4-74.6177.9-22.500111.8L30 L42 I43 W48 L49 I50L30-Q46 PolarHBondContact O-NE2 2.98Å; L42-Q46 HydrophobicContact CD2-CG 4.2Å; L42-Q46 WeakPolarHBondContact O-CG 3.44Å; L42-Q46 PolarHBondContact O-N 2.86Å; I43-Q46 PolarHBondContact O-N 3.42Å; Q46-W48 VanDerWaalsContact C-N 3.28Å; Q46-W48 PolarHBondContact O-N 3.1Å; Q46-L49 PolarHBondContact O-N 3.41Å; Q46-I50 VanDerWaalsContact O-CG1 3.25Å; Q46-I50 WeakPolarHBondContact O-CG1 3.37Å; Q46-I50 PolarHBondContact O-N 2.95Å
47Q90.6Very high89.2Confident97 Ų9793.7 Ų93.745%0.45345%0.453SS..Hα-helixtrans-60.9-38.8177.6-74175.8-12.300111.9N39 I43 T44 K51N39-Q47 PolarHBondContact ND2-NE2 3.05Å; I43-Q47 HydrophobicContact CG2-CG 4.23Å; I43-Q47 WeakPolarHBondContact O-CB 3.01Å; I43-Q47 VanDerWaalsContact O-CG 3.27Å; I43-Q47 WeakPolarHBondContact O-CG 3.42Å; I43-Q47 PolarHBondContact O-N 2.84Å; T44-Q47 PolarHBondContact O-N 3.31Å; Q47-K51 VanDerWaalsContact O-CB 3.32Å; Q47-K51 WeakPolarHBondContact O-CB 3.33Å; Q47-K51 PolarHBondContact O-N 3.15Å
48W92.5Very high89.5Confident168 Ų16886 Ų8664%0.63641%0.413SS*.Hα-helixtrans-63.2-45.2175-179.782.5000111.9T44 T45 Q46 K51 L52T44-W48 VanDerWaalsContact O-CB 3.32Å; T44-W48 WeakPolarHBondContact O-CB 3.33Å; T44-W48 PolarHBondContact O-N 3.1Å; T45-W48 PolarHBondContact O-N 3.43Å; Q46-W48 VanDerWaalsContact C-N 3.28Å; Q46-W48 PolarHBondContact O-N 3.1Å; W48-K51 PolarHBondContact O-N 3.45Å; W48-L52 HydrophobicContact CD2-CD1 3.76Å; W48-L52 HydrophobicContact CD2-CG 4.43Å; W48-L52 VanDerWaalsContact CE2-CD1 3.47Å; W48-L52 HydrophobicContact CE3-CD1 3.85Å; W48-L52 HydrophobicContact CH2-CD1 3.44Å; W48-L52 VanDerWaalsContact CH2-CD1 3.44Å; W48-L52 HydrophobicContact CZ2-CD1 3.35Å; W48-L52 HydrophobicContact CZ2-CG 4.45Å; W48-L52 HydrophobicContact CZ3-CD1 3.69Å; W48-L52 WeakPolarHBondContact O-CG 3.33Å; W48-L52 PolarHBondContact O-N 2.92Å
49L91.2Very high89.4Confident94 Ų9482.6 Ų82.649%0.49241%0.408SS..Hα-helixtrans-64.6-42.6177.9-167.7145.6000112.1T45 Q46 K51 L52 T53T45-L49 WeakPolarHBondContact O-CB 3.2Å; T45-L49 PolarHBondContact O-N 3.34Å; Q46-L49 PolarHBondContact O-N 3.41Å; L49-K51 VanDerWaalsContact C-N 3.33Å; L49-K51 PolarHBondContact O-N 3.12Å; L49-L52 PolarHBondContact O-N 3.46Å; L49-T53 HydrophobicContact CD2-CG2 4.15Å; L49-T53 WeakPolarHBondContact O-CG2 3.45Å; L49-T53 PolarHBondContact O-N 3.35Å; L49-T53 PolarHBondContact O-OG1 3.16Å
50I91.6Very high88.8Confident59 Ų5986.7 Ų86.730%0.30343%0.428SS..Hα-helixtrans-61.6-41.7174.8-67.5169.8000111Q46 T53 S54 V73 I77Q46-I50 VanDerWaalsContact O-CG1 3.25Å; Q46-I50 WeakPolarHBondContact O-CG1 3.37Å; Q46-I50 PolarHBondContact O-N 2.95Å; I50-T53 WeakPolarHBondContact CA-OG1 3.34Å; I50-T53 PolarHBondContact O-OG1 3.28Å; I50-T53 VanDerWaalsContact O-OG1 3.05Å; I50-S54 VanDerWaalsContact O-CB 3.27Å; I50-S54 WeakPolarHBondContact O-CB 3.39Å; I50-S54 PolarHBondContact O-N 3.24Å; I50-S54 PolarHBondContact O-OG 2.78Å; I50-V73 HydrophobicContact CG2-CG1 3.91Å; I50-I77 HydrophobicContact CD1-CD1 4.06Å; I50-I77 HydrophobicContact CG1-CD1 3.7Å
51K91.4Very high88.4Confident153 Ų15382.1 Ų82.167%0.66540%0.402SS*.Hα-helixtrans-65.9-40178.4-172.8178-178.7179.20112.1Q47 W48 L49 S54 K55Q47-K51 VanDerWaalsContact O-CB 3.32Å; Q47-K51 WeakPolarHBondContact O-CB 3.33Å; Q47-K51 PolarHBondContact O-N 3.15Å; W48-K51 PolarHBondContact O-N 3.45Å; L49-K51 VanDerWaalsContact C-N 3.33Å; L49-K51 PolarHBondContact O-N 3.12Å; K51-S54 PolarHBondContact O-OG 3.13Å; K51-S54 VanDerWaalsContact O-OG 3.09Å; K51-K55 VanDerWaalsContact O-CB 3.25Å; K51-K55 WeakPolarHBondContact O-CB 3.24Å; K51-K55 PolarHBondContact O-N 3.28Å; K51-K55 VanDerWaalsContact O-N 3.08Å
52L91.4Very high88Confident68 Ų6877 Ų7736%0.35639%0.391SS..Hα-helixtrans-67.7-50.4178.1-74.6177.8000112.2W48 L49 K55 Q56W48-L52 HydrophobicContact CD2-CD1 3.76Å; W48-L52 HydrophobicContact CD2-CG 4.43Å; W48-L52 VanDerWaalsContact CE2-CD1 3.47Å; W48-L52 HydrophobicContact CE3-CD1 3.85Å; W48-L52 HydrophobicContact CH2-CD1 3.44Å; W48-L52 VanDerWaalsContact CH2-CD1 3.44Å; W48-L52 HydrophobicContact CZ2-CD1 3.35Å; W48-L52 HydrophobicContact CZ2-CG 4.45Å; W48-L52 HydrophobicContact CZ3-CD1 3.69Å; W48-L52 WeakPolarHBondContact O-CG 3.33Å; W48-L52 PolarHBondContact O-N 2.92Å; L49-L52 PolarHBondContact O-N 3.46Å; L52-K55 PolarHBondContact O-N 3.09Å; L52-Q56 WeakPolarHBondContact O-CG 3.34Å; L52-Q56 PolarHBondContact O-N 2.84Å
53T88.6Confident87.5Confident24 Ų2479 Ų7915%0.14741%0.407CS..Hα-helixtrans-60.4-48.718048.80000111.2L49 I50 K55 Q56 M57L49-T53 HydrophobicContact CD2-CG2 4.15Å; L49-T53 WeakPolarHBondContact O-CG2 3.45Å; L49-T53 PolarHBondContact O-N 3.35Å; L49-T53 PolarHBondContact O-OG1 3.16Å; I50-T53 WeakPolarHBondContact CA-OG1 3.34Å; I50-T53 PolarHBondContact O-OG1 3.28Å; I50-T53 VanDerWaalsContact O-OG1 3.05Å; T53-K55 VanDerWaalsContact C-N 3.34Å; T53-K55 PolarHBondContact O-N 2.71Å; T53-Q56 PolarHBondContact O-N 3.28Å; T53-M57 VanDerWaalsContact O-CG 3.31Å; T53-M57 WeakPolarHBondContact O-CG 3.42Å; T53-M57 PolarHBondContact O-N 3.43Å
54S89.1Confident86.8Confident29 Ų2984.2 Ų84.220%0.20343%0.429CS..Hα-helixtrans-60.7-40.2176.159.50000112.7I50 K51 M58I50-S54 VanDerWaalsContact O-CB 3.27Å; I50-S54 WeakPolarHBondContact O-CB 3.39Å; I50-S54 PolarHBondContact O-N 3.24Å; I50-S54 PolarHBondContact O-OG 2.78Å; K51-S54 PolarHBondContact O-OG 3.13Å; K51-S54 VanDerWaalsContact O-OG 3.09Å; S54-M58 WeakPolarHBondContact O-CB 3.26Å; S54-M58 WeakPolarHBondContact O-CG 3.3Å; S54-M58 PolarHBondContact O-N 3.19Å
55K89.3Confident86.2Confident161 Ų16181.2 Ų81.270%0.741%0.41SS*.Hα-helixtrans-63.4-44.5177.3-175.3-179.3177.6-174.20111.9K51 L52 T53 A59K51-K55 VanDerWaalsContact O-CB 3.25Å; K51-K55 WeakPolarHBondContact O-CB 3.24Å; K51-K55 PolarHBondContact O-N 3.28Å; K51-K55 VanDerWaalsContact O-N 3.08Å; L52-K55 PolarHBondContact O-N 3.09Å; T53-K55 VanDerWaalsContact C-N 3.34Å; T53-K55 PolarHBondContact O-N 2.71Å; K55-A59 WeakPolarHBondContact O-CB 3.33Å; K55-A59 PolarHBondContact O-N 3.47Å
56Q86.7Confident85.8Confident123 Ų12385 Ų8558%0.57542%0.415SS*.Hα-helixtrans-67.4-47.9-179.2-73.6177.8-20.600111.8L52 T53 A59L52-Q56 WeakPolarHBondContact O-CG 3.34Å; L52-Q56 PolarHBondContact O-N 2.84Å; T53-Q56 PolarHBondContact O-N 3.28Å; Q56-A59 PolarHBondContact O-N 2.92Å
57M84.4Confident85.5Confident12 Ų1287.7 Ų87.76%0.05944%0.435CS..Hα-helixtrans-66.9-40.8-178.8-64.4178.2110.300112.1T53 A59 H61 T215T53-M57 VanDerWaalsContact O-CG 3.31Å; T53-M57 WeakPolarHBondContact O-CG 3.42Å; T53-M57 PolarHBondContact O-N 3.43Å; M57-A59 VanDerWaalsContact C-N 3.3Å; M57-A59 PolarHBondContact O-N 2.96Å; M57-H61 PolarHBondContact O-CE1 3.38Å; M57-H61 PolarHBondContact O-ND1 3.05Å; M57-T215 VanDerWaalsContact CE-CB 3.48Å; M57-T215 WeakPolarHBondContact CE-OG1 3.34Å
58M84.7Confident85.3Confident14 Ų1485.6 Ų85.67%0.06942%0.423CS..Hα-helixtrans-77.3-15.3-177-64.3-61.2110.500113.6S54 M60 H61 R66 S69 L72S54-M58 WeakPolarHBondContact O-CB 3.26Å; S54-M58 WeakPolarHBondContact O-CG 3.3Å; S54-M58 PolarHBondContact O-N 3.19Å; M58-M60 PolarHBondContact O-N 3.35Å; M58-H61 PolarHBondContact O-N 2.93Å; M58-R66 HydrophobicContact CG-CG 4.29Å; M58-R66 HydrophobicContact SD-CB 4.36Å; M58-R66 HydrophobicContact SD-CG 3.82Å; M58-S69 WeakPolarHBondContact SD-CB 3.19Å; M58-L72 HydrophobicContact CE-CD1 3.77Å
59A84.4Confident85.1Confident85 Ų8579 Ų7970%0.70240%0.402SS*.THydrogen-bonded Turntrans-61.3-26.4176.100000112.7K55 Q56 M57K55-A59 WeakPolarHBondContact O-CB 3.33Å; K55-A59 PolarHBondContact O-N 3.47Å; Q56-A59 PolarHBondContact O-N 2.92Å; M57-A59 VanDerWaalsContact C-N 3.3Å; M57-A59 PolarHBondContact O-N 2.96Å
60M76.3Confident85.1Confident114 Ų11481.6 Ų81.656%0.56242%0.415SS*.THydrogen-bonded Turntrans-86.7-10-179.9-59-179.272.500113.6M58 H223M58-M60 PolarHBondContact O-N 3.35Å; M60-H223 PolarHBondContact O-CE1 3.47Å; M60-H223 PolarHBondContact O-ND1 2.96Å
61H81.5Confident85Confident19 Ų1981.5 Ų81.59%0.08841%0.414CS..  trans-110.3142.8-166.6-68.777000113.6M57 M58 S219M57-H61 PolarHBondContact O-CE1 3.38Å; M57-H61 PolarHBondContact O-ND1 3.05Å; M58-H61 PolarHBondContact O-N 2.93Å; H61-S219 PolarHBondContact NE2-O 3.1Å
62N79.1Confident85Confident104 Ų10474.3 Ų74.356%0.55638%0.383SS*.  trans-72.6170.9169.5-78.3-23.1000112.2K64 G65 R66N62-K64 VanDerWaalsContact C-N 3.27Å; N62-K64 PolarHBondContact O-N 3.37Å; N62-K64 VanDerWaalsContact O-N 3.16Å; N62-G65 PolarHBondContact O-N 2.87Å; N62-R66 PolarHBondContact O-N 3.37Å
63T79.2Confident85Confident127 Ų12771.8 Ų71.878%0.77937%0.37SS*.THydrogen-bonded Turntrans-53.5-37.5-176.4540000114.1
64K78.4Confident85.1Confident125 Ų12573.8 Ų73.854%0.54339%0.386SS..THydrogen-bonded Turntrans-68.3-45.4175.1-69.1-175.7-178.3177.70112.3N62 R66 T67N62-K64 VanDerWaalsContact C-N 3.27Å; N62-K64 PolarHBondContact O-N 3.37Å; N62-K64 VanDerWaalsContact O-N 3.16Å; K64-R66 PolarHBondContact O-N 2.99Å; K64-T67 WeakPolarHBondContact O-CB 3.49Å; K64-T67 PolarHBondContact O-N 3.3Å; K64-T67 PolarHBondContact O-OG1 3.46Å
65G77.6Confident85.2Confident0 Ų073.2 Ų73.20%038%0.38CS..G310 helixtrans-63.4-30.117700000112.7N62 T67 W68N62-G65 PolarHBondContact O-N 2.87Å; G65-T67 PolarHBondContact O-N 3.37Å; G65-T67 VanDerWaalsContact O-N 3.13Å; G65-W68 WeakPolarHBondContact O-CB 3.4Å; G65-W68 PolarHBondContact O-N 2.65Å
66R82.8Confident85.3Confident167 Ų16766.4 Ų66.463%0.6335%0.351SS*.G310 helixtrans-62.9-20.4177.4-153.4174.6-169.7-179.63.1114M58 N62 K64 W68 S69M58-R66 HydrophobicContact CG-CG 4.29Å; M58-R66 HydrophobicContact SD-CB 4.36Å; M58-R66 HydrophobicContact SD-CG 3.82Å; N62-R66 PolarHBondContact O-N 3.37Å; K64-R66 PolarHBondContact O-N 2.99Å; R66-W68 PolarHBondContact O-N 3.22Å; R66-S69 WeakPolarHBondContact O-CB 3.23Å; R66-S69 PolarHBondContact O-N 3.33Å; R66-S69 VanDerWaalsContact O-N 3.15Å
67T85.9Confident85.6Confident99 Ų9962.1 Ų62.161%0.60733%0.332SS*.G310 helixtrans-64.1-26.4174.161.60000112.6K64 G65 S69K64-T67 WeakPolarHBondContact O-CB 3.49Å; K64-T67 PolarHBondContact O-N 3.3Å; K64-T67 PolarHBondContact O-OG1 3.46Å; G65-T67 PolarHBondContact O-N 3.37Å; G65-T67 VanDerWaalsContact O-N 3.13Å; T67-S69 VanDerWaalsContact C-N 3.27Å; T67-S69 PolarHBondContact O-N 3.18Å
68W86.3Confident85.9Confident53 Ų5363.9 Ų63.920%0.20134%0.339CS..G310 helixtrans-84.10.9177.2-72.561.9000113.6G65 R66 L70 M71 L72 M115 L222G65-W68 WeakPolarHBondContact O-CB 3.4Å; G65-W68 PolarHBondContact O-N 2.65Å; R66-W68 PolarHBondContact O-N 3.22Å; W68-L70 VanDerWaalsContact C-N 3.3Å; W68-L70 PolarHBondContact O-N 3.03Å; W68-M71 HydrophobicContact CD2-CE 4.36Å; W68-M71 HydrophobicContact CE3-CE 3.17Å; W68-M71 HydrophobicContact CE3-SD 3.76Å; W68-M71 HydrophobicContact CZ3-CE 3.31Å; W68-M71 HydrophobicContact CZ3-SD 3.62Å; W68-M71 PolarHBondContact O-N 3.46Å; W68-M71 VanDerWaalsContact O-N 3.08Å; W68-L72 PolarHBondContact O-N 3.28Å; W68-M115 HydrophobicContact CZ2-SD 3.96Å; W68-M115 PolarHBondContact NE1-SD 3.38Å; W68-L222 HydrophobicContact CB-CD2 3.47Å; W68-L222 VanDerWaalsContact CB-CD2 3.47Å; W68-L222 HydrophobicContact CD2-CD1 3.85Å; W68-L222 HydrophobicContact CD2-CD2 4.19Å; W68-L222 HydrophobicContact CE3-CD1 4.2Å; W68-L222 HydrophobicContact CG-CD1 4Å; W68-L222 HydrophobicContact CG-CD2 3.63Å; W68-L222 HydrophobicContact CG-CG 4.49Å
69S87.3Confident86.2Confident28 Ų2863.2 Ų63.220%0.19634%0.336CS..Hα-helixtrans-52-47.7-179.2-178.50000112.5M58 R66 T67 M71 L72 V73M58-S69 WeakPolarHBondContact SD-CB 3.19Å; R66-S69 WeakPolarHBondContact O-CB 3.23Å; R66-S69 PolarHBondContact O-N 3.33Å; R66-S69 VanDerWaalsContact O-N 3.15Å; T67-S69 VanDerWaalsContact C-N 3.27Å; T67-S69 PolarHBondContact O-N 3.18Å; S69-M71 VanDerWaalsContact C-N 3.29Å; S69-M71 PolarHBondContact O-N 3.02Å; S69-L72 PolarHBondContact O-N 2.8Å; S69-V73 WeakPolarHBondContact O-CB 3.29Å; S69-V73 VanDerWaalsContact O-CG2 3.24Å; S69-V73 WeakPolarHBondContact O-CG2 3.48Å; S69-V73 PolarHBondContact O-N 3.37Å
70L90.8Very high86.5Confident149 Ų14960.6 Ų60.678%0.7832%0.315SS*.Hα-helixtrans-57.8-45.3-179.6-172.983.7000111W68 S74W68-L70 VanDerWaalsContact C-N 3.3Å; W68-L70 PolarHBondContact O-N 3.03Å; L70-S74 VanDerWaalsContact O-CB 3.3Å; L70-S74 WeakPolarHBondContact O-CB 3.44Å; L70-S74 PolarHBondContact O-N 3.08Å; L70-S74 PolarHBondContact O-OG 3.09Å
71M91.1Very high87.2Confident57 Ų5756.7 Ų56.728%0.28130%0.297SS..Hα-helixtrans-66.9-47.7-177-164.3-165.374.900111W68 S69 V73 S74 L75 L108W68-M71 HydrophobicContact CD2-CE 4.36Å; W68-M71 HydrophobicContact CE3-CE 3.17Å; W68-M71 HydrophobicContact CE3-SD 3.76Å; W68-M71 HydrophobicContact CZ3-CE 3.31Å; W68-M71 HydrophobicContact CZ3-SD 3.62Å; W68-M71 PolarHBondContact O-N 3.46Å; W68-M71 VanDerWaalsContact O-N 3.08Å; S69-M71 VanDerWaalsContact C-N 3.29Å; S69-M71 PolarHBondContact O-N 3.02Å; M71-V73 PolarHBondContact O-N 3.16Å; M71-S74 PolarHBondContact O-N 3.35Å; M71-S74 PolarHBondContact O-OG 3.3Å; M71-L75 VanDerWaalsContact O-CB 3.27Å; M71-L75 WeakPolarHBondContact O-CB 3.41Å; M71-L75 PolarHBondContact O-N 2.88Å; M71-L108 HydrophobicContact CE-CD2 3.12Å; M71-L108 HydrophobicContact CG-CD2 4.36Å; M71-L108 HydrophobicContact SD-CD2 3.55Å; M71-L108 VanDerWaalsContact SD-CD2 3.55Å
