A0A059RGC7_HUMAN Loading...

ATP synthase subunit a

AlphaFold DB , UniProt , Accession A0A059RGC7, 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
1M44.2Very low71.1Confident219 Ų219100.9 Ų100.9100%1.07954%0.543SS*.  0123.80-71.1157.791.300106E3M1-E3 PolarHBondContact O-N 3.39Å
2N46Very low72Confident160 Ų16095.7 Ų95.786%0.85652%0.519SS*.  trans-66.686167.6-97.413000106.1N4N2-N4 PolarHBondContact O-N 3.18Å
3E58Low73.1Confident121 Ų12195.8 Ų95.857%0.56553%0.525SS*.  trans-54.9114.4164.5-73.3-84.5140.600105.4M1 L5M1-E3 PolarHBondContact O-N 3.39Å; E3-L5 PolarHBondContact O-N 3.33Å
4N73.5Confident74Confident122 Ų12296.9 Ų96.965%0.65253%0.528SS*.  trans-70.779.6177.8-76.7-26.4000108N2 F6 A7N2-N4 PolarHBondContact O-N 3.18Å; N4-F6 PolarHBondContact O-N 3.37Å; N4-A7 HydrophobicContact CB-CB 3.82Å; N4-A7 VanDerWaalsContact O-CB 3.23Å; N4-A7 WeakPolarHBondContact O-CB 2.93Å; N4-A7 PolarHBondContact O-N 3.38Å
5L74.1Confident74.7Confident45 Ų45102.1 Ų102.124%0.23655%0.554CS.*THydrogen-bonded Turntrans-52.4-26.8175.8-63.8175.4000111.8E3 L169 H172 L173E3-L5 PolarHBondContact O-N 3.33Å; L5-L169 HydrophobicContact CB-CD2 4.25Å; L5-H172 VanDerWaalsContact CD2-CE1 3.44Å; L5-H172 WeakPolarHBondContact CD2-CE1 3.43Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.23Å; L5-L173 HydrophobicContact CD1-CD2 3.84Å; L5-L173 HydrophobicContact CD2-CD2 4.4Å
6F80.5Confident75.2Confident135 Ų135100 Ų10059%0.59256%0.564SS**THydrogen-bonded Turntrans-90.1-5.8-179.9-63.2-76.6000114.8N4 S8 F9 L169N4-F6 PolarHBondContact O-N 3.37Å; F6-S8 PolarHBondContact O-N 3.16Å; F6-F9 AromaticContact CD1-CD2 3.97Å; F6-F9 HydrophobicContact CD1-CD2 3.97Å; F6-F9 HydrophobicContact CD1-CE2 4.34Å; F6-F9 PolarHBondContact O-N 3.34Å; F6-L169 HydrophobicContact CD1-CD2 4.44Å; F6-L169 HydrophobicContact CE1-CD1 4.07Å; F6-L169 HydrophobicContact CE1-CD2 4.09Å; F6-L169 HydrophobicContact CZ-CD2 4.46Å
7A78.9Confident75.7Confident51 Ų51101.6 Ų101.642%0.42157%0.569SS.*G310 helixtrans-59.9-33.9-178.100000112.3N4 F9 I10N4-A7 HydrophobicContact CB-CB 3.82Å; N4-A7 VanDerWaalsContact O-CB 3.23Å; N4-A7 WeakPolarHBondContact O-CB 2.93Å; N4-A7 PolarHBondContact O-N 3.38Å; A7-F9 PolarHBondContact O-N 3.36Å; A7-I10 PolarHBondContact O-N 3.03Å
8S78.2Confident76.2Confident60 Ų60100.3 Ų100.342%0.4257%0.566SS.*G310 helixtrans-67.3-1917757.50000114F6 F92F6-S8 PolarHBondContact O-N 3.16Å; S8-F92 WeakPolarHBondContact O-CD2 3.44Å
9F81.5Confident76.7Confident24 Ų2495.9 Ų95.911%0.10554%0.544CS..G310 helixtrans-94.3-9.3178.2-57.8-68.2000113F6 A7 A11 T96 Q97 T165 H168 L169F6-F9 AromaticContact CD1-CD2 3.97Å; F6-F9 HydrophobicContact CD1-CD2 3.97Å; F6-F9 HydrophobicContact CD1-CE2 4.34Å; F6-F9 PolarHBondContact O-N 3.34Å; A7-F9 PolarHBondContact O-N 3.36Å; F9-A11 PolarHBondContact O-N 3.41Å; F9-T96 HydrophobicContact CD1-CG2 3.86Å; F9-T96 HydrophobicContact CE1-CG2 3.75Å; F9-Q97 PolarHBondContact O-NE2 3.32Å; F9-T165 HydrophobicContact CD1-CG2 4.45Å; F9-T165 HydrophobicContact CE1-CG2 4.18Å; F9-H168 HydrophobicContact CE1-CB 4.12Å; F9-H168 HydrophobicContact CZ-CB 3.85Å; F9-L169 HydrophobicContact CE2-CD1 4.4Å; F9-L169 HydrophobicContact CE2-CD2 3.72Å; F9-L169 HydrophobicContact CE2-CG 3.76Å; F9-L169 HydrophobicContact CZ-CD2 4.36Å; F9-L169 HydrophobicContact CZ-CG 3.94Å
10I84.1Confident77.1Confident121 Ų12192.1 Ų92.162%0.62153%0.525SS*.SBendtrans-70.2129.1178-59.4174.3000108.3A7 P12A7-I10 PolarHBondContact O-N 3.03Å; I10-P12 WeakPolarHBondContact O-CD 3.39Å
11A82.6Confident77.5Confident52 Ų5291.6 Ų91.643%0.4352%0.523SS..PPolyproline II helixtrans-58.1121.2179.400000110.1F9 T13 F92F9-A11 PolarHBondContact O-N 3.41Å; A11-T13 PolarHBondContact O-N 3.33Å; A11-F92 HydrophobicContact CB-CZ 4.49Å
12P82.2Confident79.5Confident38 Ų3887.2 Ų87.225%0.24750%0.503CS..PPolyproline II helixtrans-72.1125.1-174.227.1-33.4000110.2I10 A19 I23 F92I10-P12 WeakPolarHBondContact O-CD 3.39Å; P12-A19 HydrophobicContact CB-CB 4.25Å; P12-A19 HydrophobicContact CG-CB 4.34Å; P12-A19 WeakPolarHBondContact O-CB 3.06Å; P12-A19 PolarHBondContact O-N 2.86Å; P12-I23 HydrophobicContact CG-CD1 3.64Å; P12-F92 HydrophobicContact CG-CB 4.39Å; P12-F92 HydrophobicContact CG-CD1 4.16Å; P12-F92 HydrophobicContact CG-CG 4.1Å
13T86.1Confident81.4Confident98 Ų9882 Ų8260%0.60148%0.475SS*.EExtended strand (participates in β ladder)trans-116.3121.2169.958.70000109.6A11 L17A11-T13 PolarHBondContact O-N 3.33Å; T13-L17 CarbonylContact C-O 3.54Å; T13-L17 VanDerWaalsContact CA-O 3.25Å; T13-L17 WeakPolarHBondContact CA-O 3.39Å
14I86.1Confident82.8Confident111 Ų11178.7 Ų78.757%0.56946%0.461SS*.EExtended strand (participates in β ladder)trans-105.6124.1175.1-62.6172.1000106.9G16 L17 A19I14-G16 PolarHBondContact O-N 3.37Å; I14-G16 VanDerWaalsContact O-N 3.11Å; I14-L17 PolarHBondContact N-O 3.47Å; I14-L17 PolarHBondContact O-N 2.99Å; I14-A19 HydrophobicContact CD1-CB 3.9Å; I14-A19 HydrophobicContact CG1-CB 3.97Å
15L84.3Confident83.5Confident174 Ų17478.5 Ų78.591%0.91146%0.459SS*.THydrogen-bonded Turntrans54.430.4178.8-72.8149.5000113.9L17L15-L17 VanDerWaalsContact C-N 3.27Å; L15-L17 PolarHBondContact O-N 2.94Å
16G83.2Confident84.1Confident69 Ų6980.7 Ų80.771%0.71147%0.467SS*.THydrogen-bonded Turntrans80.5-2.1-17700000115.2I14I14-G16 PolarHBondContact O-N 3.37Å; I14-G16 VanDerWaalsContact O-N 3.11Å
17L83.6Confident84.5Confident127 Ų12774.4 Ų74.467%0.66544%0.44SS*.EExtended strand (participates in β ladder)trans-92.9140172.7-67.1168.6000110.9T13 I14 L15 A19T13-L17 CarbonylContact C-O 3.54Å; T13-L17 VanDerWaalsContact CA-O 3.25Å; T13-L17 WeakPolarHBondContact CA-O 3.39Å; I14-L17 PolarHBondContact N-O 3.47Å; I14-L17 PolarHBondContact O-N 2.99Å; L15-L17 VanDerWaalsContact C-N 3.27Å; L15-L17 PolarHBondContact O-N 2.94Å; L17-A19 PolarHBondContact O-N 3.36Å
18P84.8Confident84.7Confident78 Ų7875.3 Ų75.351%0.50644%0.441SS..EExtended strand (participates in β ladder)trans-71.6100.817829.2-33.4000110.6A20 V21P18-A20 PolarHBondContact O-N 3.38Å; P18-V21 HydrophobicContact CB-CG2 4.43Å; P18-V21 HydrophobicContact CG-CG2 4.18Å; P18-V21 PolarHBondContact O-N 2.97Å
19A85.4Confident85.1Confident18 Ų1878.9 Ų78.915%0.14946%0.455CS..THydrogen-bonded Turntrans-68.2-16.7176.800000112.3P12 I14 L17 V21 L22 I23P12-A19 HydrophobicContact CB-CB 4.25Å; P12-A19 HydrophobicContact CG-CB 4.34Å; P12-A19 WeakPolarHBondContact O-CB 3.06Å; P12-A19 PolarHBondContact O-N 2.86Å; I14-A19 HydrophobicContact CD1-CB 3.9Å; I14-A19 HydrophobicContact CG1-CB 3.97Å; L17-A19 PolarHBondContact O-N 3.36Å; A19-V21 PolarHBondContact O-N 3.25Å; A19-L22 PolarHBondContact O-N 3.45Å; A19-L22 VanDerWaalsContact O-N 3.1Å; A19-I23 PolarHBondContact O-N 3.02Å
20A85Confident85.4Confident19 Ų1981.2 Ų81.216%0.15747%0.468CS..Hα-helixtrans-52.9-33.8172.300000113.2P18 L22 I23 I24 F92P18-A20 PolarHBondContact O-N 3.38Å; A20-L22 VanDerWaalsContact C-N 3.35Å; A20-L22 PolarHBondContact O-N 3.27Å; A20-I23 PolarHBondContact O-N 3.14Å; A20-I24 VanDerWaalsContact O-CG1 3.27Å; A20-I24 WeakPolarHBondContact O-CG1 3.48Å; A20-I24 PolarHBondContact O-N 2.97Å; A20-F92 HydrophobicContact CB-CE1 4.34Å
21V84.9Confident85.5Confident81 Ų8178.2 Ų78.249%0.49145%0.453SS..Hα-helixtrans-64.2-41.5179.1179.90000111.2P18 A19 I23 I24 L25P18-V21 HydrophobicContact CB-CG2 4.43Å; P18-V21 HydrophobicContact CG-CG2 4.18Å; P18-V21 PolarHBondContact O-N 2.97Å; A19-V21 PolarHBondContact O-N 3.25Å; V21-I23 VanDerWaalsContact C-N 3.31Å; V21-I23 PolarHBondContact O-N 3.28Å; V21-I24 PolarHBondContact O-N 3.44Å; V21-L25 HydrophobicContact CG1-CD1 4.13Å; V21-L25 WeakPolarHBondContact O-CG 3.45Å; V21-L25 PolarHBondContact O-N 3.12Å; V21-L25 VanDerWaalsContact O-N 3.08Å
22L85.8Confident85.6Confident127 Ų12778.6 Ų78.667%0.66545%0.451SS*.Hα-helixtrans-65.7-39.3179-163.3152.9000110.7A19 A20 L25 F26A19-L22 PolarHBondContact O-N 3.45Å; A19-L22 VanDerWaalsContact O-N 3.1Å; A20-L22 VanDerWaalsContact C-N 3.35Å; A20-L22 PolarHBondContact O-N 3.27Å; L22-L25 PolarHBondContact O-N 3.42Å; L22-F26 PolarHBondContact O-N 2.96Å
23I87.3Confident85.7Confident52 Ų5281.8 Ų81.827%0.26748%0.48SS..Hα-helixtrans-65.4-41.4177-61.6162.3000111P12 A19 A20 V21 L25 F26 P27 F92P12-I23 HydrophobicContact CG-CD1 3.64Å; A19-I23 PolarHBondContact O-N 3.02Å; A20-I23 PolarHBondContact O-N 3.14Å; V21-I23 VanDerWaalsContact C-N 3.31Å; V21-I23 PolarHBondContact O-N 3.28Å; I23-L25 VanDerWaalsContact C-N 3.28Å; I23-L25 PolarHBondContact O-N 3.25Å; I23-F26 WeakPolarHBondContact O-CB 3.12Å; I23-F26 PolarHBondContact O-N 3.01Å; I23-P27 VanDerWaalsContact O-CD 3.32Å; I23-P27 WeakPolarHBondContact O-CD 3.2Å; I23-F92 HydrophobicContact CD1-CB 4.09Å; I23-F92 HydrophobicContact CD1-CD1 3.92Å; I23-F92 HydrophobicContact CD1-CG 4.39Å; I23-F92 HydrophobicContact CG2-CD1 4.46Å; I23-F92 WeakPolarHBondContact CG2-O 3.33Å
24I87.8Confident85.7Confident50 Ų5078.7 Ų78.726%0.25646%0.463SS..Hα-helixtrans-65.1-32.2176.7-69163.6000111.9A20 V21 F26 P27 F78 P94 M100A20-I24 VanDerWaalsContact O-CG1 3.27Å; A20-I24 WeakPolarHBondContact O-CG1 3.48Å; A20-I24 PolarHBondContact O-N 2.97Å; V21-I24 PolarHBondContact O-N 3.44Å; I24-F26 VanDerWaalsContact C-N 3.34Å; I24-P27 WeakPolarHBondContact O-CD 3.35Å; I24-F78 HydrophobicContact CG2-CZ 4.35Å; I24-P94 HydrophobicContact CD1-CB 4.28Å; I24-P94 HydrophobicContact CG1-CB 3.71Å; I24-P94 HydrophobicContact CG1-CG 4.07Å; I24-M100 HydrophobicContact CD1-SD 4.32Å; I24-M100 HydrophobicContact CG2-CE 4.28Å
25L86.6Confident85.6Confident118 Ų11883.5 Ų83.562%0.61848%0.479SS*.Hα-helixtrans-82.2-9.8178.7-70.9172.3000114V21 L22 I23 P28V21-L25 HydrophobicContact CG1-CD1 4.13Å; V21-L25 WeakPolarHBondContact O-CG 3.45Å; V21-L25 PolarHBondContact O-N 3.12Å; V21-L25 VanDerWaalsContact O-N 3.08Å; L22-L25 PolarHBondContact O-N 3.42Å; I23-L25 VanDerWaalsContact C-N 3.28Å; I23-L25 PolarHBondContact O-N 3.25Å; L25-P28 WeakPolarHBondContact O-CD 3.31Å
26F88Confident85.6Confident91 Ų9183.9 Ų83.940%0.39947%0.47SS..Hα-helixtrans-71.1-42.4-177.1-167.9-94000114.8L22 I23 I24 L29 L30 L85L22-F26 PolarHBondContact O-N 2.96Å; I23-F26 WeakPolarHBondContact O-CB 3.12Å; I23-F26 PolarHBondContact O-N 3.01Å; I24-F26 VanDerWaalsContact C-N 3.34Å; F26-L29 VanDerWaalsContact O-CB 3.3Å; F26-L29 WeakPolarHBondContact O-CB 3.32Å; F26-L29 PolarHBondContact O-N 3.24Å; F26-L30 HydrophobicContact CD1-CD1 4.37Å; F26-L30 HydrophobicContact CE1-CD1 4.2Å; F26-L30 HydrophobicContact CE1-CD2 4.19Å; F26-L30 HydrophobicContact CE1-CG 4.25Å; F26-L85 HydrophobicContact CD1-CD2 3.32Å; F26-L85 HydrophobicContact CE1-CD2 3.6Å
27P87.5Confident85.4Confident4 Ų489.1 Ų89.13%0.02648%0.481CS..Hα-helixtrans-57.6-41.5-178.7-15.922.8000115.3I23 I24 L29 L30 T81 T82I23-P27 VanDerWaalsContact O-CD 3.32Å; I23-P27 WeakPolarHBondContact O-CD 3.2Å; I24-P27 WeakPolarHBondContact O-CD 3.35Å; P27-L29 PolarHBondContact O-N 3.35Å; P27-L30 WeakPolarHBondContact O-CB 3.45Å; P27-L30 PolarHBondContact O-N 3.28Å; P27-L30 VanDerWaalsContact O-N 3.08Å; P27-T81 WeakPolarHBondContact CB-OG1 3.41Å; P27-T82 HydrophobicContact CB-CG2 4.3Å; P27-T82 HydrophobicContact CG-CG2 3.53Å
28P83.7Confident85.5Confident70 Ų7090.5 Ų90.546%0.45549%0.487SS..Hα-helixtrans-55.9-31.8173.5-27.634000114.3L25 L30 I31L25-P28 WeakPolarHBondContact O-CD 3.31Å; P28-L30 PolarHBondContact O-N 3.03Å; P28-I31 PolarHBondContact O-N 2.75Å