72L90.4Very high87.6Confident3 Ų356 Ų562%0.01629%0.294CS..Hα-helixtrans-61.3-42.9178.6-70.2170.4000112.3M58 W68 S69 L75 I76 V218M58-L72 HydrophobicContact CE-CD1 3.77Å; W68-L72 PolarHBondContact O-N 3.28Å; S69-L72 PolarHBondContact O-N 2.8Å; L72-L75 PolarHBondContact O-N 3.36Å; L72-I76 PolarHBondContact O-N 3.08Å; L72-V218 HydrophobicContact CD2-CB 4.2Å; L72-V218 HydrophobicContact CD2-CG1 3.83Å
73V91.5Very high88.2Confident14 Ų1451.1 Ų51.19%0.08527%0.268CS..Hα-helixtrans-68.1-42.3177.9172.60000111.2I50 S69 M71 L75 I76 I77I50-V73 HydrophobicContact CG2-CG1 3.91Å; S69-V73 WeakPolarHBondContact O-CB 3.29Å; S69-V73 VanDerWaalsContact O-CG2 3.24Å; S69-V73 WeakPolarHBondContact O-CG2 3.48Å; S69-V73 PolarHBondContact O-N 3.37Å; M71-V73 PolarHBondContact O-N 3.16Å; V73-L75 PolarHBondContact O-N 3.19Å; V73-I76 VanDerWaalsContact O-CG2 3.3Å; V73-I76 WeakPolarHBondContact O-CG2 3.02Å; V73-I77 HydrophobicContact CG1-CD1 3.8Å; V73-I77 VanDerWaalsContact O-CD1 3.28Å; V73-I77 WeakPolarHBondContact O-CD1 3.49Å; V73-I77 VanDerWaalsContact O-CG1 3.23Å; V73-I77 WeakPolarHBondContact O-CG1 3.19Å; V73-I77 PolarHBondContact O-N 3Å
74S91.5Very high88.7Confident67 Ų6749.6 Ų49.647%0.46926%0.255SS..Hα-helixtrans-61.8-36.5176.270.70000111.5L70 M71 F78L70-S74 VanDerWaalsContact O-CB 3.3Å; L70-S74 WeakPolarHBondContact O-CB 3.44Å; L70-S74 PolarHBondContact O-N 3.08Å; L70-S74 PolarHBondContact O-OG 3.09Å; M71-S74 PolarHBondContact O-N 3.35Å; M71-S74 PolarHBondContact O-OG 3.3Å; S74-F78 VanDerWaalsContact O-CB 3.32Å; S74-F78 WeakPolarHBondContact O-CB 3.47Å; S74-F78 PolarHBondContact O-N 3Å
75L90.8Very high89.3Confident17 Ų1745.3 Ų45.39%0.08924%0.238CC..Hα-helixtrans-74.7-42.6-176.3-169.2138.8000113.1M71 L72 V73 I77 F78 I79 L108 F214 T215M71-L75 VanDerWaalsContact O-CB 3.27Å; M71-L75 WeakPolarHBondContact O-CB 3.41Å; M71-L75 PolarHBondContact O-N 2.88Å; L72-L75 PolarHBondContact O-N 3.36Å; V73-L75 PolarHBondContact O-N 3.19Å; L75-I77 VanDerWaalsContact C-N 3.27Å; L75-I77 PolarHBondContact O-N 3.48Å; L75-F78 PolarHBondContact O-N 2.91Å; L75-I79 HydrophobicContact CD2-CD1 3.45Å; L75-I79 VanDerWaalsContact CD2-CD1 3.45Å; L75-I79 HydrophobicContact CD2-CG1 4.28Å; L75-I79 HydrophobicContact CG-CD1 4.08Å; L75-I79 WeakPolarHBondContact O-CG1 3.49Å; L75-I79 PolarHBondContact O-N 2.89Å; L75-L108 HydrophobicContact CD1-CD1 3.13Å; L75-L108 HydrophobicContact CD1-CD2 3.91Å; L75-L108 HydrophobicContact CD1-CG 4.13Å; L75-F214 HydrophobicContact CD1-CE1 4.24Å; L75-F214 HydrophobicContact CD2-CD1 3.45Å; L75-F214 VanDerWaalsContact CD2-CD1 3.45Å; L75-F214 HydrophobicContact CD2-CE1 3.52Å; L75-F214 HydrophobicContact CG-CE1 4.46Å; L75-T215 HydrophobicContact CD2-CG2 3.25Å; L75-T215 HydrophobicContact CG-CG2 4.48Å
76I91.5Very high89.6Confident18 Ų1845.4 Ų45.49%0.09224%0.239CC..Hα-helixtrans-61.9-40.6176.5-166.3171.6000110.7L72 V73 A80 A211 Y212 T215L72-I76 PolarHBondContact O-N 3.08Å; V73-I76 VanDerWaalsContact O-CG2 3.3Å; V73-I76 WeakPolarHBondContact O-CG2 3.02Å; I76-A80 WeakPolarHBondContact O-CB 3.21Å; I76-A80 PolarHBondContact O-N 3.39Å; I76-A211 HydrophobicContact CG1-CB 4.5Å; I76-Y212 HydrophobicContact CD1-CD2 4.15Å; I76-T215 VanDerWaalsContact CA-CG2 3.48Å; I76-T215 HydrophobicContact CB-CG2 3.47Å; I76-T215 VanDerWaalsContact CB-CG2 3.47Å; I76-T215 HydrophobicContact CG1-CG2 3.95Å
77I91.6Very high89.8Confident33 Ų3339.4 Ų39.417%0.16922%0.219CC..Hα-helixtrans-67.8-42.9178.5-63.2165.1000110.4I31 I50 V73 L75 T81I31-I77 HydrophobicContact CD1-CG2 3.39Å; I31-I77 HydrophobicContact CG1-CG2 4.47Å; I50-I77 HydrophobicContact CD1-CD1 4.06Å; I50-I77 HydrophobicContact CG1-CD1 3.7Å; V73-I77 HydrophobicContact CG1-CD1 3.8Å; V73-I77 VanDerWaalsContact O-CD1 3.28Å; V73-I77 WeakPolarHBondContact O-CD1 3.49Å; V73-I77 VanDerWaalsContact O-CG1 3.23Å; V73-I77 WeakPolarHBondContact O-CG1 3.19Å; V73-I77 PolarHBondContact O-N 3Å; L75-I77 VanDerWaalsContact C-N 3.27Å; L75-I77 PolarHBondContact O-N 3.48Å; I77-T81 HydrophobicContact CG2-CG2 4.3Å; I77-T81 WeakPolarHBondContact O-CB 3.06Å; I77-T81 VanDerWaalsContact O-CG2 3.27Å; I77-T81 WeakPolarHBondContact O-CG2 3.33Å; I77-T81 PolarHBondContact O-N 2.95Å; I77-T81 PolarHBondContact O-OG1 3.34Å
78F91Very high89.9Confident49 Ų4939.4 Ų39.422%0.21522%0.215CC..Hα-helixtrans-60.1-53.8177.7-179.7-104.6000111.7I24 S74 L75 A80 T81 T82 M100 M104I24-F78 HydrophobicContact CG2-CZ 4.31Å; S74-F78 VanDerWaalsContact O-CB 3.32Å; S74-F78 WeakPolarHBondContact O-CB 3.47Å; S74-F78 PolarHBondContact O-N 3Å; L75-F78 PolarHBondContact O-N 2.91Å; F78-A80 PolarHBondContact O-N 3.1Å; F78-T81 PolarHBondContact O-N 3.23Å; F78-T81 PolarHBondContact O-OG1 3.36Å; F78-T82 HydrophobicContact CD2-CG2 4.32Å; F78-T82 HydrophobicContact CE1-CG2 4.19Å; F78-T82 HydrophobicContact CE2-CG2 3.94Å; F78-T82 HydrophobicContact CZ-CG2 3.87Å; F78-T82 WeakPolarHBondContact O-CG2 2.98Å; F78-T82 PolarHBondContact O-N 3.29Å; F78-T82 PolarHBondContact O-OG1 3.23Å; F78-T82 VanDerWaalsContact O-OG1 3.09Å; F78-M100 HydrophobicContact CE1-CE 3.93Å; F78-M100 HydrophobicContact CZ-CE 3.92Å; F78-M104 HydrophobicContact CD1-SD 3.9Å; F78-M104 HydrophobicContact CE1-CE 4.13Å; F78-M104 HydrophobicContact CE1-SD 3.62Å
79I91.1Very high89.7Confident0 Ų042.3 Ų42.30%024%0.24CC..Hα-helixtrans-65-42.4-178.3-61.4176.3000111.1L75 T81 T82 N83 M104 L160 A211 F214L75-I79 HydrophobicContact CD2-CD1 3.45Å; L75-I79 VanDerWaalsContact CD2-CD1 3.45Å; L75-I79 HydrophobicContact CD2-CG1 4.28Å; L75-I79 HydrophobicContact CG-CD1 4.08Å; L75-I79 WeakPolarHBondContact O-CG1 3.49Å; L75-I79 PolarHBondContact O-N 2.89Å; I79-T81 PolarHBondContact O-N 3.13Å; I79-T82 WeakPolarHBondContact CA-OG1 3.37Å; I79-T82 PolarHBondContact O-N 2.92Å; I79-T82 PolarHBondContact O-OG1 3.35Å; I79-N83 WeakPolarHBondContact CG2-ND2 3.28Å; I79-N83 WeakPolarHBondContact O-CB 3.29Å; I79-N83 PolarHBondContact O-N 3.01Å; I79-N83 PolarHBondContact O-ND2 3.46Å; I79-N83 PolarHBondContact O-OD1 3.49Å; I79-M104 HydrophobicContact CG1-SD 4.47Å; I79-L160 HydrophobicContact CG2-CD1 4.08Å; I79-L160 HydrophobicContact CG2-CD2 4.12Å; I79-A211 HydrophobicContact CB-CB 4.06Å; I79-A211 HydrophobicContact CG2-CB 3.78Å; I79-F214 HydrophobicContact CD1-CB 4.29Å; I79-F214 HydrophobicContact CD1-CD1 3.53Å; I79-F214 HydrophobicContact CD1-CD2 4.19Å; I79-F214 HydrophobicContact CD1-CE1 3.84Å; I79-F214 HydrophobicContact CD1-CE2 4.43Å; I79-F214 HydrophobicContact CD1-CG 3.74Å; I79-F214 HydrophobicContact CD1-CZ 4.28Å
80A90.8Very high89.5Confident30 Ų3050.7 Ų50.725%0.24828%0.276CS..Hα-helixtrans-62.4-43.9179.100000111.6I76 F78 L84 A211I76-A80 WeakPolarHBondContact O-CB 3.21Å; I76-A80 PolarHBondContact O-N 3.39Å; F78-A80 PolarHBondContact O-N 3.1Å; A80-L84 VanDerWaalsContact O-CB 3.25Å; A80-L84 WeakPolarHBondContact O-CB 3.47Å; A80-L84 PolarHBondContact O-N 3.33Å; A80-A211 HydrophobicContact CB-CB 3.9Å
81T91Very high89.2Confident31 Ų3145.2 Ų45.219%0.1925%0.25CS..Hα-helixtrans-69.2-43.8178.9530000111.9P27 I77 F78 I79 N83 L84 L85P27-T81 WeakPolarHBondContact CB-OG1 3.42Å; I77-T81 HydrophobicContact CG2-CG2 4.3Å; I77-T81 WeakPolarHBondContact O-CB 3.06Å; I77-T81 VanDerWaalsContact O-CG2 3.27Å; I77-T81 WeakPolarHBondContact O-CG2 3.33Å; I77-T81 PolarHBondContact O-N 2.95Å; I77-T81 PolarHBondContact O-OG1 3.34Å; F78-T81 PolarHBondContact O-N 3.23Å; F78-T81 PolarHBondContact O-OG1 3.36Å; I79-T81 PolarHBondContact O-N 3.13Å; T81-N83 VanDerWaalsContact C-N 3.33Å; T81-N83 PolarHBondContact O-N 2.96Å; T81-L84 PolarHBondContact O-N 3.04Å; T81-L85 WeakPolarHBondContact O-CB 3.43Å; T81-L85 WeakPolarHBondContact O-CD1 3.38Å; T81-L85 PolarHBondContact O-N 2.95Å
82T90.9Very high88.7Confident5 Ų543.9 Ų43.93%0.03124%0.243CC..Hα-helixtrans-61.5-40.8176.952.20000112.5P27 F78 I79 G86 T95P27-T82 HydrophobicContact CB-CG2 4.29Å; P27-T82 HydrophobicContact CG-CG2 3.54Å; F78-T82 HydrophobicContact CD2-CG2 4.32Å; F78-T82 HydrophobicContact CE1-CG2 4.19Å; F78-T82 HydrophobicContact CE2-CG2 3.94Å; F78-T82 HydrophobicContact CZ-CG2 3.87Å; F78-T82 WeakPolarHBondContact O-CG2 2.98Å; F78-T82 PolarHBondContact O-N 3.29Å; F78-T82 PolarHBondContact O-OG1 3.23Å; F78-T82 VanDerWaalsContact O-OG1 3.09Å; I79-T82 WeakPolarHBondContact CA-OG1 3.37Å; I79-T82 PolarHBondContact O-N 2.92Å; I79-T82 PolarHBondContact O-OG1 3.35Å; T82-G86 PolarHBondContact O-N 3.36Å; T82-G86 VanDerWaalsContact O-N 3.1Å; T82-T95 WeakPolarHBondContact OG1-CG2 3.21Å
83N91Very high88.4Confident2 Ų243.9 Ų43.91%0.01124%0.243CC..Hα-helixtrans-70.8-41.6-179.3-66.3-10.2000111.4I79 T81 G86 L87 T95 L160 I164 A207I79-N83 WeakPolarHBondContact CG2-ND2 3.28Å; I79-N83 WeakPolarHBondContact O-CB 3.29Å; I79-N83 PolarHBondContact O-N 3.01Å; I79-N83 PolarHBondContact O-ND2 3.46Å; I79-N83 PolarHBondContact O-OD1 3.49Å; T81-N83 VanDerWaalsContact C-N 3.33Å; T81-N83 PolarHBondContact O-N 2.96Å; N83-G86 WeakPolarHBondContact O-CA 3.3Å; N83-G86 PolarHBondContact O-N 3.38Å; N83-G86 VanDerWaalsContact O-N 3.12Å; N83-L87 PolarHBondContact O-N 3.34Å; N83-T95 WeakPolarHBondContact OD1-CB 3.46Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.27Å; N83-T95 PolarHBondContact OD1-OG1 3.15Å; N83-L160 WeakPolarHBondContact ND2-CD1 3.4Å; N83-I164 HydrophobicContact CB-CD1 4.24Å; N83-I164 VanDerWaalsContact CG-CD1 3.4Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.29Å; N83-A207 HydrophobicContact CB-CB 3.9Å; N83-A207 PolarHBondContact ND2-O 3.11Å
84L89.9Confident88Confident95 Ų9543.7 Ų43.750%0.49724%0.242SC..Hα-helixtrans-70.8-38.9-178.4-163.7142.4000112A80 T81 G86 L87A80-L84 VanDerWaalsContact O-CB 3.25Å; A80-L84 WeakPolarHBondContact O-CB 3.47Å; A80-L84 PolarHBondContact O-N 3.33Å; T81-L84 PolarHBondContact O-N 3.04Å; L84-G86 PolarHBondContact O-N 3.32Å; L84-L87 PolarHBondContact O-N 3.08Å
85L89.8Confident87.7Confident35 Ų3540.6 Ų40.618%0.18322%0.22CC..Hα-helixtrans-61.5-32.3169.8-93.678.1000111.8F26 L30 T81 L87 L88 S91F26-L85 HydrophobicContact CD1-CD2 3.32Å; F26-L85 HydrophobicContact CE1-CD2 3.56Å; L30-L85 HydrophobicContact CD1-CD1 3.44Å; L30-L85 VanDerWaalsContact CD1-CD1 3.44Å; L30-L85 HydrophobicContact CD1-CD2 3.77Å; L30-L85 HydrophobicContact CD1-CG 4.09Å; T81-L85 WeakPolarHBondContact O-CB 3.43Å; T81-L85 WeakPolarHBondContact O-CD1 3.38Å; T81-L85 PolarHBondContact O-N 2.95Å; L85-L87 VanDerWaalsContact C-N 3.26Å; L85-L87 PolarHBondContact O-N 2.79Å; L85-L88 VanDerWaalsContact O-CB 3.24Å; L85-L88 WeakPolarHBondContact O-CB 3.5Å; L85-L88 VanDerWaalsContact O-CG 3.29Å; L85-L88 WeakPolarHBondContact O-CG 3.25Å; L85-L88 PolarHBondContact O-N 3.41Å; L85-L88 VanDerWaalsContact O-N 3.16Å; L85-S91 PolarHBondContact O-OG 3.48Å
86G85.7Confident87.5Confident2 Ų240.2 Ų40.22%0.02122%0.219CC..Hα-helixtrans-60-31.617800000116.4T82 N83 L84 L88 S91 H168T82-G86 PolarHBondContact O-N 3.36Å; T82-G86 VanDerWaalsContact O-N 3.1Å; N83-G86 WeakPolarHBondContact O-CA 3.3Å; N83-G86 PolarHBondContact O-N 3.38Å; N83-G86 VanDerWaalsContact O-N 3.12Å; L84-G86 PolarHBondContact O-N 3.32Å; G86-L88 PolarHBondContact O-N 3.25Å; G86-S91 VanDerWaalsContact C-OG 3.28Å; G86-S91 WeakPolarHBondContact CA-OG 3.34Å; G86-S91 PolarHBondContact O-OG 2.85Å; G86-H168 PolarHBondContact O-CE1 2.75Å; G86-H168 PolarHBondContact O-NE2 2.88Å
87L86.9Confident87.3Confident40 Ų4042.5 Ų42.521%0.20923%0.229CC..THydrogen-bonded Turntrans-75.7-6.1179.6-60.1175.2000112.5N83 L84 L85 M171 E203 I204 A207N83-L87 PolarHBondContact O-N 3.34Å; L84-L87 PolarHBondContact O-N 3.08Å; L85-L87 VanDerWaalsContact C-N 3.26Å; L85-L87 PolarHBondContact O-N 2.79Å; L87-M171 HydrophobicContact CD2-CE 3.95Å; L87-E203 HydrophobicContact CD1-CG 4.44Å; L87-E203 HydrophobicContact CD2-CB 4.18Å; L87-E203 HydrophobicContact CD2-CG 3.41Å; L87-E203 VanDerWaalsContact CD2-CG 3.41Å; L87-I204 HydrophobicContact CD1-CB 4.21Å; L87-I204 HydrophobicContact CD1-CG1 3.61Å; L87-A207 HydrophobicContact CD1-CB 4.11Å
88L87.6Confident87.1Confident100 Ų10044.3 Ų44.352%0.52424%0.238SC..SBendtrans-67.4143.2174.6-65.3173.3000110.6L85 G86 H90 S91L85-L88 VanDerWaalsContact O-CB 3.24Å; L85-L88 WeakPolarHBondContact O-CB 3.5Å; L85-L88 VanDerWaalsContact O-CG 3.29Å; L85-L88 WeakPolarHBondContact O-CG 3.25Å; L85-L88 PolarHBondContact O-N 3.41Å; L85-L88 VanDerWaalsContact O-N 3.16Å; G86-L88 PolarHBondContact O-N 3.25Å; L88-H90 PolarHBondContact O-N 3.08Å; L88-S91 WeakPolarHBondContact O-CB 3.46Å; L88-S91 PolarHBondContact O-N 3.28Å; L88-S91 VanDerWaalsContact O-N 3.15Å; L88-S91 PolarHBondContact O-OG 3.31Å
89P82.3Confident86.9Confident114 Ų11445.9 Ų45.974%0.7426%0.256SS*.THydrogen-bonded Turntrans-58.7134.2-179.224.7-33.9000110.7S91P89-S91 PolarHBondContact O-N 3.42Å; P89-S91 VanDerWaalsContact O-N 3.12Å
90H82.4Confident86.7Confident203 Ų20347.9 Ų47.994%0.9427%0.266SS*.THydrogen-bonded Turntrans57.916.9-179-56.6-62.1000115.9L88L88-H90 PolarHBondContact O-N 3.08Å
91S83.8Confident86.6Confident35 Ų3546.4 Ų46.425%0.24525%0.254CS..  trans-81.3141.3172.272.50000111.2L85 G86 L88 P89L85-S91 PolarHBondContact O-OG 3.48Å; G86-S91 VanDerWaalsContact C-OG 3.28Å; G86-S91 WeakPolarHBondContact CA-OG 3.34Å; G86-S91 PolarHBondContact O-OG 2.85Å; L88-S91 WeakPolarHBondContact O-CB 3.46Å; L88-S91 PolarHBondContact O-N 3.28Å; L88-S91 VanDerWaalsContact O-N 3.15Å; L88-S91 PolarHBondContact O-OG 3.31Å; P89-S91 PolarHBondContact O-N 3.42Å; P89-S91 VanDerWaalsContact O-N 3.12Å