29L87.2Confident85.7Confident134 Ų13488.1 Ų88.170%0.70247%0.47SS*.Hα-helixtrans-67.9-24.9179.6-172.464.7000112.5F26 P27 I31F26-L29 VanDerWaalsContact O-CB 3.3Å; F26-L29 WeakPolarHBondContact O-CB 3.32Å; F26-L29 PolarHBondContact O-N 3.24Å; P27-L29 PolarHBondContact O-N 3.35Å; L29-I31 PolarHBondContact O-N 2.95Å
30L86.7Confident85.9Confident73 Ų7392.8 Ų92.838%0.38249%0.493SS..THydrogen-bonded Turntrans-75.1-8.1179.2-64.6169.8000113.6F26 P27 P28 P32 Q46 L85F26-L30 HydrophobicContact CD1-CD1 4.37Å; F26-L30 HydrophobicContact CE1-CD1 4.2Å; F26-L30 HydrophobicContact CE1-CD2 4.19Å; F26-L30 HydrophobicContact CE1-CG 4.25Å; P27-L30 WeakPolarHBondContact O-CB 3.45Å; P27-L30 PolarHBondContact O-N 3.28Å; P27-L30 VanDerWaalsContact O-N 3.08Å; P28-L30 PolarHBondContact O-N 3.03Å; L30-P32 WeakPolarHBondContact O-CD 3.21Å; L30-Q46 PolarHBondContact O-NE2 2.84Å; L30-L85 HydrophobicContact CD1-CD1 3.34Å; L30-L85 HydrophobicContact CD1-CD2 3.94Å; L30-L85 HydrophobicContact CD1-CG 4.19Å
31I86.8Confident86.1Confident59 Ų59101.9 Ų101.930%0.30352%0.523SS..SBendtrans-111.979.1-178.4-54.4155000108P28 L29 A33 I77P28-I31 PolarHBondContact O-N 2.75Å; L29-I31 PolarHBondContact O-N 2.95Å; I31-A33 PolarHBondContact O-N 3.43Å; I31-I77 HydrophobicContact CD1-CG2 3.3Å; I31-I77 HydrophobicContact CG1-CG2 4.37Å
32P84.8Confident86.3Confident60 Ų60102.1 Ų102.139%0.3952%0.521SS..  trans-67.3133.9178.926.4-32.7000110.7L30 L42 I43L30-P32 WeakPolarHBondContact O-CD 3.21Å; P32-L42 HydrophobicContact CG-CD2 3.85Å; P32-I43 HydrophobicContact CB-CD1 4.43Å; P32-I43 HydrophobicContact CG-CD1 4.28Å; P32-I43 HydrophobicContact CG-CG1 3.95Å
33A83.9Confident86.5Confident104 Ų10497 Ų9786%0.8649%0.494SS*.  trans-94.2129.7168.700000109.9I31I31-A33 PolarHBondContact O-N 3.43Å
34S85.5Confident86.7Confident34 Ų3497.5 Ų97.524%0.23850%0.5CS..  trans-111.9148.3170.957.50000111.2N39S34-N39 WeakPolarHBondContact CB-OD1 3.34Å; S34-N39 PolarHBondContact OG-ND2 3.38Å; S34-N39 PolarHBondContact OG-OD1 3.29Å
35K84.1Confident86.9Confident211 Ų21199.2 Ų99.292%0.91751%0.512SS*.  trans-89.4-10.8177.3-62.4-179.5-179178.20113.2
36Y85.8Confident87.1Confident183 Ų18395.8 Ų95.872%0.71849%0.493SS*.SBendtrans-82.4153-174.5-60.3-71.8000111.7N39Y36-N39 PolarHBondContact O-ND2 3.5Å; Y36-N39 PolarHBondContact O-OD1 3.29Å
37L78.3Confident87.1Confident179 Ų17995.9 Ų95.994%0.93750%0.495SS*.SBendtrans-72.5-39.2176.3-171.373.1000111.4
38I85.6Confident87.4Confident156 Ų156103.8 Ų103.880%0.852%0.524SS*.SBendtrans-102.4115.8174.8-58.7170.2000107.3
39N88.8Confident87.7Confident28 Ų28105 Ų10515%0.1553%0.527CS..  trans-109.6168.9-172.4-68.5-31.7000112.5S34 Y36 I43 T44 Q47S34-N39 WeakPolarHBondContact CB-OD1 3.34Å; S34-N39 PolarHBondContact OG-ND2 3.38Å; S34-N39 PolarHBondContact OG-OD1 3.29Å; Y36-N39 PolarHBondContact O-ND2 3.5Å; Y36-N39 PolarHBondContact O-OD1 3.29Å; N39-I43 HydrophobicContact CB-CB 3.95Å; N39-I43 HydrophobicContact CB-CG2 3.82Å; N39-T44 HydrophobicContact CB-CG2 4.02Å; N39-Q47 PolarHBondContact ND2-NE2 3.42Å; N39-Q47 PolarHBondContact ND2-OE1 3.47Å
40N89.1Confident87.9Confident115 Ų115101.2 Ų101.262%0.61551%0.506SS*.  trans-63.6152.3171.2-1672000110.8L42 I43 T44N40-L42 PolarHBondContact O-N 3.3Å; N40-L42 VanDerWaalsContact O-N 3.13Å; N40-I43 HydrophobicContact CB-CD1 4.47Å; N40-I43 PolarHBondContact O-N 3.19Å; N40-T44 PolarHBondContact O-N 3.06Å
41R89.3Confident88.1Confident211 Ų211105.1 Ų105.180%0.79652%0.52SS*.Hα-helixtrans-51.9-37.8-178.7-64.4-177.5-178.8-179.40.5113T44 T45R41-T44 WeakPolarHBondContact CA-OG1 3.42Å; R41-T44 PolarHBondContact O-N 3.13Å; R41-T44 PolarHBondContact O-OG1 3.45Å; R41-T45 WeakPolarHBondContact O-CG2 3.46Å; R41-T45 PolarHBondContact O-N 3.4Å; R41-T45 VanDerWaalsContact O-N 3.08Å; R41-T45 PolarHBondContact O-OG1 3.12Å
42L89.7Confident88.3Confident86 Ų86105.4 Ų105.445%0.4552%0.522SS..Hα-helixtrans-66.2-41.6177.7-177.1150.8000111.9P32 N40 T45 Q46P32-L42 HydrophobicContact CG-CD2 3.85Å; N40-L42 PolarHBondContact O-N 3.3Å; N40-L42 VanDerWaalsContact O-N 3.13Å; L42-T45 PolarHBondContact O-OG1 3.03Å; L42-Q46 VanDerWaalsContact CD2-CD 3.47Å; L42-Q46 HydrophobicContact CD2-CG 4.33Å; L42-Q46 WeakPolarHBondContact O-CB 3.3Å; L42-Q46 VanDerWaalsContact O-CG 3.25Å; L42-Q46 WeakPolarHBondContact O-CG 3.29Å; L42-Q46 PolarHBondContact O-N 2.9Å
43I91.1Very high88.4Confident19 Ų19103.7 Ų103.710%0.09751%0.511CS..Hα-helixtrans-71.1-37.2179.6-62.1173.4000110P32 N39 N40 Q46 Q47P32-I43 HydrophobicContact CB-CD1 4.43Å; P32-I43 HydrophobicContact CG-CD1 4.28Å; P32-I43 HydrophobicContact CG-CG1 3.95Å; N39-I43 HydrophobicContact CB-CB 3.95Å; N39-I43 HydrophobicContact CB-CG2 3.82Å; N40-I43 HydrophobicContact CB-CD1 4.47Å; N40-I43 PolarHBondContact O-N 3.19Å; I43-Q46 PolarHBondContact O-N 3.11Å; I43-Q47 HydrophobicContact CG2-CG 4.21Å; I43-Q47 WeakPolarHBondContact O-CB 3.49Å; I43-Q47 VanDerWaalsContact O-CG 3.23Å; I43-Q47 WeakPolarHBondContact O-CG 3.42Å; I43-Q47 PolarHBondContact O-N 3.46Å
44T91.2Very high88.7Confident63 Ų63100.2 Ų100.239%0.38748%0.48SS..Hα-helixtrans-67.4-39.9177.959.80000112.2N39 N40 R41 W48N39-T44 HydrophobicContact CB-CG2 4.02Å; N40-T44 PolarHBondContact O-N 3.06Å; R41-T44 WeakPolarHBondContact CA-OG1 3.42Å; R41-T44 PolarHBondContact O-N 3.13Å; R41-T44 PolarHBondContact O-OG1 3.45Å; T44-W48 VanDerWaalsContact O-CB 3.3Å; T44-W48 WeakPolarHBondContact O-CB 3.29Å; T44-W48 PolarHBondContact O-N 2.87Å
45T90.9Very high88.8Confident85 Ų85105.8 Ų105.852%0.52150%0.5SS..Hα-helixtrans-67.5-40.1174.756.70000111.8R41 L42 W48 L49R41-T45 WeakPolarHBondContact O-CG2 3.46Å; R41-T45 PolarHBondContact O-N 3.4Å; R41-T45 VanDerWaalsContact O-N 3.08Å; R41-T45 PolarHBondContact O-OG1 3.12Å; L42-T45 PolarHBondContact O-OG1 3.03Å; T45-W48 PolarHBondContact O-N 3.34Å; T45-L49 WeakPolarHBondContact O-CB 3.4Å; T45-L49 PolarHBondContact O-N 2.99Å