92F82.3Confident86.4Confident28 Ų2846.9 Ų46.912%0.12326%0.255CS..  trans-87.9123.9171.6173.1-94.7000109.3S8 A11 P12 A20 I23 P94 Q97S8-F92 WeakPolarHBondContact O-CD2 3.09Å; A11-F92 HydrophobicContact CB-CZ 4.46Å; P12-F92 HydrophobicContact CG-CB 4.38Å; P12-F92 HydrophobicContact CG-CD1 4.18Å; P12-F92 HydrophobicContact CG-CD2 4.47Å; P12-F92 HydrophobicContact CG-CG 4.09Å; A20-F92 HydrophobicContact CB-CE1 4.37Å; I23-F92 HydrophobicContact CD1-CB 4.1Å; I23-F92 HydrophobicContact CD1-CD1 3.96Å; I23-F92 HydrophobicContact CD1-CG 4.39Å; I23-F92 HydrophobicContact CG2-CD1 4.43Å; I23-F92 WeakPolarHBondContact CG2-O 3.3Å; F92-P94 HydrophobicContact CE1-CB 4.47Å; F92-P94 WeakPolarHBondContact O-CD 3.35Å; F92-Q97 HydrophobicContact CZ-CG 4.16Å
93T83.8Confident86.3Confident4 Ų449.8 Ų49.83%0.02528%0.279CS..  trans-93.6111.2178.529.80000111.3T95 T96 I164T93-T95 PolarHBondContact O-N 3.46Å; T93-T96 PolarHBondContact O-N 3.37Å; T93-T96 PolarHBondContact O-OG1 3.03Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.13Å; T93-I164 HydrophobicContact CG2-CG2 4.33Å
94P82.4Confident86Confident10 Ų1051 Ų517%0.06529%0.285CS..G310 helixtrans-64.1-23.617726.2-33.5000112.7I24 F92 T96 Q97 M100I24-P94 HydrophobicContact CD1-CB 4.25Å; I24-P94 HydrophobicContact CG1-CB 3.69Å; I24-P94 HydrophobicContact CG1-CG 4.04Å; F92-P94 HydrophobicContact CE1-CB 4.47Å; F92-P94 WeakPolarHBondContact O-CD 3.35Å; P94-T96 VanDerWaalsContact C-N 3.27Å; P94-T96 PolarHBondContact O-N 3.44Å; P94-Q97 PolarHBondContact O-N 3.44Å; P94-M100 WeakPolarHBondContact O-CB 3.38Å
95T85.3Confident85.8Confident1 Ų146.5 Ų46.51%0.00626%0.262CS..G310 helixtrans-76.3-7.2179.251.30000114.4T82 N83 T93 Q97 N101 L160 I164T82-T95 WeakPolarHBondContact OG1-CG2 3.21Å; N83-T95 WeakPolarHBondContact OD1-CB 3.46Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.27Å; N83-T95 PolarHBondContact OD1-OG1 3.15Å; T93-T95 PolarHBondContact O-N 3.46Å; T95-Q97 VanDerWaalsContact C-N 3.33Å; T95-N101 PolarHBondContact O-ND2 3.42Å; T95-L160 HydrophobicContact CG2-CD2 4.47Å; T95-I164 VanDerWaalsContact OG1-CD1 3.3Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.24Å
96T85.7Confident85.8Confident10 Ų1048.7 Ų48.76%0.06127%0.273CS..G310 helixtrans-74.8-26.7169.556.60000112.4F9 T93 P94 L98 T161 I164 T165F9-T96 HydrophobicContact CD1-CG2 3.88Å; F9-T96 HydrophobicContact CE1-CG2 3.77Å; T93-T96 PolarHBondContact O-N 3.37Å; T93-T96 PolarHBondContact O-OG1 3.03Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.13Å; P94-T96 VanDerWaalsContact C-N 3.27Å; P94-T96 PolarHBondContact O-N 3.44Å; T96-L98 PolarHBondContact O-N 3.13Å; T96-T161 WeakPolarHBondContact O-CG2 3.48Å; T96-I164 HydrophobicContact CG2-CB 4.34Å; T96-I164 HydrophobicContact CG2-CG2 3.64Å; T96-T165 HydrophobicContact CG2-CG2 3.76Å
97Q88.8Confident85.9Confident66 Ų6652.5 Ų52.531%0.30830%0.297SS..SBendtrans-78119.6178.2-66.2-63.9-28.800109.7F9 F92 P94 T95 S99 M100 N101F9-Q97 PolarHBondContact O-NE2 3.33Å; F92-Q97 HydrophobicContact CZ-CG 4.16Å; P94-Q97 PolarHBondContact O-N 3.44Å; T95-Q97 VanDerWaalsContact C-N 3.33Å; Q97-S99 PolarHBondContact O-N 2.88Å; Q97-M100 PolarHBondContact O-N 3.38Å; Q97-M100 VanDerWaalsContact O-N 3.1Å; Q97-N101 PolarHBondContact O-N 3.04Å
98L86.6Confident85.9Confident70 Ų7051.4 Ų51.437%0.36629%0.292SS..Hα-helixtrans-57.6-33.7178.7-177.264.5000112.1T96 M100 N101 L102 A157 V158 T161T96-L98 PolarHBondContact O-N 3.13Å; L98-M100 VanDerWaalsContact C-N 3.32Å; L98-M100 PolarHBondContact O-N 3.39Å; L98-N101 PolarHBondContact O-N 2.84Å; L98-L102 VanDerWaalsContact O-CB 3.23Å; L98-L102 WeakPolarHBondContact O-CB 3.31Å; L98-L102 PolarHBondContact O-N 2.94Å; L98-A157 HydrophobicContact CD1-CB 4.37Å; L98-V158 HydrophobicContact CD1-CG2 3.88Å; L98-T161 VanDerWaalsContact CA-CG2 3.45Å; L98-T161 HydrophobicContact CB-CG2 4.03Å; L98-T161 HydrophobicContact CD1-CG2 4Å
99S87.5Confident85.9Confident83 Ų8348.5 Ų48.558%0.5827%0.274SS*.Hα-helixtrans-56.2-43.8176.655.70000112.6Q97 A103Q97-S99 PolarHBondContact O-N 2.88Å; S99-A103 WeakPolarHBondContact O-CB 3.49Å; S99-A103 PolarHBondContact O-N 3.25Å
100M87.3Confident86Confident41 Ų4144.4 Ų44.420%0.20225%0.249CC..Hα-helixtrans-67.7-46.2-179.1-176.662.3-172.500111.4I24 F78 P94 Q97 L98 L102 A103 M104I24-M100 HydrophobicContact CD1-SD 4.33Å; I24-M100 HydrophobicContact CG2-CE 4.3Å; F78-M100 HydrophobicContact CE1-CE 3.93Å; F78-M100 HydrophobicContact CZ-CE 3.92Å; P94-M100 WeakPolarHBondContact O-CB 3.38Å; Q97-M100 PolarHBondContact O-N 3.38Å; Q97-M100 VanDerWaalsContact O-N 3.1Å; L98-M100 VanDerWaalsContact C-N 3.32Å; L98-M100 PolarHBondContact O-N 3.39Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 3.48Å; M100-A103 PolarHBondContact O-N 3.38Å; M100-M104 HydrophobicContact CE-CE 3.84Å; M100-M104 HydrophobicContact CE-CG 4.32Å; M100-M104 HydrophobicContact CE-SD 4.17Å; M100-M104 HydrophobicContact CG-CE 3.73Å; M100-M104 PolarHBondContact O-N 3.13Å; M100-M104 HydrophobicContact SD-CE 4.47Å
101N87.9Confident86.1Confident0 Ų035.8 Ų35.80%022%0.215CC..Hα-helixtrans-67.4-37.6-179.3-66.7-10.4000111.8T95 Q97 L98 M104 A105 A157 L160 T161T95-N101 PolarHBondContact O-ND2 3.42Å; Q97-N101 PolarHBondContact O-N 3.04Å; L98-N101 PolarHBondContact O-N 2.84Å; N101-M104 PolarHBondContact O-N 3.22Å; N101-A105 VanDerWaalsContact O-CB 3.29Å; N101-A105 WeakPolarHBondContact O-CB 3.17Å; N101-A105 PolarHBondContact O-N 3.47Å; N101-A157 HydrophobicContact CB-CB 3.92Å; N101-A157 PolarHBondContact ND2-O 3.32Å; N101-L160 HydrophobicContact CB-CD2 4.37Å; N101-L160 VanDerWaalsContact CG-CD2 3.47Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.31Å; N101-L160 VanDerWaalsContact ND2-CG 3.35Å; N101-L160 WeakPolarHBondContact ND2-CG 3.42Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.48Å; N101-T161 HydrophobicContact CB-CG2 4.31Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.4Å; N101-T161 PolarHBondContact ND2-N 3.27Å
102L86.1Confident86.1Confident41 Ų4134.2 Ų34.222%0.21520%0.204CC..Hα-helixtrans-70-38.8177-159.872.8000111.5L98 M100 M104 A105 I106 M154 A157L98-L102 VanDerWaalsContact O-CB 3.23Å; L98-L102 WeakPolarHBondContact O-CB 3.31Å; L98-L102 PolarHBondContact O-N 2.94Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 3.48Å; L102-M104 VanDerWaalsContact C-N 3.26Å; L102-M104 PolarHBondContact O-N 3.4Å; L102-A105 PolarHBondContact O-N 2.91Å; L102-I106 HydrophobicContact CD1-CD1 3.99Å; L102-I106 HydrophobicContact CD1-CG1 4.12Å; L102-I106 HydrophobicContact CD2-CD1 3.93Å; L102-I106 HydrophobicContact CG-CD1 3.54Å; L102-I106 HydrophobicContact CG-CG1 4.01Å; L102-I106 WeakPolarHBondContact O-CG1 3.46Å; L102-I106 PolarHBondContact O-N 3.37Å; L102-M154 HydrophobicContact CD1-CE 4.3Å; L102-M154 HydrophobicContact CD1-CG 4.29Å; L102-M154 HydrophobicContact CD2-CE 4.36Å; L102-A157 HydrophobicContact CB-CB 4.47Å; L102-A157 HydrophobicContact CD1-CB 4.02Å
103A88.8Confident86.1Confident65 Ų6533.5 Ų33.554%0.53720%0.202SC..Hα-helixtrans-63.3-30.1173.800000112.8S99 M100 P107S99-A103 WeakPolarHBondContact O-CB 3.49Å; S99-A103 PolarHBondContact O-N 3.25Å; M100-A103 PolarHBondContact O-N 3.38Å; A103-P107 WeakPolarHBondContact O-CD 3.36Å; A103-P107 WeakPolarHBondContact O-CG 3.42Å
104M85.4Confident86.1Confident27 Ų2738 Ų3813%0.13323%0.225CC..Hα-helixtrans-77.5-48.2170.3-70.6-172.3-91.200112F78 I79 M100 N101 L102 L108F78-M104 HydrophobicContact CD1-SD 3.9Å; F78-M104 HydrophobicContact CE1-CE 4.13Å; F78-M104 HydrophobicContact CE1-SD 3.62Å; I79-M104 HydrophobicContact CG1-SD 4.47Å; M100-M104 HydrophobicContact CE-CE 3.84Å; M100-M104 HydrophobicContact CE-CG 4.32Å; M100-M104 HydrophobicContact CE-SD 4.17Å; M100-M104 HydrophobicContact CG-CE 3.73Å; M100-M104 PolarHBondContact O-N 3.13Å; M100-M104 HydrophobicContact SD-CE 4.47Å; N101-M104 PolarHBondContact O-N 3.22Å; L102-M104 VanDerWaalsContact C-N 3.26Å; L102-M104 PolarHBondContact O-N 3.4Å; M104-L108 WeakPolarHBondContact O-CD1 3.45Å; M104-L108 WeakPolarHBondContact O-CG 3.47Å
105A86.4Confident86.1Confident2 Ų239.8 Ų39.82%0.01723%0.233CC..Hα-helixtrans-68.9-43.9-170.900000113.9N101 L102 L108 W109 A157 F214N101-A105 VanDerWaalsContact O-CB 3.29Å; N101-A105 WeakPolarHBondContact O-CB 3.17Å; N101-A105 PolarHBondContact O-N 3.47Å; L102-A105 PolarHBondContact O-N 2.91Å; A105-L108 PolarHBondContact O-N 2.99Å; A105-W109 WeakPolarHBondContact O-CB 3.28Å; A105-W109 PolarHBondContact O-N 2.96Å; A105-A157 HydrophobicContact CB-CB 4.24Å; A105-F214 HydrophobicContact CB-CE2 4.33Å; A105-F214 HydrophobicContact CB-CZ 4.15Å
106I87.9Confident85.6Confident81 Ų8139.8 Ų39.842%0.41523%0.233SC..Hα-helixtrans-62.6-50.5-175-67175.8000111.9L102 L108 W109 A110L102-I106 HydrophobicContact CD1-CD1 3.99Å; L102-I106 HydrophobicContact CD1-CG1 4.12Å; L102-I106 HydrophobicContact CD2-CD1 3.93Å; L102-I106 HydrophobicContact CG-CD1 3.54Å; L102-I106 HydrophobicContact CG-CG1 4.01Å; L102-I106 WeakPolarHBondContact O-CG1 3.46Å; L102-I106 PolarHBondContact O-N 3.37Å; I106-L108 VanDerWaalsContact C-N 3.34Å; I106-L108 PolarHBondContact O-N 3.15Å; I106-W109 PolarHBondContact O-N 2.93Å; I106-A110 WeakPolarHBondContact O-CB 3.37Å; I106-A110 PolarHBondContact O-N 3.47Å
107P89.1Confident85.2Confident81 Ų8143 Ų4353%0.52625%0.247SC..Hα-helixtrans-63.7-37.2-179.1-24.936.5000113.4A103 G111A103-P107 WeakPolarHBondContact O-CD 3.36Å; A103-P107 WeakPolarHBondContact O-CG 3.42Å; P107-G111 PolarHBondContact O-N 2.85Å
108L87.3Confident84.6Confident18 Ų1850.2 Ų50.29%0.09427%0.271CS..Hα-helixtrans-65.6-47.7178.7-68.2163.3000111.6M71 L75 M104 A105 I106 G111 A112 F214 V218M71-L108 HydrophobicContact CE-CD2 3.12Å; M71-L108 HydrophobicContact CG-CD2 4.36Å; M71-L108 HydrophobicContact SD-CD2 3.55Å; M71-L108 VanDerWaalsContact SD-CD2 3.55Å; L75-L108 HydrophobicContact CD1-CD1 3.13Å; L75-L108 HydrophobicContact CD1-CD2 3.91Å; L75-L108 HydrophobicContact CD1-CG 4.13Å; M104-L108 WeakPolarHBondContact O-CD1 3.45Å; M104-L108 WeakPolarHBondContact O-CG 3.47Å; A105-L108 PolarHBondContact O-N 2.99Å; I106-L108 VanDerWaalsContact C-N 3.34Å; I106-L108 PolarHBondContact O-N 3.15Å; L108-G111 PolarHBondContact O-N 3.08Å; L108-A112 PolarHBondContact O-N 2.69Å; L108-F214 HydrophobicContact CD1-CE1 4.01Å; L108-F214 HydrophobicContact CD1-CZ 4.33Å; L108-V218 HydrophobicContact CB-CG1 4.38Å
109W86.1Confident83.8Confident39 Ų3949.1 Ų49.115%0.14827%0.269CS..Hα-helixtrans-64.4-46.9177172.390000111A105 I106 G111 A112 V113 L149 L150 P153A105-W109 WeakPolarHBondContact O-CB 3.28Å; A105-W109 PolarHBondContact O-N 2.96Å; I106-W109 PolarHBondContact O-N 2.93Å; W109-G111 VanDerWaalsContact C-N 3.28Å; W109-G111 PolarHBondContact O-N 3.19Å; W109-A112 PolarHBondContact O-N 3.15Å; W109-A112 VanDerWaalsContact O-N 3.15Å; W109-V113 HydrophobicContact CD2-CG2 4.07Å; W109-V113 HydrophobicContact CH2-CG2 4.37Å; W109-V113 HydrophobicContact CZ2-CG2 3.89Å; W109-V113 WeakPolarHBondContact O-CG2 3.46Å; W109-V113 PolarHBondContact O-N 3.29Å; W109-L149 HydrophobicContact CH2-CD2 4.11Å; W109-L149 HydrophobicContact CZ2-CD2 3.45Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.45Å; W109-L149 HydrophobicContact CZ2-CG 3.91Å; W109-L149 VanDerWaalsContact CZ2-O 3.26Å; W109-L149 WeakPolarHBondContact CZ2-O 3.06Å; W109-L149 PolarHBondContact NE1-O 3.21Å; W109-L150 HydrophobicContact CH2-CD2 3.76Å; W109-L150 HydrophobicContact CZ2-CD2 4.3Å; W109-P153 HydrophobicContact CB-CB 3.87Å; W109-P153 HydrophobicContact CB-CG 4.37Å; W109-P153 HydrophobicContact CD2-CB 4.28Å; W109-P153 HydrophobicContact CD2-CG 3.8Å; W109-P153 HydrophobicContact CE3-CG 4.34Å; W109-P153 HydrophobicContact CG-CB 3.8Å; W109-P153 HydrophobicContact CG-CG 3.79Å
110A85.3Confident83Confident27 Ų2749.8 Ų49.822%0.22326%0.262CS..Hα-helixtrans-60.3-41.2178.100000110.9I106 V113 I114I106-A110 WeakPolarHBondContact O-CB 3.37Å; I106-A110 PolarHBondContact O-N 3.47Å; A110-V113 PolarHBondContact O-N 3.3Å; A110-I114 VanDerWaalsContact O-CB 3.3Å; A110-I114 WeakPolarHBondContact O-CB 3.43Å; A110-I114 WeakPolarHBondContact O-CD1 3.49Å; A110-I114 WeakPolarHBondContact O-CG1 3.42Å; A110-I114 PolarHBondContact O-N 3.43Å
111G85.4Confident81.9Confident22 Ų2253 Ų5323%0.22728%0.278CS..Hα-helixtrans-59.7-45.5174.600000113.1P107 L108 W109 M115P107-G111 PolarHBondContact O-N 2.85Å; L108-G111 PolarHBondContact O-N 3.08Å; W109-G111 VanDerWaalsContact C-N 3.28Å; W109-G111 PolarHBondContact O-N 3.19Å; G111-M115 WeakPolarHBondContact O-CB 3.4Å; G111-M115 PolarHBondContact O-N 2.83Å
112A83.1Confident80.7Confident2 Ų261.9 Ų61.92%0.01732%0.317CS..Hα-helixtrans-63.2-45.817700000111.9L108 W109 M115 G116L108-A112 PolarHBondContact O-N 2.69Å; W109-A112 PolarHBondContact O-N 3.15Å; W109-A112 VanDerWaalsContact O-N 3.15Å; A112-M115 PolarHBondContact O-N 2.86Å; A112-G116 PolarHBondContact O-N 3.2Å
113V82.8Confident79.8Confident14 Ų1464.9 Ų64.99%0.08533%0.333CS..Hα-helixtrans-64.8-46.5179172.40000111.4W109 A110 M115 G116 F117W109-V113 HydrophobicContact CD2-CG2 4.07Å; W109-V113 HydrophobicContact CH2-CG2 4.37Å; W109-V113 HydrophobicContact CZ2-CG2 3.89Å; W109-V113 WeakPolarHBondContact O-CG2 3.46Å; W109-V113 PolarHBondContact O-N 3.29Å; A110-V113 PolarHBondContact O-N 3.3Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 3.2Å; V113-G116 PolarHBondContact O-N 3.29Å; V113-G116 VanDerWaalsContact O-N 3.13Å; V113-F117 HydrophobicContact CG1-CD2 3.62Å; V113-F117 HydrophobicContact CG1-CE2 3.37Å; V113-F117 WeakPolarHBondContact O-CD2 3.23Å; V113-F117 PolarHBondContact O-N 3.29Å
114I83.8Confident78.6Confident98 Ų9862.6 Ų62.650%0.50331%0.314SS..Hα-helixtrans-60.9-39.4176.8-68.6163.8000110.5A110 G116 F117 R118A110-I114 VanDerWaalsContact O-CB 3.3Å; A110-I114 WeakPolarHBondContact O-CB 3.43Å; A110-I114 WeakPolarHBondContact O-CD1 3.49Å; A110-I114 WeakPolarHBondContact O-CG1 3.42Å; A110-I114 PolarHBondContact O-N 3.43Å; I114-G116 VanDerWaalsContact C-N 3.34Å; I114-F117 PolarHBondContact O-N 2.92Å; I114-R118 HydrophobicContact CG2-CG 4.4Å; I114-R118 WeakPolarHBondContact O-CB 3.3Å; I114-R118 VanDerWaalsContact O-CG 3.3Å; I114-R118 WeakPolarHBondContact O-CG 2.99Å; I114-R118 PolarHBondContact O-N 2.7Å
115M80.7Confident77.6Confident47 Ų4765.7 Ų65.723%0.23233%0.331CS..Hα-helixtrans-65.8-37.5176.3-170.8168.4-177.200112.2W68 G111 A112 V113 R118 S119 L222W68-M115 HydrophobicContact CZ2-SD 3.96Å; W68-M115 PolarHBondContact NE1-SD 3.38Å; G111-M115 WeakPolarHBondContact O-CB 3.4Å; G111-M115 PolarHBondContact O-N 2.83Å; A112-M115 PolarHBondContact O-N 2.86Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 3.2Å; M115-R118 PolarHBondContact O-N 3.19Å; M115-S119 WeakPolarHBondContact O-CB 3.4Å; M115-S119 PolarHBondContact O-N 3.09Å; M115-S119 PolarHBondContact O-OG 3.14Å; M115-S119 VanDerWaalsContact O-OG 3.1Å; M115-L222 HydrophobicContact SD-CD1 4.25Å
116G75.5Confident76.4Confident1 Ų168.2 Ų68.21%0.0135%0.352CS..Hα-helixtrans-61.5-51.317300000112.8A112 V113 I114 R118 S119 K120 N225A112-G116 PolarHBondContact O-N 3.2Å; V113-G116 PolarHBondContact O-N 3.29Å; V113-G116 VanDerWaalsContact O-N 3.13Å; I114-G116 VanDerWaalsContact C-N 3.34Å; G116-R118 VanDerWaalsContact C-N 3.31Å; G116-R118 PolarHBondContact O-N 3.18Å; G116-S119 PolarHBondContact O-N 2.97Å; G116-S119 PolarHBondContact O-OG 2.95Å; G116-K120 PolarHBondContact O-N 3.18Å; G116-N225 VanDerWaalsContact CA-O 3.24Å; G116-N225 WeakPolarHBondContact CA-O 3.32Å
117F77.8Confident75.3Confident79 Ų7969.5 Ų69.535%0.34636%0.356SS..Hα-helixtrans-59.8-40175.6-77.4-65.4000112.2V113 I114 I121 A124 L125 F128V113-F117 HydrophobicContact CG1-CD2 3.62Å; V113-F117 HydrophobicContact CG1-CE2 3.37Å; V113-F117 WeakPolarHBondContact O-CD2 3.23Å; V113-F117 PolarHBondContact O-N 3.29Å; I114-F117 PolarHBondContact O-N 2.92Å; F117-I121 WeakPolarHBondContact O-CG1 3.28Å; F117-A124 HydrophobicContact CD1-CB 4.3Å; F117-A124 HydrophobicContact CE1-CB 4.38Å; F117-L125 HydrophobicContact CD1-CD1 4.18Å; F117-L125 HydrophobicContact CE1-CD1 3.79Å; F117-F128 HydrophobicContact CZ-CE2 4.44Å
118R76.9Confident74Confident217 Ų21767.3 Ų67.382%0.81934%0.338SS*.Hα-helixtrans-70.6-33.6178.8-73.9-178.769.6-168.21.7113.6I114 M115 G116I114-R118 HydrophobicContact CG2-CG 4.4Å; I114-R118 WeakPolarHBondContact O-CB 3.3Å; I114-R118 VanDerWaalsContact O-CG 3.3Å; I114-R118 WeakPolarHBondContact O-CG 2.99Å; I114-R118 PolarHBondContact O-N 2.7Å; M115-R118 PolarHBondContact O-N 3.19Å; G116-R118 VanDerWaalsContact C-N 3.31Å; G116-R118 PolarHBondContact O-N 3.18Å
119S69Low72.8Confident47 Ų4769.5 Ų69.533%0.32935%0.35SS..Hα-helixtrans-89.5-39.1-172.8730000113.5M115 G116 N225M115-S119 WeakPolarHBondContact O-CB 3.4Å; M115-S119 PolarHBondContact O-N 3.09Å; M115-S119 PolarHBondContact O-OG 3.14Å; M115-S119 VanDerWaalsContact O-OG 3.1Å; G116-S119 PolarHBondContact O-N 2.97Å; G116-S119 PolarHBondContact O-OG 2.95Å; S119-N225 PolarHBondContact OG-O 2.99Å
120K69.8Low71.5Confident96 Ų9671 Ų7142%0.41736%0.364SS..  trans-14872.9-177.2-67.7177.4-178.7159.40111.6G116 K122 N123 A124 T226G116-K120 PolarHBondContact O-N 3.18Å; K120-K122 VanDerWaalsContact C-N 3.28Å; K120-K122 PolarHBondContact O-N 3.35Å; K120-N123 HydrophobicContact CB-CB 3.91Å; K120-N123 HydrophobicContact CD-CB 4.25Å; K120-N123 PolarHBondContact O-N 3.36Å; K120-N123 VanDerWaalsContact O-N 3.12Å; K120-A124 WeakPolarHBondContact O-CB 3.08Å; K120-A124 PolarHBondContact O-N 3.46Å; K120-T226 WeakPolarHBondContact CE-O 3.33Å; K120-T226 PolarHBondContact NZ-O 3.49Å
121I65.8Low70.3Confident108 Ų10879.4 Ų79.455%0.55440%0.399SS*.Hα-helixtrans-47.7-49.6177-59.7170.3000111.7F117 N123 A124 L125F117-I121 WeakPolarHBondContact O-CG1 3.28Å; I121-N123 PolarHBondContact O-N 2.95Å; I121-A124 PolarHBondContact O-N 3.29Å; I121-L125 HydrophobicContact CG2-CD1 3.8Å; I121-L125 WeakPolarHBondContact O-CD1 3.35Å; I121-L125 PolarHBondContact O-N 3.34Å
122K62.7Low69.2Low188 Ų18882.2 Ų82.282%0.81743%0.428SS*.Hα-helixtrans-65.8-36.9-176.1-65.2-176179.8-177.70113.4K120 A126K120-K122 VanDerWaalsContact C-N 3.28Å; K120-K122 PolarHBondContact O-N 3.35Å; K122-A126 VanDerWaalsContact O-CB 3.26Å; K122-A126 WeakPolarHBondContact O-CB 3.3Å; K122-A126 PolarHBondContact O-N 2.97Å
123N67.1Low68.6Low103 Ų10383.8 Ų83.855%0.55144%0.437SS*.Hα-helixtrans-79.1-36.6-178.4-15062.2000111.3K120 I121 A126 H127K120-N123 HydrophobicContact CB-CB 3.91Å; K120-N123 HydrophobicContact CD-CB 4.25Å; K120-N123 PolarHBondContact O-N 3.36Å; K120-N123 VanDerWaalsContact O-N 3.12Å; I121-N123 PolarHBondContact O-N 2.95Å; N123-A126 PolarHBondContact O-N 3.31Å; N123-H127 PolarHBondContact O-N 3.3Å; N123-H127 VanDerWaalsContact O-N 3.1Å
124A63.4Low68.1Low17 Ų1786.8 Ų86.814%0.1446%0.457CS..Hα-helixtrans-63.1-42.5173.500000111.5F117 K120 I121 H127F117-A124 HydrophobicContact CD1-CB 4.3Å; F117-A124 HydrophobicContact CE1-CB 4.38Å; K120-A124 WeakPolarHBondContact O-CB 3.08Å; K120-A124 PolarHBondContact O-N 3.46Å; I121-A124 PolarHBondContact O-N 3.29Å; A124-H127 PolarHBondContact O-N 3.36Å
125L62.9Low67.7Low93 Ų9387.8 Ų87.849%0.48747%0.468SS..Hα-helixtrans-70.4-32.4174.4-86.782.6000112.8F117 I121 H127 F128F117-L125 HydrophobicContact CD1-CD1 4.18Å; F117-L125 HydrophobicContact CE1-CD1 3.79Å; I121-L125 HydrophobicContact CG2-CD1 3.8Å; I121-L125 WeakPolarHBondContact O-CD1 3.35Å; I121-L125 PolarHBondContact O-N 3.34Å; L125-H127 VanDerWaalsContact C-N 3.29Å; L125-H127 PolarHBondContact O-N 3.25Å; L125-F128 PolarHBondContact O-N 3.31Å
126A62Low67.7Low54 Ų5490.5 Ų90.545%0.44649%0.489SS..Hα-helixtrans-67.7-28.1176.900000112.6K122 N123 F128 L129K122-A126 VanDerWaalsContact O-CB 3.26Å; K122-A126 WeakPolarHBondContact O-CB 3.3Å; K122-A126 PolarHBondContact O-N 2.97Å; N123-A126 PolarHBondContact O-N 3.31Å; A126-F128 PolarHBondContact O-N 3.35Å; A126-L129 PolarHBondContact O-N 2.92Å; A126-L129 VanDerWaalsContact O-N 3.08Å
127H64.6Low67.9Low109 Ų10995.4 Ų95.451%0.50552%0.515SS..THydrogen-bonded Turntrans-64.4-21.6175.2-163.6-67.8000112.9N123 A124 L125 L129N123-H127 PolarHBondContact O-N 3.3Å; N123-H127 VanDerWaalsContact O-N 3.1Å; A124-H127 PolarHBondContact O-N 3.36Å; L125-H127 VanDerWaalsContact C-N 3.29Å; L125-H127 PolarHBondContact O-N 3.25Å; H127-L129 PolarHBondContact O-N 3.4Å
128F62.1Low67.9Low35 Ų3594 Ų9415%0.15451%0.51CS..THydrogen-bonded Turntrans-69.4-15174.1-67-57.7000113.4F117 L125 A126 L141 E145 T146 L149F117-F128 HydrophobicContact CZ-CE2 4.44Å; L125-F128 PolarHBondContact O-N 3.31Å; A126-F128 PolarHBondContact O-N 3.35Å; F128-L141 WeakPolarHBondContact O-CD2 3.44Å; F128-E145 HydrophobicContact CD1-CB 4.26Å; F128-E145 HydrophobicContact CD1-CG 3.84Å; F128-T146 HydrophobicContact CD1-CG2 4.24Å; F128-T146 HydrophobicContact CE1-CG2 4.06Å; F128-L149 HydrophobicContact CE1-CD1 4.33Å
129L61.6Low68Low64 Ų6487.8 Ų87.834%0.33550%0.498SS..SBendtrans-121.8114175.6-100.674.8000111A126 H127 Q131 I138 V142A126-L129 PolarHBondContact O-N 2.92Å; A126-L129 VanDerWaalsContact O-N 3.08Å; H127-L129 PolarHBondContact O-N 3.4Å; L129-Q131 PolarHBondContact O-N 3.33Å; L129-I138 HydrophobicContact CD1-CG2 4.02Å; L129-I138 HydrophobicContact CD2-CD1 4.28Å; L129-I138 HydrophobicContact CD2-CG1 4.35Å; L129-I138 HydrophobicContact CD2-CG2 3.82Å; L129-I138 HydrophobicContact CG-CG2 4.2Å; L129-V142 HydrophobicContact CD1-CG2 3.29Å
130P60.2Low68.7Low70 Ų7091 Ų9146%0.45551%0.509SS..  trans-62.5138.8165.418.3-18.7000109.7G132 T133 L141P130-G132 PolarHBondContact O-N 3.41Å; P130-T133 HydrophobicContact CB-CG2 4.44Å; P130-T133 HydrophobicContact CG-CG2 3.69Å; P130-T133 WeakPolarHBondContact O-CG2 3.43Å; P130-L141 HydrophobicContact CG-CD1 3.84Å; P130-L141 HydrophobicContact CG-CD2 3.96Å
131Q60.2Low69.4Low203 Ų20388.7 Ų88.795%0.94950%0.501SS*.THydrogen-bonded Turntrans-64.6128.1-179.1-63.6-166.6-1.700110.3L129L129-Q131 PolarHBondContact O-N 3.33Å
132G61.7Low70.1Confident82 Ų8285.7 Ų85.785%0.84549%0.488SS*.THydrogen-bonded Turntrans99.713.3176.400000116.2P130P130-G132 PolarHBondContact O-N 3.41Å
133T69.8Low71.2Confident34 Ų3481.1 Ų81.121%0.20947%0.471CS..  trans-71.913517752.80000112.7P130 L141P130-T133 HydrophobicContact CB-CG2 4.44Å; P130-T133 HydrophobicContact CG-CG2 3.69Å; P130-T133 WeakPolarHBondContact O-CG2 3.43Å; T133-L141 HydrophobicContact CG2-CD1 3.84Å
134P72.5Confident72.1Confident77 Ų7780.6 Ų80.650%0.547%0.468SS..  trans-58.7137.4173.6-19.630.1000111.6P136 L137P134-P136 VanDerWaalsContact C-N 3.31Å; P134-P136 WeakPolarHBondContact O-CD 3.43Å; P134-P136 VanDerWaalsContact O-N 3.09Å; P134-L137 HydrophobicContact CB-CD1 4.37Å; P134-L137 HydrophobicContact CG-CD1 4.08Å; P134-L137 PolarHBondContact O-N 2.97Å
135T75.1Confident73Confident120 Ų12082.5 Ų82.574%0.73647%0.474SS*.THydrogen-bonded Turntrans-50.6-31.3-176.648.90000116.8I138T135-I138 HydrophobicContact CG2-CD1 4.48Å
136P81.5Confident73.9Confident103 Ų10380.6 Ų80.667%0.66947%0.466SS*.THydrogen-bonded Turntrans-76.5-25.4178.9-7.122.4000113.8P134 P139P134-P136 VanDerWaalsContact C-N 3.31Å; P134-P136 WeakPolarHBondContact O-CD 3.43Å; P134-P136 VanDerWaalsContact O-N 3.09Å; P136-P139 WeakPolarHBondContact O-CD 3.47Å
137L79.4Confident75Confident105 Ų10582 Ų8255%0.5547%0.465SS..THydrogen-bonded Turntrans-89.2-11.4-173.4-67.7168.7000113P134 M140 L141P134-L137 HydrophobicContact CB-CD1 4.37Å; P134-L137 HydrophobicContact CG-CD1 4.08Å; P134-L137 PolarHBondContact O-N 2.97Å; L137-M140 PolarHBondContact O-N 3.4Å; L137-L141 PolarHBondContact O-N 2.99Å; L137-L141 VanDerWaalsContact O-N 3.11Å
138I78.6Confident75.9Confident49 Ų4979.2 Ų79.225%0.25146%0.458SS..Hα-helixtrans-54.5-49.2-176.7-64.5175.9000112.5L129 T135 M140 L141 V142L129-I138 HydrophobicContact CD1-CG2 4.02Å; L129-I138 HydrophobicContact CD2-CD1 4.28Å; L129-I138 HydrophobicContact CD2-CG1 4.35Å; L129-I138 HydrophobicContact CD2-CG2 3.82Å; L129-I138 HydrophobicContact CG-CG2 4.2Å; T135-I138 HydrophobicContact CG2-CD1 4.48Å; I138-M140 VanDerWaalsContact C-N 3.32Å; I138-M140 PolarHBondContact O-N 3.03Å; I138-L141 PolarHBondContact O-N 2.97Å; I138-V142 HydrophobicContact CG2-CG2 4.44Å; I138-V142 WeakPolarHBondContact O-CG2 3.33Å; I138-V142 PolarHBondContact O-N 2.97Å; I138-V142 VanDerWaalsContact O-N 3.13Å
139P78.8Confident76.9Confident86 Ų8679.7 Ų79.756%0.55846%0.462SS*.Hα-helixtrans-64.5-37.3-175.3-20.633.3000112.7P136 I143P136-P139 WeakPolarHBondContact O-CD 3.47Å; P139-I143 WeakPolarHBondContact O-CG1 3.12Å; P139-I143 PolarHBondContact O-N 2.93Å
140M82.8Confident77.8Confident114 Ų11481.9 Ų81.956%0.56247%0.473SS*.Hα-helixtrans-69.7-41179.1-173.364-172.200111.5L137 I138 I143 I144L137-M140 PolarHBondContact O-N 3.4Å; I138-M140 VanDerWaalsContact C-N 3.32Å; I138-M140 PolarHBondContact O-N 3.03Å; M140-I143 PolarHBondContact O-N 2.96Å; M140-I144 HydrophobicContact CE-CD1 3.98Å; M140-I144 HydrophobicContact CE-CG1 4.2Å; M140-I144 HydrophobicContact CG-CD1 4.12Å; M140-I144 WeakPolarHBondContact O-CG1 3.24Å; M140-I144 PolarHBondContact O-N 3.07Å; M140-I144 VanDerWaalsContact O-N 3.12Å
141L84.4Confident79Confident48 Ų4883.3 Ų83.325%0.25148%0.476SS..Hα-helixtrans-66.7-40.7-178.4-168.2150000111.8F128 P130 T133 L137 I138 I143 I144 E145F128-L141 WeakPolarHBondContact O-CD2 3.44Å; P130-L141 HydrophobicContact CG-CD1 3.84Å; P130-L141 HydrophobicContact CG-CD2 3.96Å; T133-L141 HydrophobicContact CG2-CD1 3.84Å; L137-L141 PolarHBondContact O-N 2.99Å; L137-L141 VanDerWaalsContact O-N 3.11Å; I138-L141 PolarHBondContact O-N 2.97Å; L141-I143 VanDerWaalsContact C-N 3.3Å; L141-I143 PolarHBondContact O-N 3.43Å; L141-I144 PolarHBondContact O-N 3.43Å; L141-E145 WeakPolarHBondContact O-CB 3.38Å; L141-E145 PolarHBondContact O-N 2.92Å
142V81.1Confident80.1Confident46 Ų4677 Ų7728%0.27945%0.447SS..Hα-helixtrans-58.3-44175.1174.20000110.9L129 I138 I144 E145 T146L129-V142 HydrophobicContact CD1-CG2 3.29Å; I138-V142 HydrophobicContact CG2-CG2 4.44Å; I138-V142 WeakPolarHBondContact O-CG2 3.33Å; I138-V142 PolarHBondContact O-N 2.97Å; I138-V142 VanDerWaalsContact O-N 3.13Å; V142-I144 PolarHBondContact O-N 3.41Å; V142-E145 PolarHBondContact O-N 3.44Å; V142-T146 HydrophobicContact CG1-CG2 4.33Å; V142-T146 VanDerWaalsContact O-CG2 3.26Å; V142-T146 WeakPolarHBondContact O-CG2 3.39Å; V142-T146 PolarHBondContact O-N 3.22Å; V142-T146 PolarHBondContact O-OG1 3.49Å
143I84.8Confident80.9Confident91 Ų9173.6 Ų73.647%0.46741%0.409SS..Hα-helixtrans-60.9-47.5178.1-66.5166.7000110.3P139 M140 L141 E145 T146 I147P139-I143 WeakPolarHBondContact O-CG1 3.12Å; P139-I143 PolarHBondContact O-N 2.93Å; M140-I143 PolarHBondContact O-N 2.96Å; L141-I143 VanDerWaalsContact C-N 3.3Å; L141-I143 PolarHBondContact O-N 3.43Å; I143-E145 VanDerWaalsContact C-N 3.35Å; I143-E145 PolarHBondContact O-N 3.13Å; I143-T146 PolarHBondContact O-N 2.66Å; I143-T146 PolarHBondContact O-OG1 2.9Å; I143-I147 HydrophobicContact CG2-CD1 3.79Å; I143-I147 VanDerWaalsContact O-CG1 3.3Å; I143-I147 WeakPolarHBondContact O-CG1 3.45Å; I143-I147 PolarHBondContact O-N 3.47Å