46Q90.4Very high88.9Confident46 Ų46101.7 Ų101.722%0.21548%0.484CS..Hα-helixtrans-61.2-49.8173.6-75.5177.5-14.900111.7L30 L42 I43 W48 L49 I50L30-Q46 PolarHBondContact O-NE2 2.84Å; L42-Q46 VanDerWaalsContact CD2-CD 3.47Å; L42-Q46 HydrophobicContact CD2-CG 4.33Å; L42-Q46 WeakPolarHBondContact O-CB 3.3Å; L42-Q46 VanDerWaalsContact O-CG 3.25Å; L42-Q46 WeakPolarHBondContact O-CG 3.29Å; L42-Q46 PolarHBondContact O-N 2.9Å; I43-Q46 PolarHBondContact O-N 3.11Å; Q46-W48 VanDerWaalsContact C-N 3.29Å; Q46-W48 PolarHBondContact O-N 3.3Å; Q46-L49 PolarHBondContact O-N 2.83Å; Q46-I50 VanDerWaalsContact O-CG1 3.23Å; Q46-I50 WeakPolarHBondContact O-CG1 3.2Å; Q46-I50 PolarHBondContact O-N 3.42Å
47Q89.8Confident88.9Confident94 Ų9493.7 Ų93.744%0.43945%0.453SS..Hα-helixtrans-60.3-39.1177.5-75.2174.2-1100112.1N39 I43 K51N39-Q47 PolarHBondContact ND2-NE2 3.42Å; N39-Q47 PolarHBondContact ND2-OE1 3.47Å; I43-Q47 HydrophobicContact CG2-CG 4.21Å; I43-Q47 WeakPolarHBondContact O-CB 3.49Å; I43-Q47 VanDerWaalsContact O-CG 3.23Å; I43-Q47 WeakPolarHBondContact O-CG 3.42Å; I43-Q47 PolarHBondContact O-N 3.46Å; Q47-K51 WeakPolarHBondContact O-CB 3.48Å; Q47-K51 PolarHBondContact O-N 3Å
48W92Very high89.2Confident169 Ų16986 Ų8664%0.6441%0.413SS*.Hα-helixtrans-63.3-44.5175.2179.682.7000112T44 T45 Q46 K51 L52T44-W48 VanDerWaalsContact O-CB 3.3Å; T44-W48 WeakPolarHBondContact O-CB 3.29Å; T44-W48 PolarHBondContact O-N 2.87Å; T45-W48 PolarHBondContact O-N 3.34Å; Q46-W48 VanDerWaalsContact C-N 3.29Å; Q46-W48 PolarHBondContact O-N 3.3Å; W48-K51 PolarHBondContact O-N 3.16Å; W48-L52 HydrophobicContact CD2-CD1 3.75Å; W48-L52 HydrophobicContact CD2-CG 4.4Å; W48-L52 VanDerWaalsContact CE2-CD1 3.48Å; W48-L52 HydrophobicContact CE3-CD1 3.8Å; W48-L52 HydrophobicContact CH2-CD1 3.41Å; W48-L52 VanDerWaalsContact CH2-CD1 3.41Å; W48-L52 HydrophobicContact CZ2-CD1 3.35Å; W48-L52 HydrophobicContact CZ2-CG 4.42Å; W48-L52 HydrophobicContact CZ3-CD1 3.63Å; W48-L52 WeakPolarHBondContact O-CG 3Å; W48-L52 PolarHBondContact O-N 3.13Å
49L90.7Very high89.1Confident96 Ų9683.4 Ų83.450%0.50340%0.404SS..Hα-helixtrans-65.5-41.1178.2-166.7144000112.1T45 Q46 K51 L52 T53T45-L49 WeakPolarHBondContact O-CB 3.4Å; T45-L49 PolarHBondContact O-N 2.99Å; Q46-L49 PolarHBondContact O-N 2.83Å; L49-K51 VanDerWaalsContact C-N 3.33Å; L49-K51 PolarHBondContact O-N 3.12Å; L49-L52 PolarHBondContact O-N 3.15Å; L49-T53 HydrophobicContact CD2-CG2 4.18Å; L49-T53 WeakPolarHBondContact O-CG2 3.18Å; L49-T53 PolarHBondContact O-N 3.48Å; L49-T53 PolarHBondContact O-OG1 3.21Å
50I91.2Very high88.5Confident54 Ų5488.7 Ų88.728%0.27743%0.43SS..Hα-helixtrans-62.2-41.3174.3-65.8170.5000110.9Q46 T53 S54 V73 I77Q46-I50 VanDerWaalsContact O-CG1 3.23Å; Q46-I50 WeakPolarHBondContact O-CG1 3.2Å; Q46-I50 PolarHBondContact O-N 3.42Å; I50-T53 WeakPolarHBondContact CA-OG1 3.32Å; I50-T53 PolarHBondContact O-OG1 2.77Å; I50-T53 VanDerWaalsContact O-OG1 3.04Å; I50-S54 VanDerWaalsContact O-CB 3.28Å; I50-S54 WeakPolarHBondContact O-CB 3.38Å; I50-S54 PolarHBondContact O-N 3.34Å; I50-S54 PolarHBondContact O-OG 3.38Å; I50-V73 HydrophobicContact CG2-CG1 3.85Å; I50-I77 HydrophobicContact CD1-CD1 4Å; I50-I77 HydrophobicContact CG1-CD1 3.7Å
51K90.8Very high88.1Confident155 Ų15583.5 Ų83.567%0.67440%0.402SS*.Hα-helixtrans-66.4-39.4178.1-172.5176.3-178.6178.20112.2Q47 W48 L49 S54 K55Q47-K51 WeakPolarHBondContact O-CB 3.48Å; Q47-K51 PolarHBondContact O-N 3Å; W48-K51 PolarHBondContact O-N 3.16Å; L49-K51 VanDerWaalsContact C-N 3.33Å; L49-K51 PolarHBondContact O-N 3.12Å; K51-S54 WeakPolarHBondContact CA-OG 3.42Å; K51-S54 PolarHBondContact O-OG 2.97Å; K51-S54 VanDerWaalsContact O-OG 3.07Å; K51-K55 VanDerWaalsContact O-CB 3.23Å; K51-K55 WeakPolarHBondContact O-CB 3.25Å; K51-K55 PolarHBondContact O-N 3.4Å
52L90.9Very high87.5Confident66 Ų6678.7 Ų78.735%0.34639%0.392SS..Hα-helixtrans-67-50.4177.1-75.1177.7000112.3W48 L49 K55 Q56W48-L52 HydrophobicContact CD2-CD1 3.75Å; W48-L52 HydrophobicContact CD2-CG 4.4Å; W48-L52 VanDerWaalsContact CE2-CD1 3.48Å; W48-L52 HydrophobicContact CE3-CD1 3.8Å; W48-L52 HydrophobicContact CH2-CD1 3.41Å; W48-L52 VanDerWaalsContact CH2-CD1 3.41Å; W48-L52 HydrophobicContact CZ2-CD1 3.35Å; W48-L52 HydrophobicContact CZ2-CG 4.42Å; W48-L52 HydrophobicContact CZ3-CD1 3.63Å; W48-L52 WeakPolarHBondContact O-CG 3Å; W48-L52 PolarHBondContact O-N 3.13Å; L49-L52 PolarHBondContact O-N 3.15Å; L52-K55 PolarHBondContact O-N 2.74Å; L52-Q56 WeakPolarHBondContact O-CG 3.44Å; L52-Q56 PolarHBondContact O-N 3.13Å
53T88.1Confident87Confident24 Ų2480 Ų8015%0.14740%0.404CS..Hα-helixtrans-61.3-46.8-179.348.70000111.5L49 I50 K55 Q56 M57L49-T53 HydrophobicContact CD2-CG2 4.18Å; L49-T53 WeakPolarHBondContact O-CG2 3.18Å; L49-T53 PolarHBondContact O-N 3.48Å; L49-T53 PolarHBondContact O-OG1 3.21Å; I50-T53 WeakPolarHBondContact CA-OG1 3.32Å; I50-T53 PolarHBondContact O-OG1 2.77Å; I50-T53 VanDerWaalsContact O-OG1 3.04Å; T53-K55 PolarHBondContact O-N 3.13Å; T53-Q56 PolarHBondContact O-N 2.8Å; T53-M57 WeakPolarHBondContact O-CG 3.39Å; T53-M57 PolarHBondContact O-N 3.27Å
54S88.8Confident86.4Confident30 Ų3085.3 Ų85.321%0.2143%0.426CS..Hα-helixtrans-61.6-42.2175.658.10000112.4I50 K51 Q56 M58I50-S54 VanDerWaalsContact O-CB 3.28Å; I50-S54 WeakPolarHBondContact O-CB 3.38Å; I50-S54 PolarHBondContact O-N 3.34Å; I50-S54 PolarHBondContact O-OG 3.38Å; K51-S54 WeakPolarHBondContact CA-OG 3.42Å; K51-S54 PolarHBondContact O-OG 2.97Å; K51-S54 VanDerWaalsContact O-OG 3.07Å; S54-Q56 PolarHBondContact O-N 2.96Å; S54-M58 VanDerWaalsContact O-CB 3.29Å; S54-M58 WeakPolarHBondContact O-CB 3.33Å; S54-M58 VanDerWaalsContact O-CG 3.22Å; S54-M58 WeakPolarHBondContact O-CG 3.4Å; S54-M58 PolarHBondContact O-N 3.35Å