144I85.8Confident81.6Confident93 Ų9376.4 Ų76.448%0.47742%0.421SS..Hα-helixtrans-61.9-43.6179.5-64.6165.7000111.1M140 L141 V142 I147 S148M140-I144 HydrophobicContact CE-CD1 3.98Å; M140-I144 HydrophobicContact CE-CG1 4.2Å; M140-I144 HydrophobicContact CG-CD1 4.12Å; M140-I144 WeakPolarHBondContact O-CG1 3.24Å; M140-I144 PolarHBondContact O-N 3.07Å; M140-I144 VanDerWaalsContact O-N 3.12Å; L141-I144 PolarHBondContact O-N 3.43Å; V142-I144 PolarHBondContact O-N 3.41Å; I144-I147 PolarHBondContact O-N 3.32Å; I144-S148 WeakPolarHBondContact O-CB 3.28Å; I144-S148 PolarHBondContact O-N 2.91Å
145E83.8Confident82.2Confident57 Ų5774.7 Ų74.727%0.26641%0.414SS..Hα-helixtrans-66.8-39.7-179.3-166.961.8-161.200111.6F128 L141 V142 I143 I147 S148 L149F128-E145 HydrophobicContact CD1-CB 4.26Å; F128-E145 HydrophobicContact CD1-CG 3.84Å; L141-E145 WeakPolarHBondContact O-CB 3.38Å; L141-E145 PolarHBondContact O-N 2.92Å; V142-E145 PolarHBondContact O-N 3.44Å; I143-E145 VanDerWaalsContact C-N 3.35Å; I143-E145 PolarHBondContact O-N 3.13Å; E145-I147 VanDerWaalsContact C-N 3.31Å; E145-I147 PolarHBondContact O-N 3.43Å; E145-S148 WeakPolarHBondContact O-CB 3.49Å; E145-S148 PolarHBondContact O-N 3.27Å; E145-L149 WeakPolarHBondContact O-CB 3.18Å; E145-L149 PolarHBondContact O-N 3.18Å
146T81.1Confident82.5Confident53 Ų5369.3 Ų69.333%0.32538%0.38SS..Hα-helixtrans-62.8-38.1173.959.70000112.3F128 V142 I143 L150F128-T146 HydrophobicContact CD1-CG2 4.24Å; F128-T146 HydrophobicContact CE1-CG2 4.06Å; V142-T146 HydrophobicContact CG1-CG2 4.33Å; V142-T146 VanDerWaalsContact O-CG2 3.26Å; V142-T146 WeakPolarHBondContact O-CG2 3.39Å; V142-T146 PolarHBondContact O-N 3.22Å; V142-T146 PolarHBondContact O-OG1 3.49Å; I143-T146 PolarHBondContact O-N 2.66Å; I143-T146 PolarHBondContact O-OG1 2.9Å; T146-L150 WeakPolarHBondContact O-CG 3.38Å; T146-L150 PolarHBondContact O-N 3.48Å
147I85.2Confident82.6Confident84 Ų8464.4 Ų64.443%0.43135%0.349SS..Hα-helixtrans-68.5-43.5175.2-67.7167.1000110.7I143 I144 E145 L149 L150 I151I143-I147 HydrophobicContact CG2-CD1 3.79Å; I143-I147 VanDerWaalsContact O-CG1 3.3Å; I143-I147 WeakPolarHBondContact O-CG1 3.45Å; I143-I147 PolarHBondContact O-N 3.47Å; I144-I147 PolarHBondContact O-N 3.32Å; E145-I147 VanDerWaalsContact C-N 3.31Å; E145-I147 PolarHBondContact O-N 3.43Å; I147-L149 VanDerWaalsContact C-N 3.33Å; I147-L149 PolarHBondContact O-N 2.98Å; I147-L150 PolarHBondContact O-N 3.34Å; 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 3.49Å; I147-I151 PolarHBondContact O-N 2.87Å
148S83.6Confident82.9Confident50 Ų5062.5 Ų62.535%0.3534%0.341SS..Hα-helixtrans-57.2-46.2177.6-176.50000111.7I144 E145 L150 I151 Q152I144-S148 WeakPolarHBondContact O-CB 3.28Å; I144-S148 PolarHBondContact O-N 2.91Å; E145-S148 WeakPolarHBondContact O-CB 3.49Å; E145-S148 PolarHBondContact O-N 3.27Å; S148-L150 VanDerWaalsContact C-N 3.29Å; S148-L150 PolarHBondContact O-N 2.83Å; S148-I151 PolarHBondContact O-N 3.18Å; S148-Q152 PolarHBondContact O-N 3.14Å; S148-Q152 VanDerWaalsContact O-N 3.12Å
149L82.3Confident83.4Confident45 Ų4564.9 Ų64.924%0.23635%0.347CS..Hα-helixtrans-60.9-35.9177.6-174.5123.9000112.3W109 F128 E145 I147 P153W109-L149 HydrophobicContact CH2-CD2 4.11Å; W109-L149 HydrophobicContact CZ2-CD2 3.45Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.45Å; W109-L149 HydrophobicContact CZ2-CG 3.91Å; W109-L149 VanDerWaalsContact CZ2-O 3.26Å; W109-L149 WeakPolarHBondContact CZ2-O 3.06Å; W109-L149 PolarHBondContact NE1-O 3.21Å; F128-L149 HydrophobicContact CE1-CD1 4.33Å; E145-L149 WeakPolarHBondContact O-CB 3.18Å; E145-L149 PolarHBondContact O-N 3.18Å; I147-L149 VanDerWaalsContact C-N 3.33Å; I147-L149 PolarHBondContact O-N 2.98Å; L149-P153 WeakPolarHBondContact O-CD 3.11Å
150L82.3Confident83.5Confident110 Ų11060.8 Ų60.858%0.57632%0.32SS*.Hα-helixtrans-78.1-35.7177-71.4173.5000113.7W109 T146 I147 S148 P153W109-L150 HydrophobicContact CH2-CD2 3.76Å; W109-L150 HydrophobicContact CZ2-CD2 4.3Å; T146-L150 WeakPolarHBondContact O-CG 3.38Å; T146-L150 PolarHBondContact O-N 3.48Å; I147-L150 PolarHBondContact O-N 3.34Å; I147-L150 VanDerWaalsContact O-N 3.16Å; S148-L150 VanDerWaalsContact C-N 3.29Å; S148-L150 PolarHBondContact O-N 2.83Å; L150-P153 WeakPolarHBondContact O-CD 3.24Å; L150-P153 WeakPolarHBondContact O-CG 3.17Å
151I84.9Confident83.7Confident100 Ų10056 Ų5651%0.51330%0.298SS..Hα-helixtrans-72.3-32-179-69.6173.2000111.2I147 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 3.49Å; I147-I151 PolarHBondContact O-N 2.87Å; S148-I151 PolarHBondContact O-N 3.18Å; I151-M154 CarbonylContact O-C 3.57Å; I151-M154 WeakPolarHBondContact O-CB 3.36Å; I151-M154 PolarHBondContact O-N 3.43Å; I151-M154 VanDerWaalsContact O-N 3.09Å; I151-A155 HydrophobicContact CG2-CB 4.44Å; I151-A155 WeakPolarHBondContact O-CB 3.31Å; I151-A155 PolarHBondContact O-N 3.45Å
152Q82.9Confident83.7Confident70 Ų7055.7 Ų55.733%0.32730%0.302SS..Hα-helixtrans-50.9-53.4-177-110.2174.2-15.100116.3S148 M154 A155 L156 Y221S148-Q152 PolarHBondContact O-N 3.14Å; S148-Q152 VanDerWaalsContact O-N 3.12Å; Q152-M154 PolarHBondContact O-N 2.98Å; Q152-A155 PolarHBondContact O-N 3.23Å; Q152-L156 PolarHBondContact O-N 3.17Å; Q152-Y221 HydrophobicContact CG-CE1 4.38Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.47Å; Q152-Y221 VanDerWaalsContact NE2-CE1 3.35Å; Q152-Y221 PolarHBondContact NE2-OH 3.34Å; Q152-Y221 PolarHBondContact OE1-OH 3.21Å
153P79.1Confident84.1Confident10 Ų1056.4 Ų56.47%0.06530%0.304CS..Hα-helixtrans-63.5-32.8178.324.1-34.7000112W109 L149 L150 A157W109-P153 HydrophobicContact CB-CB 3.87Å; W109-P153 HydrophobicContact CB-CG 4.37Å; W109-P153 HydrophobicContact CD2-CB 4.28Å; W109-P153 HydrophobicContact CD2-CG 3.8Å; W109-P153 HydrophobicContact CE3-CG 4.34Å; W109-P153 HydrophobicContact CG-CB 3.8Å; W109-P153 HydrophobicContact CG-CG 3.79Å; L149-P153 WeakPolarHBondContact O-CD 3.11Å; L150-P153 WeakPolarHBondContact O-CD 3.24Å; L150-P153 WeakPolarHBondContact O-CG 3.17Å; P153-A157 PolarHBondContact O-N 2.99Å
154M84Confident84.1Confident94 Ų9452.3 Ų52.346%0.46328%0.283SS..Hα-helixtrans-70.7-43.2176.4-164.7148.3-151.700111.6L102 I151 Q152 L156 A157 V158L102-M154 HydrophobicContact CD1-CE 4.3Å; L102-M154 HydrophobicContact CD1-CG 4.29Å; L102-M154 HydrophobicContact CD2-CE 4.36Å; I151-M154 CarbonylContact O-C 3.57Å; I151-M154 WeakPolarHBondContact O-CB 3.36Å; I151-M154 PolarHBondContact O-N 3.43Å; I151-M154 VanDerWaalsContact O-N 3.09Å; Q152-M154 PolarHBondContact O-N 2.98Å; M154-L156 VanDerWaalsContact C-N 3.28Å; M154-L156 PolarHBondContact O-N 3.23Å; M154-A157 PolarHBondContact O-N 3.22Å; M154-V158 HydrophobicContact CG-CG2 4.48Å; M154-V158 WeakPolarHBondContact O-CB 3.13Å; M154-V158 VanDerWaalsContact O-CG2 3.29Å; M154-V158 WeakPolarHBondContact O-CG2 3.34Å; M154-V158 PolarHBondContact O-N 3.07Å
155A85.3Confident84.2Confident41 Ų4149.6 Ų49.634%0.33927%0.271SS..Hα-helixtrans-61.3-37.217600000112.1I151 Q152 R159I151-A155 HydrophobicContact CG2-CB 4.44Å; I151-A155 WeakPolarHBondContact O-CB 3.31Å; I151-A155 PolarHBondContact O-N 3.45Å; Q152-A155 PolarHBondContact O-N 3.23Å; A155-R159 VanDerWaalsContact O-CB 3.31Å; A155-R159 WeakPolarHBondContact O-CB 3.31Å; A155-R159 PolarHBondContact O-N 3.27Å
156L80.6Confident84.4Confident7 Ų749.5 Ų49.54%0.03728%0.28CS..Hα-helixtrans-62.7-48.2175.1-163.886.7000111.9Q152 M154 R159 L160 F214 L217 V218Q152-L156 PolarHBondContact O-N 3.17Å; M154-L156 VanDerWaalsContact C-N 3.28Å; M154-L156 PolarHBondContact O-N 3.23Å; L156-R159 PolarHBondContact O-N 3.32Å; L156-L160 PolarHBondContact O-N 2.84Å; L156-F214 HydrophobicContact CD1-CD2 4.34Å; L156-F214 HydrophobicContact CD2-CD1 4.05Å; L156-F214 HydrophobicContact CD2-CD2 3.3Å; L156-F214 HydrophobicContact CD2-CE1 3.93Å; L156-F214 HydrophobicContact CD2-CE2 3.17Å; L156-F214 HydrophobicContact CD2-CG 3.75Å; L156-F214 HydrophobicContact CD2-CZ 3.51Å; L156-F214 HydrophobicContact CG-CD2 3.49Å; L156-F214 VanDerWaalsContact CG-CD2 3.49Å; L156-F214 HydrophobicContact CG-CE2 3.73Å; L156-F214 HydrophobicContact CG-CG 4.14Å; L156-L217 HydrophobicContact CD1-CB 3.86Å; L156-L217 HydrophobicContact CD1-CD1 3.32Å; L156-L217 HydrophobicContact CD1-CG 4.21Å; L156-V218 HydrophobicContact CD2-CG2 4.3Å
157A83.8Confident84.7Confident0 Ų047.2 Ų47.20%027%0.267CS..Hα-helixtrans-64.1-44.6179.500000111.8L98 N101 L102 A105 P153 M154 R159 L160 T161L98-A157 HydrophobicContact CD1-CB 4.37Å; N101-A157 HydrophobicContact CB-CB 3.92Å; N101-A157 PolarHBondContact ND2-O 3.32Å; L102-A157 HydrophobicContact CB-CB 4.47Å; L102-A157 HydrophobicContact CD1-CB 4.02Å; A105-A157 HydrophobicContact CB-CB 4.24Å; P153-A157 PolarHBondContact O-N 2.99Å; M154-A157 PolarHBondContact O-N 3.22Å; A157-R159 VanDerWaalsContact C-N 3.34Å; A157-R159 PolarHBondContact O-N 3.05Å; A157-L160 PolarHBondContact O-N 2.84Å; A157-T161 PolarHBondContact O-N 3.15Å; A157-T161 VanDerWaalsContact O-N 3.13Å; A157-T161 PolarHBondContact O-OG1 3.28Å
158V86.9Confident84.8Confident65 Ų6544.8 Ų44.839%0.39425%0.254SS..Hα-helixtrans-63.9-38.5177.2172.60000111.4L98 M154 L160 T161 A162L98-V158 HydrophobicContact CD1-CG2 3.88Å; M154-V158 HydrophobicContact CG-CG2 4.48Å; M154-V158 WeakPolarHBondContact O-CB 3.13Å; M154-V158 VanDerWaalsContact O-CG2 3.29Å; M154-V158 WeakPolarHBondContact O-CG2 3.34Å; M154-V158 PolarHBondContact O-N 3.07Å; V158-L160 VanDerWaalsContact C-N 3.32Å; V158-L160 PolarHBondContact O-N 3.01Å; V158-T161 WeakPolarHBondContact CA-OG1 3.41Å; V158-T161 PolarHBondContact O-N 3.12Å; V158-T161 PolarHBondContact O-OG1 3.03Å; V158-A162 WeakPolarHBondContact O-CB 3.17Å; V158-A162 PolarHBondContact O-N 2.99Å
159R87.2Confident85.1Confident99 Ų9944.5 Ų44.537%0.37425%0.248SC..Hα-helixtrans-61-42.6177.5-168.4-172.5-61.2159.21.5111.6A155 L156 A157 N163 Q210A155-R159 VanDerWaalsContact O-CB 3.31Å; A155-R159 WeakPolarHBondContact O-CB 3.31Å; A155-R159 PolarHBondContact O-N 3.27Å; L156-R159 PolarHBondContact O-N 3.32Å; A157-R159 VanDerWaalsContact C-N 3.34Å; A157-R159 PolarHBondContact O-N 3.05Å; R159-N163 WeakPolarHBondContact O-CB 3.43Å; R159-N163 VanDerWaalsContact O-CG 3.27Å; R159-N163 PolarHBondContact O-N 3.1Å; R159-N163 PolarHBondContact O-ND2 3.36Å; R159-Q210 VanDerWaalsContact CG-NE2 3.3Å
160L82.5Confident85.4Confident0 Ų046 Ų460%026%0.256CS..Hα-helixtrans-67.8-44.2179.9178.666.3000110.9I79 N83 T95 N101 L156 A157 V158 I164 Q210 F214I79-L160 HydrophobicContact CG2-CD1 4.08Å; I79-L160 HydrophobicContact CG2-CD2 4.12Å; N83-L160 WeakPolarHBondContact ND2-CD1 3.4Å; T95-L160 HydrophobicContact CG2-CD2 4.47Å; N101-L160 HydrophobicContact CB-CD2 4.37Å; N101-L160 VanDerWaalsContact CG-CD2 3.47Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.31Å; N101-L160 VanDerWaalsContact ND2-CG 3.35Å; N101-L160 WeakPolarHBondContact ND2-CG 3.42Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.48Å; L156-L160 PolarHBondContact O-N 2.84Å; A157-L160 PolarHBondContact O-N 2.84Å; V158-L160 VanDerWaalsContact C-N 3.32Å; V158-L160 PolarHBondContact O-N 3.01Å; L160-I164 HydrophobicContact CD1-CD1 3.65Å; L160-I164 HydrophobicContact CG-CD1 4.22Å; L160-I164 WeakPolarHBondContact O-CG1 3.4Å; L160-I164 PolarHBondContact O-N 3.16Å; L160-Q210 VanDerWaalsContact CA-NE2 3.25Å; L160-Q210 HydrophobicContact CB-CG 4.22Å; L160-Q210 HydrophobicContact CD1-CB 4.34Å; L160-Q210 HydrophobicContact CD1-CG 3.4Å; L160-Q210 HydrophobicContact CG-CG 4.4Å; L160-F214 HydrophobicContact CD2-CD2 4.46Å
161T85.6Confident85.8Confident14 Ų1442.2 Ų42.29%0.08624%0.236CC..Hα-helixtrans-65.3-47176.849.10000112.2T96 L98 N101 A157 V158 N163 I164 T165T96-T161 WeakPolarHBondContact O-CG2 3.48Å; L98-T161 VanDerWaalsContact CA-CG2 3.45Å; L98-T161 HydrophobicContact CB-CG2 4.03Å; L98-T161 HydrophobicContact CD1-CG2 4Å; N101-T161 HydrophobicContact CB-CG2 4.31Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.4Å; N101-T161 PolarHBondContact ND2-N 3.27Å; A157-T161 PolarHBondContact O-N 3.15Å; A157-T161 VanDerWaalsContact O-N 3.13Å; A157-T161 PolarHBondContact O-OG1 3.28Å; V158-T161 WeakPolarHBondContact CA-OG1 3.41Å; V158-T161 PolarHBondContact O-N 3.12Å; V158-T161 PolarHBondContact O-OG1 3.03Å; T161-N163 PolarHBondContact O-N 3.34Å; T161-I164 PolarHBondContact O-N 3.35Å; T161-T165 VanDerWaalsContact O-CB 3.28Å; T161-T165 WeakPolarHBondContact O-CB 3.4Å; T161-T165 WeakPolarHBondContact O-CG2 3.37Å; T161-T165 PolarHBondContact O-N 3.5Å; T161-T165 PolarHBondContact O-OG1 3.4Å
162A85.1Confident86Confident41 Ų4141.6 Ų41.634%0.33923%0.231SC..Hα-helixtrans-62.6-44.5-173.100000111.2V158 T165 A166V158-A162 WeakPolarHBondContact O-CB 3.17Å; V158-A162 PolarHBondContact O-N 2.99Å; A162-T165 WeakPolarHBondContact CA-OG1 3.27Å; A162-T165 PolarHBondContact O-OG1 3.48Å; A162-T165 VanDerWaalsContact O-OG1 3.13Å; A162-A166 WeakPolarHBondContact O-CB 3.46Å; A162-A166 PolarHBondContact O-N 2.95Å
163N88.4Confident86.3Confident61 Ų6142.6 Ų42.633%0.32624%0.237SC..Hα-helixtrans-63.7-48.9-179.8-69.2-6000111.5R159 T161 G167 V206R159-N163 WeakPolarHBondContact O-CB 3.43Å; R159-N163 VanDerWaalsContact O-CG 3.27Å; R159-N163 PolarHBondContact O-N 3.1Å; R159-N163 PolarHBondContact O-ND2 3.36Å; T161-N163 PolarHBondContact O-N 3.34Å; N163-G167 PolarHBondContact O-N 3.12Å; N163-V206 HydrophobicContact CB-CG1 4.06Å