55K89.1Confident85.7Confident152 Ų15282.3 Ų82.366%0.66141%0.408SS*.Hα-helixtrans-61-47.1176.9-175179.1178.5-175.60111.2K51 L52 T53 T59K51-K55 VanDerWaalsContact O-CB 3.23Å; K51-K55 WeakPolarHBondContact O-CB 3.25Å; K51-K55 PolarHBondContact O-N 3.4Å; L52-K55 PolarHBondContact O-N 2.74Å; T53-K55 PolarHBondContact O-N 3.13Å; K55-T59 WeakPolarHBondContact O-CG2 3.31Å; K55-T59 PolarHBondContact O-N 3.11Å
56Q86.3Confident85.3Confident125 Ų12584.8 Ų84.858%0.58441%0.408SS*.Hα-helixtrans-67-40.6-178.5-74.2179.9-26.300112.7L52 T53 S54 T59L52-Q56 WeakPolarHBondContact O-CG 3.44Å; L52-Q56 PolarHBondContact O-N 3.13Å; T53-Q56 PolarHBondContact O-N 2.8Å; S54-Q56 PolarHBondContact O-N 2.96Å; Q56-T59 PolarHBondContact O-OG1 2.93Å
57M84Confident85.1Confident14 Ų1487.5 Ų87.57%0.06943%0.427CS..Hα-helixtrans-72.4-36179.5-69.8-165.4148.100112.7T53 H61 I76 Y212 T215T53-M57 WeakPolarHBondContact O-CG 3.39Å; T53-M57 PolarHBondContact O-N 3.27Å; M57-H61 PolarHBondContact O-ND1 3.27Å; M57-I76 HydrophobicContact CE-CD1 4.17Å; M57-Y212 HydrophobicContact CE-CD2 4.45Å; M57-Y212 HydrophobicContact CE-CE2 4.49Å; M57-T215 WeakPolarHBondContact CE-OG1 3.43Å
58M84.5Confident84.9Confident19 Ų1985.6 Ų85.69%0.09442%0.416CS..Hα-helixtrans-83.2-8.5-175.8-63.3-49.2125.200114.5S54 M60 H61 R66 S69 L72S54-M58 VanDerWaalsContact O-CB 3.29Å; S54-M58 WeakPolarHBondContact O-CB 3.33Å; S54-M58 VanDerWaalsContact O-CG 3.22Å; S54-M58 WeakPolarHBondContact O-CG 3.4Å; S54-M58 PolarHBondContact O-N 3.35Å; M58-M60 PolarHBondContact O-N 3.16Å; M58-H61 PolarHBondContact O-N 3.21Å; M58-R66 HydrophobicContact SD-CG 4.38Å; M58-S69 VanDerWaalsContact SD-CB 3.57Å; M58-L72 HydrophobicContact CE-CB 4.46Å; M58-L72 HydrophobicContact CE-CD1 3.9Å
59T83.6Confident84.7Confident100 Ų10078.9 Ų78.961%0.61340%0.395SS*.THydrogen-bonded Turntrans-62.9-32172.354.30000112K55 Q56 H61K55-T59 WeakPolarHBondContact O-CG2 3.31Å; K55-T59 PolarHBondContact O-N 3.11Å; Q56-T59 PolarHBondContact O-OG1 2.93Å; T59-H61 VanDerWaalsContact C-N 3.34Å
60M76.4Confident84.7Confident140 Ų14081.5 Ų81.569%0.6941%0.409SS*.THydrogen-bonded Turntrans-83.6-7.4-177.1-51.1-139.186.500113.4M58 H223M58-M60 PolarHBondContact O-N 3.16Å; M60-H223 PolarHBondContact O-CE1 3.43Å; M60-H223 PolarHBondContact O-ND1 2.97Å
61H80.5Confident84.7Confident6 Ų681.4 Ų81.43%0.02841%0.408CS..  trans-110.9139.3-169.9-7179.1000113.8M57 M58 T59 R66 S219M57-H61 PolarHBondContact O-ND1 3.27Å; M58-H61 PolarHBondContact O-N 3.21Å; T59-H61 VanDerWaalsContact C-N 3.34Å; H61-R66 HydrophobicContact CB-CG 4.43Å; H61-R66 PolarHBondContact O-NE 3.11Å; H61-S219 PolarHBondContact NE2-O 3.07Å
62N78.1Confident84.6Confident109 Ų10974 Ų7458%0.58338%0.376SS*.  trans-70.6169.9168.2-84.6-20.8000112.3K64 G65 R66N62-K64 VanDerWaalsContact C-N 3.26Å; N62-K64 PolarHBondContact O-N 2.98Å; N62-K64 VanDerWaalsContact O-N 3.16Å; N62-G65 PolarHBondContact O-N 3.41Å; N62-R66 PolarHBondContact O-N 2.92Å
63T78.9Confident84.6Confident115 Ų11571.7 Ų71.771%0.70636%0.364SS*.THydrogen-bonded Turntrans-53.8-37.2-175.753.30000114
64K77.8Confident84.8Confident129 Ų12973.7 Ų73.756%0.56138%0.379SS*.THydrogen-bonded Turntrans-67.8-44.7174.4-69.2-176.4-178.3177.20112.2N62 R66 T67N62-K64 VanDerWaalsContact C-N 3.26Å; N62-K64 PolarHBondContact O-N 2.98Å; N62-K64 VanDerWaalsContact O-N 3.16Å; K64-R66 VanDerWaalsContact C-N 3.28Å; K64-R66 PolarHBondContact O-N 3.03Å; K64-T67 WeakPolarHBondContact O-CB 3.27Å; K64-T67 PolarHBondContact O-N 3.33Å; K64-T67 PolarHBondContact O-OG1 3.35Å
65G77.2Confident84.9Confident0 Ų073 Ų730%037%0.373CS..G310 helixtrans-64.1-31.1177.400000113.1N62 T67 W68N62-G65 PolarHBondContact O-N 3.41Å; G65-T67 PolarHBondContact O-N 3.24Å; G65-T67 VanDerWaalsContact O-N 3.14Å; G65-W68 WeakPolarHBondContact O-CB 3.32Å; G65-W68 PolarHBondContact O-N 3.1Å
66R82.6Confident85Confident138 Ų13866.6 Ų66.652%0.52135%0.346SS..G310 helixtrans-62.3-20.5176.1-71.1-179.3-175.9-176.20.4114.2M58 H61 N62 K64 W68 S69M58-R66 HydrophobicContact SD-CG 4.38Å; H61-R66 HydrophobicContact CB-CG 4.43Å; H61-R66 PolarHBondContact O-NE 3.11Å; N62-R66 PolarHBondContact O-N 2.92Å; K64-R66 VanDerWaalsContact C-N 3.28Å; K64-R66 PolarHBondContact O-N 3.03Å; R66-W68 PolarHBondContact O-N 3.38Å; R66-S69 WeakPolarHBondContact O-CB 3.44Å; R66-S69 PolarHBondContact O-N 2.94Å; R66-S69 VanDerWaalsContact O-N 3.1Å
67T85.7Confident85.2Confident102 Ų10262.1 Ų62.163%0.62633%0.326SS*.G310 helixtrans-63.6-26.2174.561.70000112.5K64 G65 S69K64-T67 WeakPolarHBondContact O-CB 3.27Å; K64-T67 PolarHBondContact O-N 3.33Å; K64-T67 PolarHBondContact O-OG1 3.35Å; G65-T67 PolarHBondContact O-N 3.24Å; G65-T67 VanDerWaalsContact O-N 3.14Å; T67-S69 VanDerWaalsContact C-N 3.28Å; T67-S69 PolarHBondContact O-N 3.47Å
68W86.1Confident85.5Confident54 Ų5463.8 Ų63.821%0.20533%0.332CS..G310 helixtrans-84.91.1177-73.662.6000113.6G65 R66 L70 M71 L72 M115 L222G65-W68 WeakPolarHBondContact O-CB 3.32Å; G65-W68 PolarHBondContact O-N 3.1Å; R66-W68 PolarHBondContact O-N 3.38Å; W68-L70 VanDerWaalsContact C-N 3.31Å; W68-L70 PolarHBondContact O-N 3.09Å; W68-M71 HydrophobicContact CD2-CE 4.32Å; W68-M71 HydrophobicContact CE3-CE 3.13Å; W68-M71 HydrophobicContact CE3-SD 3.56Å; W68-M71 VanDerWaalsContact CE3-SD 3.56Å; W68-M71 HydrophobicContact CH2-SD 4.37Å; W68-M71 HydrophobicContact CZ3-CE 3.35Å; W68-M71 HydrophobicContact CZ3-SD 3.43Å; W68-M71 WeakPolarHBondContact CZ3-SD 3.41Å; W68-M71 PolarHBondContact O-N 3.36Å; W68-M71 VanDerWaalsContact O-N 3.09Å; W68-L72 PolarHBondContact O-N 3.06Å; W68-M115 HydrophobicContact CZ2-SD 4Å; W68-M115 PolarHBondContact NE1-SD 3.37Å; W68-L222 HydrophobicContact CB-CD2 3.47Å; W68-L222 VanDerWaalsContact CB-CD2 3.47Å; W68-L222 HydrophobicContact CD2-CD1 3.83Å; W68-L222 HydrophobicContact CD2-CD2 4.18Å; W68-L222 HydrophobicContact CE3-CD1 4.14Å; W68-L222 HydrophobicContact CG-CD1 3.99Å; W68-L222 HydrophobicContact CG-CD2 3.63Å; W68-L222 HydrophobicContact CG-CG 4.49Å