164I85.6Confident86.9Confident5 Ų543.6 Ų43.63%0.02624%0.242CC..Hα-helixtrans-70.5-40.9-176.4-59.9173.8000111.5N83 T93 T95 T96 L160 T161 H168N83-I164 HydrophobicContact CB-CD1 4.24Å; N83-I164 VanDerWaalsContact CG-CD1 3.4Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.29Å; T93-I164 HydrophobicContact CG2-CG2 4.33Å; T95-I164 VanDerWaalsContact OG1-CD1 3.3Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.24Å; T96-I164 HydrophobicContact CG2-CB 4.34Å; T96-I164 HydrophobicContact CG2-CG2 3.64Å; L160-I164 HydrophobicContact CD1-CD1 3.65Å; L160-I164 HydrophobicContact CG-CD1 4.22Å; L160-I164 WeakPolarHBondContact O-CG1 3.4Å; L160-I164 PolarHBondContact O-N 3.16Å; T161-I164 PolarHBondContact O-N 3.35Å; I164-H168 WeakPolarHBondContact O-CB 3.47Å; I164-H168 PolarHBondContact O-CD2 3.05Å; I164-H168 PolarHBondContact O-N 2.95Å
165T87.7Confident87.2Confident36 Ų3640.2 Ų40.222%0.22123%0.231CC..Hα-helixtrans-65.3-46.8176.953.20000111.7F9 T96 T161 A162 H168 L169F9-T165 HydrophobicContact CD1-CG2 4.46Å; F9-T165 HydrophobicContact CE1-CG2 4.18Å; T96-T165 HydrophobicContact CG2-CG2 3.76Å; T161-T165 VanDerWaalsContact O-CB 3.28Å; T161-T165 WeakPolarHBondContact O-CB 3.4Å; T161-T165 WeakPolarHBondContact O-CG2 3.37Å; T161-T165 PolarHBondContact O-N 3.5Å; T161-T165 PolarHBondContact O-OG1 3.4Å; A162-T165 WeakPolarHBondContact CA-OG1 3.27Å; A162-T165 PolarHBondContact O-OG1 3.48Å; A162-T165 VanDerWaalsContact O-OG1 3.13Å; T165-H168 PolarHBondContact O-N 2.75Å; T165-L169 WeakPolarHBondContact O-CB 3.06Å; T165-L169 WeakPolarHBondContact O-CG 3.47Å; T165-L169 PolarHBondContact O-N 3.39Å
166A87.5Confident87.4Confident54 Ų5441.1 Ų41.145%0.44624%0.235SC..Hα-helixtrans-64.2-43.1178.800000111.5A162 L169 L170A162-A166 WeakPolarHBondContact O-CB 3.46Å; A162-A166 PolarHBondContact O-N 2.95Å; A166-L169 PolarHBondContact O-N 2.85Å; A166-L170 VanDerWaalsContact O-CB 3.24Å; A166-L170 WeakPolarHBondContact O-CB 3.25Å; A166-L170 PolarHBondContact O-N 3.01Å
167G88.1Confident87.7Confident6 Ų642.7 Ų42.76%0.06225%0.249CC..Hα-helixtrans-59.1-47.4175.900000112.6N163 L170 M171 E203N163-G167 PolarHBondContact O-N 3.12Å; G167-L170 PolarHBondContact O-N 3Å; G167-M171 WeakPolarHBondContact O-CB 3.39Å; G167-M171 WeakPolarHBondContact O-CG 3.12Å; G167-M171 PolarHBondContact O-N 3.36Å; G167-E203 WeakPolarHBondContact CA-OE2 3.28Å
168H88.1Confident88Confident33 Ų3343.6 Ų43.615%0.15325%0.254CS..Hα-helixtrans-62.8-43.7175.7-93-91.5000113.4F9 G86 I164 T165 L170 M171 H172F9-H168 HydrophobicContact CE1-CB 4.07Å; F9-H168 HydrophobicContact CZ-CB 3.81Å; G86-H168 PolarHBondContact O-CE1 2.75Å; G86-H168 PolarHBondContact O-NE2 2.88Å; I164-H168 WeakPolarHBondContact O-CB 3.47Å; I164-H168 PolarHBondContact O-CD2 3.05Å; I164-H168 PolarHBondContact O-N 2.95Å; T165-H168 PolarHBondContact O-N 2.75Å; H168-L170 VanDerWaalsContact C-N 3.32Å; H168-L170 PolarHBondContact O-N 3.08Å; H168-M171 PolarHBondContact O-N 3.4Å; H168-H172 WeakPolarHBondContact O-CB 3.44Å; H168-H172 PolarHBondContact O-N 3.02Å
169L88.1Confident88.2Confident43 Ų4346.5 Ų46.523%0.22527%0.267CS..Hα-helixtrans-61.7-42.7175.9-78.4170.6000111.2F6 F9 T165 A166 H172 L173F6-L169 HydrophobicContact CD1-CD2 4.41Å; F6-L169 HydrophobicContact CE1-CD1 4.14Å; F6-L169 HydrophobicContact CE1-CD2 4.04Å; F6-L169 HydrophobicContact CZ-CD2 4.47Å; F9-L169 HydrophobicContact CE2-CD1 4.47Å; F9-L169 HydrophobicContact CE2-CD2 3.67Å; F9-L169 HydrophobicContact CE2-CG 3.77Å; F9-L169 HydrophobicContact CZ-CD2 4.3Å; F9-L169 HydrophobicContact CZ-CG 3.92Å; T165-L169 WeakPolarHBondContact O-CB 3.06Å; T165-L169 WeakPolarHBondContact O-CG 3.47Å; T165-L169 PolarHBondContact O-N 3.39Å; A166-L169 PolarHBondContact O-N 2.85Å; L169-H172 PolarHBondContact O-N 3.09Å; L169-L173 WeakPolarHBondContact O-CB 3.38Å; L169-L173 VanDerWaalsContact O-CG 3.31Å; L169-L173 WeakPolarHBondContact O-CG 3.27Å; L169-L173 PolarHBondContact O-N 2.73Å
170L90.1Very high88.2Confident78 Ų7844 Ų4441%0.40827%0.268SS..Hα-helixtrans-70.2-39.5-178-159.6147.9000111.4A166 G167 H168 H172 L173 I174 L199A166-L170 VanDerWaalsContact O-CB 3.24Å; A166-L170 WeakPolarHBondContact O-CB 3.25Å; A166-L170 PolarHBondContact O-N 3.01Å; G167-L170 PolarHBondContact O-N 3Å; H168-L170 VanDerWaalsContact C-N 3.32Å; H168-L170 PolarHBondContact O-N 3.08Å; L170-H172 VanDerWaalsContact C-N 3.34Å; L170-H172 PolarHBondContact O-N 3.46Å; L170-L173 PolarHBondContact O-N 3.28Å; L170-I174 HydrophobicContact CD2-CD1 3.5Å; L170-I174 HydrophobicContact CD2-CG1 4.21Å; L170-I174 WeakPolarHBondContact O-CG1 3.25Å; L170-I174 PolarHBondContact O-N 3.34Å; L170-L199 HydrophobicContact CB-CD2 4.45Å; L170-L199 HydrophobicContact CD2-CD1 3.5Å; L170-L199 VanDerWaalsContact CD2-CD1 3.5Å; L170-L199 HydrophobicContact CD2-CD2 3.21Å; L170-L199 HydrophobicContact CD2-CG 3.96Å; L170-L199 HydrophobicContact CG-CD2 4.42Å
171M90.6Very high88.5Confident30 Ų3047 Ų4715%0.14828%0.283CS..Hα-helixtrans-58.5-43.9169.6-77.5-172.8-68.500111.8L87 G167 H168 G175 L199 T200 E203L87-M171 HydrophobicContact CD2-CE 3.95Å; G167-M171 WeakPolarHBondContact O-CB 3.39Å; G167-M171 WeakPolarHBondContact O-CG 3.12Å; G167-M171 PolarHBondContact O-N 3.36Å; H168-M171 PolarHBondContact O-N 3.4Å; M171-G175 PolarHBondContact O-N 2.87Å; M171-L199 HydrophobicContact CB-CD2 4.29Å; M171-L199 HydrophobicContact CG-CD2 3.52Å; M171-L199 HydrophobicContact CG-CG 4.29Å; M171-T200 HydrophobicContact SD-CG2 3.94Å; M171-E203 HydrophobicContact CE-CG 4.12Å
172H89.2Confident88.5Confident87 Ų8749.4 Ų49.440%0.40330%0.3SS..Hα-helixtrans-68.1-41.3179.3-168.8-61.3000112.3L5 H168 L169 L170 G175 S176L5-H172 WeakPolarHBondContact CD2-CE1 3.38Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.06Å; H168-H172 WeakPolarHBondContact O-CB 3.44Å; H168-H172 PolarHBondContact O-N 3.02Å; L169-H172 PolarHBondContact O-N 3.09Å; L170-H172 VanDerWaalsContact C-N 3.34Å; L170-H172 PolarHBondContact O-N 3.46Å; H172-G175 PolarHBondContact O-N 3.26Å; H172-S176 WeakPolarHBondContact O-CB 3.31Å; H172-S176 PolarHBondContact O-N 3.35Å; H172-S176 PolarHBondContact O-OG 3.46Å
173L89.8Confident88.6Confident90 Ų9053.1 Ų53.147%0.47132%0.318SS..Hα-helixtrans-63.6-48178-74.3171.4000111.2L5 L169 L170 G175 S176 A177L5-L173 HydrophobicContact CD1-CD2 4.11Å; L5-L173 HydrophobicContact CD2-CD2 4.42Å; L169-L173 WeakPolarHBondContact O-CB 3.38Å; L169-L173 VanDerWaalsContact O-CG 3.31Å; L169-L173 WeakPolarHBondContact O-CG 3.27Å; L169-L173 PolarHBondContact O-N 2.73Å; L170-L173 PolarHBondContact O-N 3.28Å; L173-G175 VanDerWaalsContact C-N 3.34Å; L173-G175 PolarHBondContact O-N 3.48Å; L173-S176 PolarHBondContact O-N 3.48Å; L173-S176 PolarHBondContact O-OG 3.37Å; L173-A177 PolarHBondContact O-N 2.86Å
174I91.1Very high88.6Confident32 Ų3255.3 Ų55.316%0.16433%0.329CS..Hα-helixtrans-65.2-40177.2-65.1-177.5000110.6L170 S176 A177 T178 I192 I195 L196 L199L170-I174 HydrophobicContact CD2-CD1 3.5Å; L170-I174 HydrophobicContact CD2-CG1 4.21Å; L170-I174 WeakPolarHBondContact O-CG1 3.25Å; L170-I174 PolarHBondContact O-N 3.34Å; I174-S176 VanDerWaalsContact C-N 3.33Å; I174-S176 PolarHBondContact O-N 2.98Å; I174-A177 WeakPolarHBondContact O-CB 3.41Å; I174-A177 PolarHBondContact O-N 3.38Å; I174-A177 VanDerWaalsContact O-N 3.15Å; I174-T178 HydrophobicContact CG2-CG2 4.41Å; I174-T178 WeakPolarHBondContact O-CG2 3.24Å; I174-T178 PolarHBondContact O-N 2.97Å; I174-T178 PolarHBondContact O-OG1 3.32Å; I174-I192 HydrophobicContact CG2-CG2 3.83Å; I174-I195 HydrophobicContact CD1-CG2 4.13Å; I174-L196 HydrophobicContact CB-CD1 4.21Å; I174-L196 HydrophobicContact CG2-CB 3.92Å; I174-L196 HydrophobicContact CG2-CD1 3.98Å; I174-L196 HydrophobicContact CG2-CG 4.5Å; I174-L199 HydrophobicContact CD1-CD2 4.19Å
175G90Very high88.7Confident23 Ų2359.6 Ų59.624%0.23735%0.352CS..Hα-helixtrans-61.7-36.6174.500000113.6M171 H172 L173 T178 L179M171-G175 PolarHBondContact O-N 2.87Å; H172-G175 PolarHBondContact O-N 3.26Å; L173-G175 VanDerWaalsContact C-N 3.34Å; L173-G175 PolarHBondContact O-N 3.48Å; G175-T178 WeakPolarHBondContact CA-OG1 3.25Å; G175-T178 PolarHBondContact O-OG1 3.32Å; G175-L179 PolarHBondContact O-N 2.87Å
176S88.9Confident88.7Confident59 Ų5964.8 Ų64.841%0.41338%0.378SS..Hα-helixtrans-70.6-35.2173.572.30000112.2H172 L173 I174 L179 A180H172-S176 WeakPolarHBondContact O-CB 3.31Å; H172-S176 PolarHBondContact O-N 3.35Å; H172-S176 PolarHBondContact O-OG 3.46Å; L173-S176 PolarHBondContact O-N 3.48Å; L173-S176 PolarHBondContact O-OG 3.37Å; I174-S176 VanDerWaalsContact C-N 3.33Å; I174-S176 PolarHBondContact O-N 2.98Å; S176-L179 PolarHBondContact O-N 2.89Å; S176-A180 WeakPolarHBondContact O-CB 3.49Å; S176-A180 PolarHBondContact O-N 2.85Å
177A88.1Confident88.7Confident40 Ų4066.8 Ų66.833%0.33139%0.386SS..Hα-helixtrans-69.2-41176.200000111.9L173 I174 L179 A180 M181L173-A177 PolarHBondContact O-N 2.86Å; I174-A177 WeakPolarHBondContact O-CB 3.41Å; I174-A177 PolarHBondContact O-N 3.38Å; I174-A177 VanDerWaalsContact O-N 3.15Å; A177-L179 VanDerWaalsContact C-N 3.31Å; A177-L179 PolarHBondContact O-N 3.35Å; A177-A180 PolarHBondContact O-N 3.39Å; A177-M181 WeakPolarHBondContact O-CB 3.45Å; A177-M181 WeakPolarHBondContact O-CG 3.47Å; A177-M181 PolarHBondContact O-N 2.77Å
178T90.4Very high88.6Confident19 Ų1968.2 Ų68.212%0.11740%0.395CS..Hα-helixtrans-60.9-42.9174.4560000110.9I174 G175 M181 S182 I192I174-T178 HydrophobicContact CG2-CG2 4.41Å; I174-T178 WeakPolarHBondContact O-CG2 3.24Å; I174-T178 PolarHBondContact O-N 2.97Å; I174-T178 PolarHBondContact O-OG1 3.32Å; G175-T178 WeakPolarHBondContact CA-OG1 3.25Å; G175-T178 PolarHBondContact O-OG1 3.32Å; T178-M181 PolarHBondContact O-N 3.07Å; T178-S182 PolarHBondContact O-N 3.35Å; T178-I192 HydrophobicContact CG2-CB 3.89Å; T178-I192 HydrophobicContact CG2-CG2 3.39Å
179L89.4Confident88.8Confident127 Ų12767.8 Ų67.867%0.66540%0.395SS*.Hα-helixtrans-66-41.8179.3-163.1137.4000111.9G175 S176 A177 S182G175-L179 PolarHBondContact O-N 2.87Å; S176-L179 PolarHBondContact O-N 2.89Å; A177-L179 VanDerWaalsContact C-N 3.31Å; A177-L179 PolarHBondContact O-N 3.35Å; L179-S182 PolarHBondContact O-N 3.29Å; L179-S182 PolarHBondContact O-OG 2.99Å
180A88.7Confident88.9Confident47 Ų4771.3 Ų71.339%0.38841%0.413SS..Hα-helixtrans-64-45.1174.600000112.2S176 A177 S182 T183S176-A180 WeakPolarHBondContact O-CB 3.49Å; S176-A180 PolarHBondContact O-N 2.85Å; A177-A180 PolarHBondContact O-N 3.39Å; A180-S182 VanDerWaalsContact C-N 3.28Å; A180-S182 PolarHBondContact O-N 3.24Å; A180-T183 PolarHBondContact O-N 2.6Å; A180-T183 PolarHBondContact O-OG1 2.78Å
181M87.1Confident89.1Confident62 Ų6272.7 Ų72.731%0.30542%0.42SS..Hα-helixtrans-69.1-25.7-178.8-68-63.2109.700113.3A177 T178 T183 I184 N185 T189 I192A177-M181 WeakPolarHBondContact O-CB 3.45Å; A177-M181 WeakPolarHBondContact O-CG 3.47Å; A177-M181 PolarHBondContact O-N 2.77Å; T178-M181 PolarHBondContact O-N 3.07Å; M181-T183 PolarHBondContact O-N 3.31Å; M181-T183 VanDerWaalsContact O-N 3.15Å; M181-I184 HydrophobicContact CE-CD1 3.61Å; M181-I184 PolarHBondContact O-N 3.34Å; M181-I184 HydrophobicContact SD-CD1 4.21Å; M181-N185 PolarHBondContact O-N 2.98Å; M181-N185 VanDerWaalsContact O-N 3.07Å; M181-T189 PolarHBondContact O-OG1 3.37Å; M181-T189 VanDerWaalsContact O-OG1 3.13Å; M181-I192 HydrophobicContact CB-CD1 4.19Å; M181-I192 HydrophobicContact CG-CD1 3.63Å
182S87.3Confident89.2Confident64 Ų6473.3 Ų73.345%0.44842%0.423SS..Hα-helixtrans-57.1-29.5176.876.80000113.1T178 L179 A180 T189T178-S182 PolarHBondContact O-N 3.35Å; L179-S182 PolarHBondContact O-N 3.29Å; L179-S182 PolarHBondContact O-OG 2.99Å; A180-S182 VanDerWaalsContact C-N 3.28Å; A180-S182 PolarHBondContact O-N 3.24Å; S182-T189 VanDerWaalsContact CA-OG1 3.31Å; S182-T189 WeakPolarHBondContact CA-OG1 3.45Å; S182-T189 PolarHBondContact N-OG1 3.37Å
183T87Confident89.3Confident119 Ų11974.1 Ų74.173%0.7343%0.426SS*.THydrogen-bonded Turntrans-81.1-19.1178.866.50000113.7A180 M181A180-T183 PolarHBondContact O-N 2.6Å; A180-T183 PolarHBondContact O-OG1 2.78Å; M181-T183 PolarHBondContact O-N 3.31Å; M181-T183 VanDerWaalsContact O-N 3.15Å
184I87.8Confident89.5Confident107 Ų10773.4 Ų73.455%0.54943%0.426SS..THydrogen-bonded Turntrans-98.8-60.6-173.5-55.3175.7000110.1M181M181-I184 HydrophobicContact CE-CD1 3.61Å; M181-I184 PolarHBondContact O-N 3.34Å; M181-I184 HydrophobicContact SD-CD1 4.21Å
185N87.8Confident89.6Confident96 Ų9675.9 Ų75.951%0.51344%0.438SS..  trans-146.4125.3-173.1-83.4-20.2000111.3M181 S188 T189M181-N185 PolarHBondContact O-N 2.98Å; M181-N185 VanDerWaalsContact O-N 3.07Å; N185-S188 WeakPolarHBondContact CB-OG 3.3Å; N185-S188 PolarHBondContact O-OG 3.45Å; N185-S188 VanDerWaalsContact O-OG 3.04Å; N185-T189 PolarHBondContact O-N 3.25Å; N185-T189 PolarHBondContact O-OG1 2.97Å
186L86.6Confident89.8Confident145 Ų14576.3 Ų76.376%0.75944%0.435SS*.Hα-helixtrans-62.9-44.3177.2-155.482.5000114.5S188 T189 L190L186-S188 PolarHBondContact O-N 2.86Å; L186-T189 WeakPolarHBondContact O-CB 3.36Å; L186-T189 PolarHBondContact O-N 3.37Å; L186-L190 PolarHBondContact O-N 3.4Å
187P88.4Confident90Very high95 Ų9577.1 Ų77.162%0.61743%0.434SS*.Hα-helixtrans-69.8-35.7-17525.4-33.2000113.2T189 L190 I191P187-T189 VanDerWaalsContact C-N 3.33Å; P187-L190 PolarHBondContact O-N 2.94Å; P187-I191 PolarHBondContact O-N 3.47Å
188S86.9Confident90.3Very high37 Ų3781 Ų8126%0.25945%0.448SS..Hα-helixtrans-68-34.5174.553.40000111.9N185 L186 L190 I191 I192N185-S188 WeakPolarHBondContact CB-OG 3.3Å; N185-S188 PolarHBondContact O-OG 3.45Å; N185-S188 VanDerWaalsContact O-OG 3.04Å; L186-S188 PolarHBondContact O-N 2.86Å; S188-L190 VanDerWaalsContact C-N 3.31Å; S188-L190 PolarHBondContact O-N 2.95Å; S188-I191 PolarHBondContact O-N 3.36Å; S188-I192 WeakPolarHBondContact O-CG1 3.35Å; S188-I192 PolarHBondContact O-N 3.32Å; S188-I192 VanDerWaalsContact O-N 3.14Å
189T91.6Very high90.5Very high23 Ų2381.2 Ų81.214%0.14145%0.449CS..Hα-helixtrans-61.4-40.8175.5-560000111.6M181 S182 N185 L186 P187 I191 I192 F193M181-T189 PolarHBondContact O-OG1 3.37Å; M181-T189 VanDerWaalsContact O-OG1 3.13Å; S182-T189 VanDerWaalsContact CA-OG1 3.31Å; S182-T189 WeakPolarHBondContact CA-OG1 3.45Å; S182-T189 PolarHBondContact N-OG1 3.37Å; N185-T189 PolarHBondContact O-N 3.25Å; N185-T189 PolarHBondContact O-OG1 2.97Å; L186-T189 WeakPolarHBondContact O-CB 3.36Å; L186-T189 PolarHBondContact O-N 3.37Å; P187-T189 VanDerWaalsContact C-N 3.33Å; T189-I191 VanDerWaalsContact C-N 3.32Å; T189-I191 PolarHBondContact O-N 3.19Å; T189-I192 PolarHBondContact O-N 2.91Å; T189-F193 VanDerWaalsContact O-CB 3.28Å; T189-F193 WeakPolarHBondContact O-CB 3.4Å; T189-F193 PolarHBondContact O-N 2.97Å
190L91.2Very high90.6Very high118 Ų11877.7 Ų77.762%0.61843%0.433SS*.Hα-helixtrans-60.5-42.1176.9-167.375.8000111.6L186 P187 S188 F193 T194L186-L190 PolarHBondContact O-N 3.4Å; P187-L190 PolarHBondContact O-N 2.94Å; S188-L190 VanDerWaalsContact C-N 3.31Å; S188-L190 PolarHBondContact O-N 2.95Å; L190-F193 PolarHBondContact O-N 2.74Å; L190-T194 WeakPolarHBondContact O-CG2 3.48Å; L190-T194 PolarHBondContact O-N 3.46Å
191I92.6Very high90.8Very high107 Ų10780.4 Ų80.455%0.54944%0.439SS..Hα-helixtrans-64.4-44.2179-62.1166.5000111.1P187 S188 T189 F193 T194 I195P187-I191 PolarHBondContact O-N 3.47Å; S188-I191 PolarHBondContact O-N 3.36Å; T189-I191 VanDerWaalsContact C-N 3.32Å; T189-I191 PolarHBondContact O-N 3.19Å; I191-F193 VanDerWaalsContact C-N 3.3Å; I191-F193 PolarHBondContact O-N 3.47Å; I191-T194 PolarHBondContact O-N 3.24Å; I191-T194 PolarHBondContact O-OG1 3Å; I191-I195 HydrophobicContact CG2-CD1 4.33Å; I191-I195 WeakPolarHBondContact O-CG1 3.41Å; I191-I195 PolarHBondContact O-N 2.89Å
192I92.9Very high91Very high42 Ų4282.2 Ų82.222%0.21545%0.45CS..Hα-helixtrans-70.8-33.4179.9-56.8167.3000110.2I174 T178 M181 S188 T189 I195 L196I174-I192 HydrophobicContact CG2-CG2 3.83Å; T178-I192 HydrophobicContact CG2-CB 3.89Å; T178-I192 HydrophobicContact CG2-CG2 3.39Å; M181-I192 HydrophobicContact CB-CD1 4.19Å; M181-I192 HydrophobicContact CG-CD1 3.63Å; S188-I192 WeakPolarHBondContact O-CG1 3.35Å; S188-I192 PolarHBondContact O-N 3.32Å; S188-I192 VanDerWaalsContact O-N 3.14Å; T189-I192 PolarHBondContact O-N 2.91Å; I192-I195 WeakPolarHBondContact O-CB 3.49Å; I192-I195 PolarHBondContact O-N 3.15Å; I192-L196 PolarHBondContact O-N 3.48Å
193F92.4Very high91.2Very high104 Ų10479.8 Ų79.846%0.45643%0.431SS..Hα-helixtrans-66.1-39.4175-174.4-105.9000112.7T189 L190 I191 I195 L196 I197T189-F193 VanDerWaalsContact O-CB 3.28Å; T189-F193 WeakPolarHBondContact O-CB 3.4Å; T189-F193 PolarHBondContact O-N 2.97Å; L190-F193 PolarHBondContact O-N 2.74Å; I191-F193 VanDerWaalsContact C-N 3.3Å; I191-F193 PolarHBondContact O-N 3.47Å; F193-I195 VanDerWaalsContact C-N 3.31Å; F193-I195 PolarHBondContact O-N 2.98Å; F193-L196 HydrophobicContact CD2-CD2 4.43Å; F193-L196 WeakPolarHBondContact O-CB 3.01Å; F193-L196 PolarHBondContact O-N 3.41Å; F193-I197 HydrophobicContact CD1-CD1 3.86Å; F193-I197 HydrophobicContact CE1-CD1 3.49Å; F193-I197 VanDerWaalsContact CE1-CD1 3.49Å; F193-I197 HydrophobicContact CE1-CG1 4.25Å; F193-I197 HydrophobicContact CZ-CD1 4.08Å; F193-I197 HydrophobicContact CZ-CG1 4.43Å; F193-I197 PolarHBondContact O-N 3.47Å
194T93.4Very high91.4Very high76 Ų7678.2 Ų78.247%0.46642%0.418SS..Hα-helixtrans-64.5-37.1173.457.40000111.8L190 I191 I197 L198L190-T194 WeakPolarHBondContact O-CG2 3.48Å; L190-T194 PolarHBondContact O-N 3.46Å; I191-T194 PolarHBondContact O-N 3.24Å; I191-T194 PolarHBondContact O-OG1 3Å; T194-I197 PolarHBondContact O-N 3.36Å; T194-L198 PolarHBondContact O-N 3.31Å
195I94.3Very high91.6Very high84 Ų8475.2 Ų75.243%0.43141%0.409SS..Hα-helixtrans-62.2-42.3172.9-66.1166.2000111I174 I191 I192 F193 I197 L198 L199I174-I195 HydrophobicContact CD1-CG2 4.13Å; I191-I195 HydrophobicContact CG2-CD1 4.33Å; I191-I195 WeakPolarHBondContact O-CG1 3.41Å; I191-I195 PolarHBondContact O-N 2.89Å; I192-I195 WeakPolarHBondContact O-CB 3.49Å; I192-I195 PolarHBondContact O-N 3.15Å; F193-I195 VanDerWaalsContact C-N 3.31Å; F193-I195 PolarHBondContact O-N 2.98Å; I195-I197 PolarHBondContact O-N 2.88Å; I195-L198 PolarHBondContact O-N 2.87Å; I195-L199 WeakPolarHBondContact O-CB 3.46Å; I195-L199 PolarHBondContact O-N 3.42Å
196L93.3Very high91.8Very high31 Ų3172.5 Ų72.516%0.16240%0.396CS..Hα-helixtrans-59.5-45.4176.1-177.766.6000111.5I174 I192 F193 L198 L199 T200I174-L196 HydrophobicContact CB-CD1 4.21Å; I174-L196 HydrophobicContact CG2-CB 3.92Å; I174-L196 HydrophobicContact CG2-CD1 3.98Å; I174-L196 HydrophobicContact CG2-CG 4.5Å; I192-L196 PolarHBondContact O-N 3.48Å; F193-L196 HydrophobicContact CD2-CD2 4.43Å; F193-L196 WeakPolarHBondContact O-CB 3.01Å; F193-L196 PolarHBondContact O-N 3.41Å; L196-L198 PolarHBondContact O-N 2.89Å; L196-L199 WeakPolarHBondContact O-CB 3.36Å; L196-L199 PolarHBondContact O-N 3Å; L196-T200 WeakPolarHBondContact O-CG2 3.27Å; L196-T200 PolarHBondContact O-N 3.4Å
197I92.9Very high91.9Very high77 Ų7765.8 Ų65.840%0.39536%0.361SS..Hα-helixtrans-60.1-47.9176.3-67.5165.6000110.4F193 T194 I195 L199 T200 I201F193-I197 HydrophobicContact CD1-CD1 3.86Å; F193-I197 HydrophobicContact CE1-CD1 3.49Å; F193-I197 VanDerWaalsContact CE1-CD1 3.49Å; F193-I197 HydrophobicContact CE1-CG1 4.25Å; F193-I197 HydrophobicContact CZ-CD1 4.08Å; F193-I197 HydrophobicContact CZ-CG1 4.43Å; F193-I197 PolarHBondContact O-N 3.47Å; T194-I197 PolarHBondContact O-N 3.36Å; I195-I197 PolarHBondContact O-N 2.88Å; I197-L199 VanDerWaalsContact C-N 3.26Å; I197-L199 PolarHBondContact O-N 3.15Å; I197-T200 PolarHBondContact O-N 3.45Å; I197-T200 VanDerWaalsContact O-N 3.14Å; I197-T200 PolarHBondContact O-OG1 3.05Å; I197-I201 HydrophobicContact CG2-CD1 4.15Å; I197-I201 WeakPolarHBondContact O-CG1 3.39Å; I197-I201 PolarHBondContact O-N 3.45Å; I197-I201 VanDerWaalsContact O-N 3.14Å
198L94.7Very high92Very high120 Ų12066.6 Ų66.663%0.62836%0.36SS*.Hα-helixtrans-59.2-40.8179.4-176.564.5000111.7T194 I195 L196 I201 L202T194-L198 PolarHBondContact O-N 3.31Å; I195-L198 PolarHBondContact O-N 2.87Å; L196-L198 PolarHBondContact O-N 2.89Å; L198-I201 PolarHBondContact O-N 3.49Å; L198-L202 PolarHBondContact O-N 3.35Å
199L93.5Very high92.2Very high25 Ų2569.4 Ų69.413%0.13137%0.371CS..Hα-helixtrans-63.3-42.6176.3-174.877.5000112.1L170 M171 I174 I195 L196 I197 I201 L202 E203L170-L199 HydrophobicContact CB-CD2 4.45Å; L170-L199 HydrophobicContact CD2-CD1 3.5Å; L170-L199 VanDerWaalsContact CD2-CD1 3.5Å; L170-L199 HydrophobicContact CD2-CD2 3.21Å; L170-L199 HydrophobicContact CD2-CG 3.96Å; L170-L199 HydrophobicContact CG-CD2 4.42Å; M171-L199 HydrophobicContact CB-CD2 4.29Å; M171-L199 HydrophobicContact CG-CD2 3.52Å; M171-L199 HydrophobicContact CG-CG 4.29Å; I174-L199 HydrophobicContact CD1-CD2 4.19Å; I195-L199 WeakPolarHBondContact O-CB 3.46Å; I195-L199 PolarHBondContact O-N 3.42Å; L196-L199 WeakPolarHBondContact O-CB 3.36Å; L196-L199 PolarHBondContact O-N 3Å; I197-L199 VanDerWaalsContact C-N 3.26Å; I197-L199 PolarHBondContact O-N 3.15Å; L199-I201 VanDerWaalsContact C-N 3.27Å; L199-I201 PolarHBondContact O-N 3.43Å; L199-L202 HydrophobicContact CD1-CD2 4.45Å; L199-L202 WeakPolarHBondContact O-CB 3.32Å; L199-L202 PolarHBondContact O-N 3.17Å; L199-L202 VanDerWaalsContact O-N 3.15Å; L199-E203 PolarHBondContact O-N 3.11Å
200T91.4Very high92Very high53 Ų5368.9 Ų68.933%0.32537%0.367SS..Hα-helixtrans-61.5-38.1177.960.20000111.9M171 L196 I197 E203 I204M171-T200 HydrophobicContact SD-CG2 3.94Å; L196-T200 WeakPolarHBondContact O-CG2 3.27Å; L196-T200 PolarHBondContact O-N 3.4Å; I197-T200 PolarHBondContact O-N 3.45Å; I197-T200 VanDerWaalsContact O-N 3.14Å; I197-T200 PolarHBondContact O-OG1 3.05Å; T200-E203 PolarHBondContact O-N 3.03Å; T200-I204 VanDerWaalsContact O-CG1 3.28Å; T200-I204 WeakPolarHBondContact O-CG1 3.45Å; T200-I204 PolarHBondContact O-N 3.15Å
201I92.8Very high92Very high103 Ų10363.3 Ų63.353%0.52834%0.338SS..Hα-helixtrans-65-43.1175.6-64.3167.8000110.5I197 L198 L199 E203 I204 A205I197-I201 HydrophobicContact CG2-CD1 4.15Å; I197-I201 WeakPolarHBondContact O-CG1 3.39Å; I197-I201 PolarHBondContact O-N 3.45Å; I197-I201 VanDerWaalsContact O-N 3.14Å; L198-I201 PolarHBondContact O-N 3.49Å; L199-I201 VanDerWaalsContact C-N 3.27Å; L199-I201 PolarHBondContact O-N 3.43Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 2.96Å; I201-I204 PolarHBondContact O-N 3.26Å; I201-A205 PolarHBondContact O-N 2.9Å
202L92.1Very high91.8Very high100 Ų10063.1 Ų63.152%0.52433%0.331SS..Hα-helixtrans-59.7-45.4175.8179.867.6000111L198 L199 I204 A205 V206L198-L202 PolarHBondContact O-N 3.35Å; L199-L202 HydrophobicContact CD1-CD2 4.45Å; L199-L202 WeakPolarHBondContact O-CB 3.32Å; L199-L202 PolarHBondContact O-N 3.17Å; L199-L202 VanDerWaalsContact O-N 3.15Å; L202-I204 PolarHBondContact O-N 3.04Å; L202-A205 WeakPolarHBondContact O-CB 3.32Å; L202-A205 PolarHBondContact O-N 3.44Å; L202-A205 VanDerWaalsContact O-N 3.11Å; L202-V206 HydrophobicContact CD1-CG2 4.38Å; L202-V206 HydrophobicContact CG-CG2 4.33Å; L202-V206 WeakPolarHBondContact O-CG2 3.5Å; L202-V206 PolarHBondContact O-N 2.65Å
203E90.9Very high91.7Very high13 Ų1363 Ų636%0.06133%0.332CS..Hα-helixtrans-67.2-36.7-176.9-161.664.9-160.700112.2L87 G167 M171 L199 T200 I201 A205 V206 A207L87-E203 HydrophobicContact CD1-CG 4.44Å; L87-E203 HydrophobicContact CD2-CB 4.18Å; L87-E203 HydrophobicContact CD2-CG 3.41Å; L87-E203 VanDerWaalsContact CD2-CG 3.41Å; G167-E203 WeakPolarHBondContact CA-OE2 3.28Å; M171-E203 HydrophobicContact CE-CG 4.12Å; L199-E203 PolarHBondContact O-N 3.11Å; T200-E203 PolarHBondContact O-N 3.03Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 2.96Å; E203-A205 VanDerWaalsContact C-N 3.3Å; E203-A205 PolarHBondContact O-N 2.98Å; E203-V206 PolarHBondContact O-N 3.48Å; E203-A207 VanDerWaalsContact O-CB 3.3Å; E203-A207 WeakPolarHBondContact O-CB 3.5Å; E203-A207 PolarHBondContact O-N 2.82Å
204I91.2Very high91.5Very high86 Ų8658 Ų5844%0.44131%0.31SS..Hα-helixtrans-59.3-43.3171.3-67.2164.8000110.7L87 T200 I201 L202 L208L87-I204 HydrophobicContact CD1-CB 4.21Å; L87-I204 HydrophobicContact CD1-CG1 3.61Å; T200-I204 VanDerWaalsContact O-CG1 3.28Å; T200-I204 WeakPolarHBondContact O-CG1 3.45Å; T200-I204 PolarHBondContact O-N 3.15Å; I201-I204 PolarHBondContact O-N 3.26Å; L202-I204 PolarHBondContact O-N 3.04Å; I204-L208 PolarHBondContact O-N 2.76Å
205A92.1Very high91.2Very high45 Ų4554.4 Ų54.437%0.37229%0.288SS..Hα-helixtrans-65.5-45.5177.200000111.7I201 L202 E203 A207 L208 I209I201-A205 PolarHBondContact O-N 2.9Å; L202-A205 WeakPolarHBondContact O-CB 3.32Å; L202-A205 PolarHBondContact O-N 3.44Å; L202-A205 VanDerWaalsContact O-N 3.11Å; E203-A205 VanDerWaalsContact C-N 3.3Å; E203-A205 PolarHBondContact O-N 2.98Å; A205-A207 VanDerWaalsContact C-N 3.35Å; A205-A207 PolarHBondContact O-N 3.21Å; A205-L208 PolarHBondContact O-N 3.36Å; A205-I209 WeakPolarHBondContact O-CB 3.48Å; A205-I209 VanDerWaalsContact O-CG1 3.26Å; A205-I209 WeakPolarHBondContact O-CG1 3.48Å; A205-I209 PolarHBondContact O-N 3.4Å
206V91.9Very high90.9Very high39 Ų3953 Ų5324%0.23628%0.281CS..Hα-helixtrans-61.2-42.5177.9172.90000111.1N163 L202 E203 L208 I209 Q210N163-V206 HydrophobicContact CB-CG1 4.06Å; L202-V206 HydrophobicContact CD1-CG2 4.38Å; L202-V206 HydrophobicContact CG-CG2 4.33Å; L202-V206 WeakPolarHBondContact O-CG2 3.5Å; L202-V206 PolarHBondContact O-N 2.65Å; E203-V206 PolarHBondContact O-N 3.48Å; V206-L208 VanDerWaalsContact C-N 3.32Å; V206-L208 PolarHBondContact O-N 3.38Å; V206-I209 PolarHBondContact O-N 2.91Å; V206-Q210 WeakPolarHBondContact O-CB 3.26Å; V206-Q210 PolarHBondContact O-N 3.38Å
207A89.5Confident90.6Very high4 Ų453.3 Ų53.33%0.03328%0.283CS..Hα-helixtrans-57.5-41.9178.200000112.9N83 L87 E203 A205 A211N83-A207 HydrophobicContact CB-CB 3.9Å; N83-A207 PolarHBondContact ND2-O 3.11Å; L87-A207 HydrophobicContact CD1-CB 4.11Å; E203-A207 VanDerWaalsContact O-CB 3.3Å; E203-A207 WeakPolarHBondContact O-CB 3.5Å; E203-A207 PolarHBondContact O-N 2.82Å; A205-A207 VanDerWaalsContact C-N 3.35Å; A205-A207 PolarHBondContact O-N 3.21Å; A207-A211 PolarHBondContact O-N 2.83Å
208L89.4Confident90.2Very high111 Ų11150 Ų5058%0.58127%0.266SS*.Hα-helixtrans-75.4-45.2178.9-169.1151.3000111.9I204 A205 V206 Q210 A211 Y212I204-L208 PolarHBondContact O-N 2.76Å; A205-L208 PolarHBondContact O-N 3.36Å; V206-L208 VanDerWaalsContact C-N 3.32Å; V206-L208 PolarHBondContact O-N 3.38Å; L208-Q210 VanDerWaalsContact C-N 3.27Å; L208-Q210 PolarHBondContact O-N 3.45Å; L208-A211 PolarHBondContact O-N 3.48Å; L208-Y212 PolarHBondContact O-N 3.34Å; L208-Y212 VanDerWaalsContact O-N 3.14Å