69S87.2Confident85.8Confident29 Ų2962.9 Ų62.920%0.20333%0.328CS..Hα-helixtrans-55-45.5-177.4179.20000112.5M58 R66 T67 M71 L72 V73M58-S69 VanDerWaalsContact SD-CB 3.57Å; R66-S69 WeakPolarHBondContact O-CB 3.44Å; R66-S69 PolarHBondContact O-N 2.94Å; R66-S69 VanDerWaalsContact O-N 3.1Å; T67-S69 VanDerWaalsContact C-N 3.28Å; T67-S69 PolarHBondContact O-N 3.47Å; S69-M71 VanDerWaalsContact C-N 3.29Å; S69-M71 PolarHBondContact O-N 3.38Å; S69-L72 PolarHBondContact O-N 3.46Å; S69-V73 WeakPolarHBondContact O-CB 3.34Å; S69-V73 VanDerWaalsContact O-CG2 3.23Å; S69-V73 WeakPolarHBondContact O-CG2 3.42Å; S69-V73 PolarHBondContact O-N 3.19Å
70L90.5Very high86.1Confident150 Ų15059.5 Ų59.579%0.78531%0.31SS*.Hα-helixtrans-57.2-45.5179-171.189000111.3W68 S74W68-L70 VanDerWaalsContact C-N 3.31Å; W68-L70 PolarHBondContact O-N 3.09Å; L70-S74 WeakPolarHBondContact O-CB 3.25Å; L70-S74 PolarHBondContact O-N 3.34Å; L70-S74 PolarHBondContact O-OG 2.65Å
71M90.7Very high86.8Confident52 Ų5254.2 Ų54.226%0.25629%0.286SS..Hα-helixtrans-66.4-47.7-177.3-168-161.374.800111W68 S69 V73 S74 L75 L108W68-M71 HydrophobicContact CD2-CE 4.32Å; W68-M71 HydrophobicContact CE3-CE 3.13Å; W68-M71 HydrophobicContact CE3-SD 3.56Å; W68-M71 VanDerWaalsContact CE3-SD 3.56Å; W68-M71 HydrophobicContact CH2-SD 4.37Å; W68-M71 HydrophobicContact CZ3-CE 3.35Å; W68-M71 HydrophobicContact CZ3-SD 3.43Å; W68-M71 WeakPolarHBondContact CZ3-SD 3.41Å; W68-M71 PolarHBondContact O-N 3.36Å; W68-M71 VanDerWaalsContact O-N 3.09Å; S69-M71 VanDerWaalsContact C-N 3.29Å; S69-M71 PolarHBondContact O-N 3.38Å; M71-V73 VanDerWaalsContact C-N 3.34Å; M71-V73 PolarHBondContact O-N 3.49Å; M71-S74 PolarHBondContact O-N 3.3Å; M71-S74 PolarHBondContact O-OG 3.14Å; M71-L75 VanDerWaalsContact O-CB 3.29Å; M71-L75 WeakPolarHBondContact O-CB 3.36Å; M71-L75 PolarHBondContact O-N 3.22Å; M71-L108 HydrophobicContact CE-CD2 3.24Å; M71-L108 HydrophobicContact CG-CD2 4.26Å; M71-L108 HydrophobicContact SD-CD2 3.41Å; M71-L108 WeakPolarHBondContact SD-CD2 3.31Å
72L90.2Very high87.3Confident1 Ų154.1 Ų54.11%0.00529%0.286CS..Hα-helixtrans-61.5-41.3178.3-70.8170.6000112.4M58 W68 S69 L75 I76 V218M58-L72 HydrophobicContact CE-CB 4.46Å; M58-L72 HydrophobicContact CE-CD1 3.9Å; W68-L72 PolarHBondContact O-N 3.06Å; S69-L72 PolarHBondContact O-N 3.46Å; L72-L75 WeakPolarHBondContact O-CB 3.41Å; L72-L75 PolarHBondContact O-N 3.44Å; L72-I76 PolarHBondContact O-N 2.88Å; L72-I76 VanDerWaalsContact O-N 3.08Å; L72-V218 HydrophobicContact CD2-CB 4.21Å; L72-V218 HydrophobicContact CD2-CG1 3.85Å
73V91.2Very high87.9Confident16 Ų1649 Ų4910%0.09726%0.259CS..Hα-helixtrans-67.8-41.9177.2172.80000111.1I50 S69 M71 L75 I76 I77I50-V73 HydrophobicContact CG2-CG1 3.85Å; S69-V73 WeakPolarHBondContact O-CB 3.34Å; S69-V73 VanDerWaalsContact O-CG2 3.23Å; S69-V73 WeakPolarHBondContact O-CG2 3.42Å; S69-V73 PolarHBondContact O-N 3.19Å; M71-V73 VanDerWaalsContact C-N 3.34Å; M71-V73 PolarHBondContact O-N 3.49Å; V73-L75 VanDerWaalsContact C-N 3.28Å; V73-L75 PolarHBondContact O-N 2.92Å; V73-I76 VanDerWaalsContact O-CG2 3.29Å; V73-I76 WeakPolarHBondContact O-CG2 3.48Å; V73-I77 HydrophobicContact CG1-CD1 3.75Å; V73-I77 VanDerWaalsContact O-CD1 3.28Å; V73-I77 WeakPolarHBondContact O-CD1 3.4Å; V73-I77 WeakPolarHBondContact O-CG1 3.3Å; V73-I77 PolarHBondContact O-N 2.99Å
74S91.1Very high88.4Confident66 Ų6648 Ų4846%0.46225%0.248SC..Hα-helixtrans-63.2-37.8175.970.60000112.2L70 M71 F78L70-S74 WeakPolarHBondContact O-CB 3.25Å; L70-S74 PolarHBondContact O-N 3.34Å; L70-S74 PolarHBondContact O-OG 2.65Å; M71-S74 PolarHBondContact O-N 3.3Å; M71-S74 PolarHBondContact O-OG 3.14Å; S74-F78 VanDerWaalsContact O-CB 3.27Å; S74-F78 WeakPolarHBondContact O-CB 3.18Å; S74-F78 PolarHBondContact O-N 2.95Å
75L90.4Very high88.9Confident16 Ų1643.9 Ų43.98%0.08423%0.232CC..Hα-helixtrans-66.5-47.9-179.1-176.375.7000111.9M71 L72 V73 I77 F78 I79 L108 F214 T215M71-L75 VanDerWaalsContact O-CB 3.29Å; M71-L75 WeakPolarHBondContact O-CB 3.36Å; M71-L75 PolarHBondContact O-N 3.22Å; L72-L75 WeakPolarHBondContact O-CB 3.41Å; L72-L75 PolarHBondContact O-N 3.44Å; V73-L75 VanDerWaalsContact C-N 3.28Å; V73-L75 PolarHBondContact O-N 2.92Å; L75-I77 VanDerWaalsContact C-N 3.32Å; L75-I77 PolarHBondContact O-N 3.37Å; L75-F78 PolarHBondContact O-N 3.24Å; L75-I79 HydrophobicContact CD1-CD1 4.01Å; L75-I79 HydrophobicContact CG-CD1 3.93Å; L75-I79 WeakPolarHBondContact O-CG1 3.3Å; L75-I79 PolarHBondContact O-N 3.14Å; L75-L108 HydrophobicContact CD1-CD1 3.51Å; L75-L108 HydrophobicContact CD2-CD1 3.77Å; L75-L108 HydrophobicContact CG-CD1 4.29Å; L75-F214 HydrophobicContact CD1-CE1 4.04Å; L75-F214 HydrophobicContact CD2-CD1 3.89Å; L75-F214 HydrophobicContact CD2-CE1 3.79Å; L75-F214 HydrophobicContact CG-CD1 4.28Å; L75-F214 HydrophobicContact CG-CE1 4.17Å; L75-T215 HydrophobicContact CB-CG2 4.06Å; L75-T215 HydrophobicContact CD2-CG2 3.54Å; L75-T215 HydrophobicContact CG-CG2 3.72Å
76I91.1Very high89.3Confident17 Ų1743.9 Ų43.99%0.08723%0.232CC..Hα-helixtrans-64.2-41.1-179.6-168.4171000111M57 L72 V73 A80 A211 Y212 T215M57-I76 HydrophobicContact CE-CD1 4.17Å; L72-I76 PolarHBondContact O-N 2.88Å; L72-I76 VanDerWaalsContact O-N 3.08Å; V73-I76 VanDerWaalsContact O-CG2 3.29Å; V73-I76 WeakPolarHBondContact O-CG2 3.48Å; I76-A80 WeakPolarHBondContact O-CB 3.43Å; I76-A80 PolarHBondContact O-N 2.99Å; I76-A211 HydrophobicContact CG1-CB 4.42Å; I76-Y212 HydrophobicContact CD1-CD2 4.23Å; I76-T215 VanDerWaalsContact CA-CG2 3.49Å; I76-T215 HydrophobicContact CB-CG2 3.51Å; I76-T215 HydrophobicContact CG1-CG2 4.15Å