209I91.1Very high89.8Confident97 Ų9744.5 Ų44.550%0.49724%0.238SC..Hα-helixtrans-60.3-40.8177.9-69166.8000110.3A205 V206 A211 Y212 V213A205-I209 WeakPolarHBondContact O-CB 3.48Å; A205-I209 VanDerWaalsContact O-CG1 3.26Å; A205-I209 WeakPolarHBondContact O-CG1 3.48Å; A205-I209 PolarHBondContact O-N 3.4Å; V206-I209 PolarHBondContact O-N 2.91Å; I209-A211 PolarHBondContact O-N 3.05Å; I209-Y212 WeakPolarHBondContact O-CB 3.39Å; I209-Y212 PolarHBondContact O-N 3.47Å; I209-V213 HydrophobicContact CG2-CG2 4.02Å; I209-V213 WeakPolarHBondContact O-CG2 3.41Å; I209-V213 PolarHBondContact O-N 3Å
210Q89.3Confident89.3Confident11 Ų1146.6 Ų46.65%0.05125%0.249CC..Hα-helixtrans-67.1-37.7-177.8-173.163.97.100112.3R159 L160 V206 L208 Y212 F214R159-Q210 VanDerWaalsContact CG-NE2 3.3Å; L160-Q210 VanDerWaalsContact CA-NE2 3.25Å; L160-Q210 HydrophobicContact CB-CG 4.22Å; L160-Q210 HydrophobicContact CD1-CB 4.34Å; L160-Q210 HydrophobicContact CD1-CG 3.4Å; L160-Q210 HydrophobicContact CG-CG 4.4Å; V206-Q210 WeakPolarHBondContact O-CB 3.26Å; V206-Q210 PolarHBondContact O-N 3.38Å; L208-Q210 VanDerWaalsContact C-N 3.27Å; L208-Q210 PolarHBondContact O-N 3.45Å; Q210-Y212 VanDerWaalsContact C-N 3.34Å; Q210-F214 VanDerWaalsContact O-CB 3.31Å; Q210-F214 WeakPolarHBondContact O-CB 3.46Å; Q210-F214 PolarHBondContact O-N 2.97Å
211A89.8Confident88.7Confident1 Ų145 Ų451%0.00824%0.237CC..Hα-helixtrans-61.7-43.8171.900000111.2I76 I79 A80 A207 L208 I209 T215I76-A211 HydrophobicContact CG1-CB 4.5Å; I79-A211 HydrophobicContact CB-CB 4.06Å; I79-A211 HydrophobicContact CG2-CB 3.78Å; A80-A211 HydrophobicContact CB-CB 3.9Å; A207-A211 PolarHBondContact O-N 2.83Å; L208-A211 PolarHBondContact O-N 3.48Å; I209-A211 PolarHBondContact O-N 3.05Å; A211-T215 VanDerWaalsContact O-CG2 3.24Å; A211-T215 WeakPolarHBondContact O-CG2 3.41Å; A211-T215 PolarHBondContact O-N 2.95Å; A211-T215 PolarHBondContact O-OG1 2.67Å
212Y89.9Confident88.1Confident103 Ų10340.2 Ų40.240%0.40421%0.212SC..Hα-helixtrans-62.4-52.2176.7177.5-101.5000112.3I76 L208 I209 Q210 F214 T215 L216I76-Y212 HydrophobicContact CD1-CD2 4.15Å; L208-Y212 PolarHBondContact O-N 3.34Å; L208-Y212 VanDerWaalsContact O-N 3.14Å; I209-Y212 WeakPolarHBondContact O-CB 3.39Å; I209-Y212 PolarHBondContact O-N 3.47Å; Q210-Y212 VanDerWaalsContact C-N 3.34Å; Y212-F214 VanDerWaalsContact C-N 3.3Å; Y212-F214 PolarHBondContact O-N 3.49Å; Y212-T215 PolarHBondContact O-N 3.14Å; Y212-T215 PolarHBondContact O-OG1 3.14Å; Y212-L216 HydrophobicContact CE1-CD1 3.64Å; Y212-L216 HydrophobicContact CE2-CD1 4.46Å; Y212-L216 WeakPolarHBondContact O-CB 3.48Å; Y212-L216 PolarHBondContact O-N 3.28Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.43Å
213V89.9Confident87.6Confident39 Ų3939.1 Ų39.124%0.23620%0.204CC..Hα-helixtrans-60.8-39.2-179.7172.30000111.5I209 T215 L217I209-V213 HydrophobicContact CG2-CG2 4.02Å; I209-V213 WeakPolarHBondContact O-CG2 3.41Å; I209-V213 PolarHBondContact O-N 3Å; V213-T215 PolarHBondContact O-N 3.33Å; V213-L217 HydrophobicContact CG1-CD1 3.94Å; V213-L217 WeakPolarHBondContact O-CG 3.37Å; V213-L217 PolarHBondContact O-N 3Å; V213-L217 VanDerWaalsContact O-N 3.08Å
214F87.3Confident86.9Confident0 Ų042 Ų420%022%0.22CC..Hα-helixtrans-56.3-52.7175.6-174.3-75.9000110.8L75 I79 A105 L108 L156 L160 Q210 Y212 L217 V218L75-F214 HydrophobicContact CD1-CE1 4.24Å; L75-F214 HydrophobicContact CD2-CD1 3.45Å; L75-F214 VanDerWaalsContact CD2-CD1 3.45Å; L75-F214 HydrophobicContact CD2-CE1 3.52Å; L75-F214 HydrophobicContact CG-CE1 4.46Å; I79-F214 HydrophobicContact CD1-CB 4.29Å; I79-F214 HydrophobicContact CD1-CD1 3.53Å; I79-F214 HydrophobicContact CD1-CD2 4.19Å; I79-F214 HydrophobicContact CD1-CE1 3.84Å; I79-F214 HydrophobicContact CD1-CE2 4.43Å; I79-F214 HydrophobicContact CD1-CG 3.74Å; I79-F214 HydrophobicContact CD1-CZ 4.28Å; A105-F214 HydrophobicContact CB-CE2 4.33Å; A105-F214 HydrophobicContact CB-CZ 4.15Å; L108-F214 HydrophobicContact CD1-CE1 4.01Å; L108-F214 HydrophobicContact CD1-CZ 4.33Å; L156-F214 HydrophobicContact CD1-CD2 4.34Å; L156-F214 HydrophobicContact CD2-CD1 4.05Å; L156-F214 HydrophobicContact CD2-CD2 3.3Å; L156-F214 HydrophobicContact CD2-CE1 3.93Å; L156-F214 HydrophobicContact CD2-CE2 3.17Å; L156-F214 HydrophobicContact CD2-CG 3.75Å; L156-F214 HydrophobicContact CD2-CZ 3.51Å; L156-F214 HydrophobicContact CG-CD2 3.49Å; L156-F214 VanDerWaalsContact CG-CD2 3.49Å; L156-F214 HydrophobicContact CG-CE2 3.73Å; L156-F214 HydrophobicContact CG-CG 4.14Å; L160-F214 HydrophobicContact CD2-CD2 4.46Å; Q210-F214 VanDerWaalsContact O-CB 3.31Å; Q210-F214 WeakPolarHBondContact O-CB 3.46Å; Q210-F214 PolarHBondContact O-N 2.97Å; Y212-F214 VanDerWaalsContact C-N 3.3Å; Y212-F214 PolarHBondContact O-N 3.49Å; F214-L217 PolarHBondContact O-N 3.22Å; F214-V218 HydrophobicContact CD1-CG2 4.25Å; F214-V218 HydrophobicContact CE1-CG2 4Å; F214-V218 WeakPolarHBondContact O-CG2 3.19Å; F214-V218 PolarHBondContact O-N 3.28Å
215T88.6Confident86Confident0 Ų039.4 Ų39.40%021%0.207CC..Hα-helixtrans-73.3-34.2-174.563.40000112.9M57 L75 I76 A211 Y212 V213 V218 S219M57-T215 VanDerWaalsContact CE-CB 3.48Å; M57-T215 WeakPolarHBondContact CE-OG1 3.34Å; L75-T215 HydrophobicContact CD2-CG2 3.25Å; L75-T215 HydrophobicContact CG-CG2 4.48Å; I76-T215 VanDerWaalsContact CA-CG2 3.48Å; I76-T215 HydrophobicContact CB-CG2 3.47Å; I76-T215 VanDerWaalsContact CB-CG2 3.47Å; I76-T215 HydrophobicContact CG1-CG2 3.95Å; A211-T215 VanDerWaalsContact O-CG2 3.24Å; A211-T215 WeakPolarHBondContact O-CG2 3.41Å; A211-T215 PolarHBondContact O-N 2.95Å; A211-T215 PolarHBondContact O-OG1 2.67Å; Y212-T215 PolarHBondContact O-N 3.14Å; Y212-T215 PolarHBondContact O-OG1 3.14Å; V213-T215 PolarHBondContact O-N 3.33Å; T215-V218 PolarHBondContact O-N 3.33Å; T215-S219 WeakPolarHBondContact O-CB 3.42Å; T215-S219 PolarHBondContact O-N 3.19Å
216L87.9Confident84.8Confident54 Ų5438.5 Ų38.528%0.28320%0.197SC..Hα-helixtrans-62.7-44.6175.2-175.8147.8000110.9Y212 S219 L220Y212-L216 HydrophobicContact CE1-CD1 3.64Å; Y212-L216 HydrophobicContact CE2-CD1 4.46Å; Y212-L216 WeakPolarHBondContact O-CB 3.48Å; Y212-L216 PolarHBondContact O-N 3.28Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.43Å; L216-S219 WeakPolarHBondContact CA-OG 3.4Å; L216-S219 CarbonylContact O-C 3.59Å; L216-S219 WeakPolarHBondContact O-CB 3.48Å; L216-S219 PolarHBondContact O-N 3.07Å; L216-S219 VanDerWaalsContact O-N 3.15Å; L216-S219 PolarHBondContact O-OG 3.15Å; L216-L220 PolarHBondContact O-N 3.13Å
217L85.9Confident84.5Confident38 Ų3838.5 Ų38.520%0.19920%0.195CC..Hα-helixtrans-63.4-43.2177.4-76.7167.6000111.8L156 V213 F214 S219 L220 Y221L156-L217 HydrophobicContact CD1-CB 3.86Å; L156-L217 HydrophobicContact CD1-CD1 3.32Å; L156-L217 HydrophobicContact CD1-CG 4.21Å; V213-L217 HydrophobicContact CG1-CD1 3.94Å; V213-L217 WeakPolarHBondContact O-CG 3.37Å; V213-L217 PolarHBondContact O-N 3Å; V213-L217 VanDerWaalsContact O-N 3.08Å; F214-L217 PolarHBondContact O-N 3.22Å; L217-S219 VanDerWaalsContact C-N 3.26Å; L217-S219 PolarHBondContact O-N 2.98Å; L217-L220 PolarHBondContact O-N 2.77Å; L217-Y221 HydrophobicContact CB-CE2 4.18Å; L217-Y221 WeakPolarHBondContact O-CD2 3.5Å; L217-Y221 WeakPolarHBondContact O-CE2 3.44Å; L217-Y221 PolarHBondContact O-N 3.04Å
218V84.9Confident84.2Confident9 Ų940.3 Ų40.36%0.05520%0.204CC..Hα-helixtrans-58.6-41.2173177.70000111.3L72 L108 L156 F214 T215 Y221 L222L72-V218 HydrophobicContact CD2-CB 4.2Å; L72-V218 HydrophobicContact CD2-CG1 3.83Å; L108-V218 HydrophobicContact CB-CG1 4.38Å; L156-V218 HydrophobicContact CD2-CG2 4.3Å; F214-V218 HydrophobicContact CD1-CG2 4.25Å; F214-V218 HydrophobicContact CE1-CG2 4Å; F214-V218 WeakPolarHBondContact O-CG2 3.19Å; F214-V218 PolarHBondContact O-N 3.28Å; T215-V218 PolarHBondContact O-N 3.33Å; V218-Y221 PolarHBondContact O-N 3.3Å; V218-L222 PolarHBondContact O-N 2.92Å; V218-L222 VanDerWaalsContact O-N 3.08Å
219S85.6Confident83.9Confident4 Ų436.4 Ų36.43%0.02818%0.183CC..Hα-helixtrans-67.3-37.8177.684.40000112.5H61 T215 L216 L217 L222 H223H61-S219 PolarHBondContact NE2-O 3.1Å; T215-S219 WeakPolarHBondContact O-CB 3.42Å; T215-S219 PolarHBondContact O-N 3.19Å; L216-S219 WeakPolarHBondContact CA-OG 3.4Å; L216-S219 CarbonylContact O-C 3.59Å; L216-S219 WeakPolarHBondContact O-CB 3.48Å; L216-S219 PolarHBondContact O-N 3.07Å; L216-S219 VanDerWaalsContact O-N 3.15Å; L216-S219 PolarHBondContact O-OG 3.15Å; L217-S219 VanDerWaalsContact C-N 3.26Å; L217-S219 PolarHBondContact O-N 2.98Å; S219-L222 WeakPolarHBondContact O-CB 3.36Å; S219-L222 PolarHBondContact O-N 3.39Å; S219-H223 PolarHBondContact O-N 3.42Å
220L83.8Confident83.5Confident68 Ų6832.8 Ų32.836%0.35616%0.164SC..Hα-helixtrans-65.6-41.8176.6-171.7147.3000111L216 L217 L222 H223 D224L216-L220 PolarHBondContact O-N 3.13Å; L217-L220 PolarHBondContact O-N 2.77Å; L220-L222 VanDerWaalsContact C-N 3.28Å; L220-L222 PolarHBondContact O-N 3.45Å; L220-H223 WeakPolarHBondContact O-CB 3.43Å; L220-H223 PolarHBondContact O-N 3.22Å; L220-H223 VanDerWaalsContact O-N 3.1Å; L220-D224 WeakPolarHBondContact CD2-OD2 3.31Å; L220-D224 PolarHBondContact O-N 3.33Å
221Y79Confident83.1Confident20 Ų2034.2 Ų34.28%0.07817%0.171CC..Hα-helixtrans-61.5-39.1172.6-61.7-51.4000112.5Q152 L217 V218 H223 D224 N225Q152-Y221 HydrophobicContact CG-CE1 4.38Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.47Å; Q152-Y221 VanDerWaalsContact NE2-CE1 3.35Å; Q152-Y221 PolarHBondContact NE2-OH 3.34Å; Q152-Y221 PolarHBondContact OE1-OH 3.21Å; L217-Y221 HydrophobicContact CB-CE2 4.18Å; L217-Y221 WeakPolarHBondContact O-CD2 3.5Å; L217-Y221 WeakPolarHBondContact O-CE2 3.44Å; L217-Y221 PolarHBondContact O-N 3.04Å; V218-Y221 PolarHBondContact O-N 3.3Å; Y221-H223 VanDerWaalsContact C-N 3.29Å; Y221-D224 PolarHBondContact O-N 2.9Å; Y221-N225 VanDerWaalsContact O-CB 3.3Å; Y221-N225 WeakPolarHBondContact O-CB 3.43Å; Y221-N225 PolarHBondContact O-N 3.48Å; Y221-N225 VanDerWaalsContact O-N 3.08Å; Y221-N225 PolarHBondContact O-ND2 2.8Å
222L80.6Confident82.7Confident3 Ų336.4 Ų36.42%0.01618%0.182CC..Hα-helixtrans-62.9-42.7175.9-17173.5000110.3W68 M115 V218 S219 L220 N225 T226W68-L222 HydrophobicContact CB-CD2 3.47Å; W68-L222 VanDerWaalsContact CB-CD2 3.47Å; W68-L222 HydrophobicContact CD2-CD1 3.85Å; W68-L222 HydrophobicContact CD2-CD2 4.19Å; W68-L222 HydrophobicContact CE3-CD1 4.2Å; W68-L222 HydrophobicContact CG-CD1 4Å; W68-L222 HydrophobicContact CG-CD2 3.63Å; W68-L222 HydrophobicContact CG-CG 4.49Å; M115-L222 HydrophobicContact SD-CD1 4.25Å; V218-L222 PolarHBondContact O-N 2.92Å; V218-L222 VanDerWaalsContact O-N 3.08Å; S219-L222 WeakPolarHBondContact O-CB 3.36Å; S219-L222 PolarHBondContact O-N 3.39Å; L220-L222 VanDerWaalsContact C-N 3.28Å; L220-L222 PolarHBondContact O-N 3.45Å; L222-N225 PolarHBondContact O-N 3.14Å; L222-T226 HydrophobicContact CD1-CG2 4.3Å; L222-T226 HydrophobicContact CG-CG2 4.27Å; L222-T226 WeakPolarHBondContact O-CB 3.28Å; L222-T226 WeakPolarHBondContact O-CG2 3.42Å; L222-T226 PolarHBondContact O-N 3.44Å; L222-T226 VanDerWaalsContact O-N 3.09Å; L222-T226 PolarHBondContact O-OG1 3.34Å
223H80.6Confident82.2Confident76 Ų7631.6 Ų31.635%0.35217%0.166SC..Hα-helixtrans-59.2-51176.3-175.186.8000111.8M60 S219 L220 Y221 N225 T226M60-H223 PolarHBondContact O-CE1 3.47Å; M60-H223 PolarHBondContact O-ND1 2.96Å; S219-H223 PolarHBondContact O-N 3.42Å; L220-H223 WeakPolarHBondContact O-CB 3.43Å; L220-H223 PolarHBondContact O-N 3.22Å; L220-H223 VanDerWaalsContact O-N 3.1Å; Y221-H223 VanDerWaalsContact C-N 3.29Å; H223-N225 PolarHBondContact O-N 3.25Å; H223-T226 PolarHBondContact O-N 3.28Å; H223-T226 VanDerWaalsContact O-N 3.13Å; H223-T226 PolarHBondContact O-OG1 3.41Å
224D76.3Confident81.6Confident74 Ų7431.1 Ų31.140%0.39616%0.161SC..Hα-helixtrans-61.3-31.1-179.4-65.4-16.9000112.5L220 Y221L220-D224 WeakPolarHBondContact CD2-OD2 3.31Å; L220-D224 PolarHBondContact O-N 3.33Å; Y221-D224 PolarHBondContact O-N 2.9Å
225N72.3Confident81.1Confident32 Ų3233.7 Ų33.717%0.17117%0.174CC..Hα-helixtrans-90.1-5.3-180-75.4-70.9000114.3G116 S119 Y221 L222 H223G116-N225 VanDerWaalsContact CA-O 3.24Å; G116-N225 WeakPolarHBondContact CA-O 3.32Å; S119-N225 PolarHBondContact OG-O 2.99Å; Y221-N225 VanDerWaalsContact O-CB 3.3Å; Y221-N225 WeakPolarHBondContact O-CB 3.43Å; Y221-N225 PolarHBondContact O-N 3.48Å; Y221-N225 VanDerWaalsContact O-N 3.08Å; Y221-N225 PolarHBondContact O-ND2 2.8Å; L222-N225 PolarHBondContact O-N 3.14Å; H223-N225 PolarHBondContact O-N 3.25Å
226T67.6Low80.4Confident26 Ų2636.7 Ų36.716%0.1619%0.19CC..  trans-109.30-178.657.30000114.5K120 L222 H223K120-T226 WeakPolarHBondContact CE-O 3.33Å; K120-T226 PolarHBondContact NZ-O 3.49Å; L222-T226 HydrophobicContact CD1-CG2 4.3Å; L222-T226 HydrophobicContact CG-CG2 4.27Å; L222-T226 WeakPolarHBondContact O-CB 3.28Å; L222-T226 WeakPolarHBondContact O-CG2 3.42Å; L222-T226 PolarHBondContact O-N 3.44Å; L222-T226 VanDerWaalsContact O-N 3.09Å; L222-T226 PolarHBondContact O-OG1 3.34Å; H223-T226 PolarHBondContact O-N 3.28Å; H223-T226 VanDerWaalsContact O-N 3.13Å; H223-T226 PolarHBondContact O-OG1 3.41Å

Retrieved 226 of 226 residues in 182.3 ms (Link to these results)

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