77I91.1Very high89.5Confident32 Ų3239.2 Ų39.216%0.16422%0.218CC..Hα-helixtrans-66.7-43.1179-63.6165000110.3I31 I50 V73 L75 T81I31-I77 HydrophobicContact CD1-CG2 3.3Å; I31-I77 HydrophobicContact CG1-CG2 4.37Å; I50-I77 HydrophobicContact CD1-CD1 4Å; I50-I77 HydrophobicContact CG1-CD1 3.7Å; V73-I77 HydrophobicContact CG1-CD1 3.75Å; V73-I77 VanDerWaalsContact O-CD1 3.28Å; V73-I77 WeakPolarHBondContact O-CD1 3.4Å; V73-I77 WeakPolarHBondContact O-CG1 3.3Å; V73-I77 PolarHBondContact O-N 2.99Å; L75-I77 VanDerWaalsContact C-N 3.32Å; L75-I77 PolarHBondContact O-N 3.37Å; I77-T81 HydrophobicContact CG2-CG2 4.31Å; I77-T81 WeakPolarHBondContact O-CB 3.5Å; I77-T81 VanDerWaalsContact O-CG2 3.26Å; I77-T81 WeakPolarHBondContact O-CG2 3.3Å; I77-T81 PolarHBondContact O-N 3.16Å; I77-T81 PolarHBondContact O-OG1 3.09Å
78F90.7Very high89.5Confident48 Ų4839.2 Ų39.221%0.21121%0.213CC..Hα-helixtrans-60.4-53.7177.8-179.9-104.3000111.5I24 S74 L75 A80 T81 T82 M100 M104I24-F78 HydrophobicContact CG2-CZ 4.35Å; S74-F78 VanDerWaalsContact O-CB 3.27Å; S74-F78 WeakPolarHBondContact O-CB 3.18Å; S74-F78 PolarHBondContact O-N 2.95Å; L75-F78 PolarHBondContact O-N 3.24Å; F78-A80 PolarHBondContact O-N 3.43Å; F78-T81 PolarHBondContact O-N 3.36Å; F78-T81 PolarHBondContact O-OG1 3.33Å; F78-T82 HydrophobicContact CD2-CG2 4.31Å; F78-T82 HydrophobicContact CE1-CG2 4.18Å; F78-T82 HydrophobicContact CE2-CG2 3.93Å; F78-T82 HydrophobicContact CZ-CG2 3.87Å; F78-T82 WeakPolarHBondContact O-CG2 3.49Å; F78-T82 PolarHBondContact O-N 3.06Å; F78-T82 PolarHBondContact O-OG1 3.35Å; F78-T82 VanDerWaalsContact O-OG1 3.07Å; F78-M100 HydrophobicContact CE1-CE 3.95Å; F78-M100 HydrophobicContact CZ-CE 3.89Å; F78-M104 HydrophobicContact CD1-SD 3.89Å; F78-M104 HydrophobicContact CE1-CE 3.98Å; F78-M104 HydrophobicContact CE1-SD 3.62Å
79I90.8Very high89.3Confident0 Ų041.9 Ų41.90%024%0.237CC..Hα-helixtrans-64.3-42.7-178-61.2169.2000111L75 T82 N83 L160 A211 F214L75-I79 HydrophobicContact CD1-CD1 4.01Å; L75-I79 HydrophobicContact CG-CD1 3.93Å; L75-I79 WeakPolarHBondContact O-CG1 3.3Å; L75-I79 PolarHBondContact O-N 3.14Å; I79-T82 WeakPolarHBondContact CA-OG1 3.36Å; I79-T82 PolarHBondContact O-OG1 3.16Å; I79-N83 WeakPolarHBondContact CG2-ND2 3.01Å; I79-N83 WeakPolarHBondContact O-CB 3.22Å; I79-N83 PolarHBondContact O-N 3.22Å; I79-N83 PolarHBondContact O-ND2 3.5Å; I79-N83 PolarHBondContact O-OD1 3.34Å; I79-L160 HydrophobicContact CG2-CD1 4.03Å; I79-L160 HydrophobicContact CG2-CD2 4.15Å; I79-A211 HydrophobicContact CB-CB 4.04Å; I79-A211 HydrophobicContact CG2-CB 3.74Å; I79-F214 HydrophobicContact CD1-CB 4.23Å; I79-F214 HydrophobicContact CD1-CD1 3.34Å; I79-F214 HydrophobicContact CD1-CD2 4.32Å; I79-F214 HydrophobicContact CD1-CE1 3.7Å; I79-F214 HydrophobicContact CD1-CG 3.71Å; I79-F214 HydrophobicContact CD1-CZ 4.33Å
80A90.5Very high89.1Confident29 Ų2950.1 Ų50.124%0.2427%0.272CS..Hα-helixtrans-63.1-44.2179.500000111.6I76 F78 L84 A211I76-A80 WeakPolarHBondContact O-CB 3.43Å; I76-A80 PolarHBondContact O-N 2.99Å; F78-A80 PolarHBondContact O-N 3.43Å; A80-L84 VanDerWaalsContact O-CB 3.3Å; A80-L84 WeakPolarHBondContact O-CB 3.5Å; A80-L84 PolarHBondContact O-N 2.96Å; A80-A211 HydrophobicContact CB-CB 3.93Å
81T90.8Very high88.7Confident30 Ų3044.7 Ų44.718%0.18425%0.247CC..Hα-helixtrans-69.3-42.8179.552.40000112P27 I77 F78 N83 L84 L85P27-T81 WeakPolarHBondContact CB-OG1 3.41Å; I77-T81 HydrophobicContact CG2-CG2 4.31Å; I77-T81 WeakPolarHBondContact O-CB 3.5Å; I77-T81 VanDerWaalsContact O-CG2 3.26Å; I77-T81 WeakPolarHBondContact O-CG2 3.3Å; I77-T81 PolarHBondContact O-N 3.16Å; I77-T81 PolarHBondContact O-OG1 3.09Å; F78-T81 PolarHBondContact O-N 3.36Å; F78-T81 PolarHBondContact O-OG1 3.33Å; T81-N83 VanDerWaalsContact C-N 3.34Å; T81-N83 PolarHBondContact O-N 2.98Å; T81-L84 PolarHBondContact O-N 3.07Å; T81-L85 WeakPolarHBondContact O-CB 3.42Å; T81-L85 WeakPolarHBondContact O-CD1 3.38Å; T81-L85 PolarHBondContact O-N 2.91Å
82T90.6Very high88.3Confident4 Ų443.4 Ų43.43%0.02524%0.24CC..Hα-helixtrans-61.9-40.6176.352.30000112.5P27 F78 I79 G86 P94 T95P27-T82 HydrophobicContact CB-CG2 4.3Å; P27-T82 HydrophobicContact CG-CG2 3.53Å; F78-T82 HydrophobicContact CD2-CG2 4.31Å; F78-T82 HydrophobicContact CE1-CG2 4.18Å; F78-T82 HydrophobicContact CE2-CG2 3.93Å; F78-T82 HydrophobicContact CZ-CG2 3.87Å; F78-T82 WeakPolarHBondContact O-CG2 3.49Å; F78-T82 PolarHBondContact O-N 3.06Å; F78-T82 PolarHBondContact O-OG1 3.35Å; F78-T82 VanDerWaalsContact O-OG1 3.07Å; I79-T82 WeakPolarHBondContact CA-OG1 3.36Å; I79-T82 PolarHBondContact O-OG1 3.16Å; T82-G86 PolarHBondContact O-N 3.2Å; T82-G86 VanDerWaalsContact O-N 3.1Å; T82-P94 HydrophobicContact CG2-CG 4.46Å; T82-T95 WeakPolarHBondContact OG1-CG2 3.49Å
83N90.8Very high88Confident2 Ų243.6 Ų43.61%0.01124%0.241CC..Hα-helixtrans-71.8-41.4-179.3-65.4-10.8000111.3I79 T81 G86 L87 T95 I164 A207I79-N83 WeakPolarHBondContact CG2-ND2 3.01Å; I79-N83 WeakPolarHBondContact O-CB 3.22Å; I79-N83 PolarHBondContact O-N 3.22Å; I79-N83 PolarHBondContact O-ND2 3.5Å; I79-N83 PolarHBondContact O-OD1 3.34Å; T81-N83 VanDerWaalsContact C-N 3.34Å; T81-N83 PolarHBondContact O-N 2.98Å; N83-G86 WeakPolarHBondContact O-CA 3.37Å; N83-G86 PolarHBondContact O-N 2.9Å; N83-G86 VanDerWaalsContact O-N 3.13Å; N83-L87 PolarHBondContact O-N 3.1Å; N83-T95 WeakPolarHBondContact OD1-CB 3.37Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.44Å; N83-T95 PolarHBondContact OD1-OG1 3.4Å; N83-I164 HydrophobicContact CB-CD1 4.25Å; N83-I164 VanDerWaalsContact CG-CD1 3.41Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.21Å; N83-A207 HydrophobicContact CB-CB 3.88Å; N83-A207 PolarHBondContact ND2-O 3.3Å
84L89.3Confident87.6Confident94 Ų9443.2 Ų43.249%0.49224%0.239SC..Hα-helixtrans-66.4-42.1179.3-163.297.4000111.5A80 T81 G86 L87 I204A80-L84 VanDerWaalsContact O-CB 3.3Å; A80-L84 WeakPolarHBondContact O-CB 3.5Å; A80-L84 PolarHBondContact O-N 2.96Å; T81-L84 PolarHBondContact O-N 3.07Å; L84-G86 PolarHBondContact O-N 3.18Å; L84-L87 PolarHBondContact O-N 3.08Å; L84-I204 HydrophobicContact CD1-CG2 4.33Å
85L88.9Confident87.3Confident41 Ų4140.1 Ų40.122%0.21522%0.217CC..Hα-helixtrans-61.3-32.4173.3-96.581.5000111.9F26 L30 T81 L87 L88 S91F26-L85 HydrophobicContact CD1-CD2 3.32Å; F26-L85 HydrophobicContact CE1-CD2 3.6Å; L30-L85 HydrophobicContact CD1-CD1 3.34Å; L30-L85 HydrophobicContact CD1-CD2 3.94Å; L30-L85 HydrophobicContact CD1-CG 4.19Å; T81-L85 WeakPolarHBondContact O-CB 3.42Å; T81-L85 WeakPolarHBondContact O-CD1 3.38Å; T81-L85 PolarHBondContact O-N 2.91Å; L85-L87 VanDerWaalsContact C-N 3.26Å; L85-L87 PolarHBondContact O-N 2.92Å; L85-L88 HydrophobicContact CG-CD1 4.45Å; L85-L88 VanDerWaalsContact O-CB 3.25Å; L85-L88 WeakPolarHBondContact O-CB 3.09Å; L85-L88 WeakPolarHBondContact O-CG 3.2Å; L85-L88 PolarHBondContact O-N 3.32Å; L85-L88 VanDerWaalsContact O-N 3.16Å; L85-S91 PolarHBondContact O-OG 2.95Å
86G85.1Confident87Confident1 Ų139.9 Ų39.91%0.0122%0.216CC..Hα-helixtrans-58.8-34177.300000116.2T82 N83 L84 L88 S91 H168T82-G86 PolarHBondContact O-N 3.2Å; T82-G86 VanDerWaalsContact O-N 3.1Å; N83-G86 WeakPolarHBondContact O-CA 3.37Å; N83-G86 PolarHBondContact O-N 2.9Å; N83-G86 VanDerWaalsContact O-N 3.13Å; L84-G86 PolarHBondContact O-N 3.18Å; G86-L88 PolarHBondContact O-N 3.3Å; G86-S91 VanDerWaalsContact C-OG 3.28Å; G86-S91 WeakPolarHBondContact CA-OG 3.27Å; G86-S91 PolarHBondContact O-OG 3.47Å; G86-H168 PolarHBondContact O-CE1 3.22Å; G86-H168 PolarHBondContact O-NE2 3.31Å
87L86.5Confident86.9Confident40 Ų4042.2 Ų42.221%0.20923%0.227CC..THydrogen-bonded Turntrans-74.3-6-179.5-61.5172.7000112.5N83 L84 L85 M171 E203 I204 A207N83-L87 PolarHBondContact O-N 3.1Å; L84-L87 PolarHBondContact O-N 3.08Å; L85-L87 VanDerWaalsContact C-N 3.26Å; L85-L87 PolarHBondContact O-N 2.92Å; L87-M171 HydrophobicContact CD2-CE 4.05Å; L87-E203 HydrophobicContact CD2-CB 4.09Å; L87-E203 HydrophobicContact CD2-CG 3.67Å; L87-I204 HydrophobicContact CD1-CB 4.19Å; L87-I204 HydrophobicContact CD1-CG1 3.6Å; L87-A207 HydrophobicContact CD1-CB 4.13Å
88L87Confident86.7Confident101 Ų10144 Ų4453%0.52924%0.236SC..SBendtrans-68.3142.9174.6-65.1173.2000110.7L85 G86 H90 S91L85-L88 HydrophobicContact CG-CD1 4.45Å; L85-L88 VanDerWaalsContact O-CB 3.25Å; L85-L88 WeakPolarHBondContact O-CB 3.09Å; L85-L88 WeakPolarHBondContact O-CG 3.2Å; L85-L88 PolarHBondContact O-N 3.32Å; L85-L88 VanDerWaalsContact O-N 3.16Å; G86-L88 PolarHBondContact O-N 3.3Å; L88-H90 PolarHBondContact O-N 3.41Å; L88-S91 WeakPolarHBondContact O-CB 3.38Å; L88-S91 PolarHBondContact O-N 3.28Å; L88-S91 VanDerWaalsContact O-N 3.14Å; L88-S91 PolarHBondContact O-OG 3.31Å
89P81.6Confident86.6Confident110 Ų11045.7 Ų45.771%0.71425%0.254SS*.THydrogen-bonded Turntrans-59134.6-178.824.7-33.9000110.9S91P89-S91 PolarHBondContact O-N 3.32Å; P89-S91 VanDerWaalsContact O-N 3.11Å
90H81.7Confident86.4Confident202 Ų20247.7 Ų47.794%0.93526%0.264SS*.THydrogen-bonded Turntrans57.317.6-178.4-57-62.5000115.8L88L88-H90 PolarHBondContact O-N 3.41Å
91S83.5Confident86.2Confident36 Ų3646.3 Ų46.325%0.25225%0.253SS..  trans-82142.7172.274.20000111.2L85 G86 L88 P89L85-S91 PolarHBondContact O-OG 2.95Å; G86-S91 VanDerWaalsContact C-OG 3.28Å; G86-S91 WeakPolarHBondContact CA-OG 3.27Å; G86-S91 PolarHBondContact O-OG 3.47Å; L88-S91 WeakPolarHBondContact O-CB 3.38Å; L88-S91 PolarHBondContact O-N 3.28Å; L88-S91 VanDerWaalsContact O-N 3.14Å; L88-S91 PolarHBondContact O-OG 3.31Å; P89-S91 PolarHBondContact O-N 3.32Å; P89-S91 VanDerWaalsContact O-N 3.11Å
92F82.1Confident86Confident26 Ų2646.8 Ų46.811%0.11425%0.254CS..  trans-90.3124.3171.9171.3-94.4000109.5S8 A11 P12 A20 I23 P94 Q97S8-F92 WeakPolarHBondContact O-CD2 3.44Å; A11-F92 HydrophobicContact CB-CZ 4.49Å; P12-F92 HydrophobicContact CG-CB 4.39Å; P12-F92 HydrophobicContact CG-CD1 4.16Å; P12-F92 HydrophobicContact CG-CG 4.1Å; A20-F92 HydrophobicContact CB-CE1 4.34Å; I23-F92 HydrophobicContact CD1-CB 4.09Å; I23-F92 HydrophobicContact CD1-CD1 3.92Å; I23-F92 HydrophobicContact CD1-CG 4.39Å; I23-F92 HydrophobicContact CG2-CD1 4.46Å; I23-F92 WeakPolarHBondContact CG2-O 3.33Å; F92-P94 HydrophobicContact CE1-CB 4.46Å; F92-P94 WeakPolarHBondContact O-CD 3.48Å; F92-Q97 HydrophobicContact CZ-CG 4.15Å
93T83.6Confident85.9Confident4 Ų449.7 Ų49.73%0.02528%0.279CS..  trans-93.2112.8177.930.20000111.4T95 T96 I164T93-T95 PolarHBondContact O-N 3.47Å; T93-T96 PolarHBondContact O-N 2.74Å; T93-T96 PolarHBondContact O-OG1 3.24Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.38Å; T93-I164 HydrophobicContact CG2-CG2 4.26Å
94P82.1Confident85.7Confident9 Ų950.9 Ų50.96%0.05828%0.284CS..G310 helixtrans-64.2-23.6176.326.1-33.3000112.5I24 T82 F92 T96 Q97 M100I24-P94 HydrophobicContact CD1-CB 4.28Å; I24-P94 HydrophobicContact CG1-CB 3.71Å; I24-P94 HydrophobicContact CG1-CG 4.07Å; T82-P94 HydrophobicContact CG2-CG 4.46Å; F92-P94 HydrophobicContact CE1-CB 4.46Å; F92-P94 WeakPolarHBondContact O-CD 3.48Å; P94-T96 VanDerWaalsContact C-N 3.28Å; P94-T96 PolarHBondContact O-N 3.32Å; P94-Q97 PolarHBondContact O-N 3.01Å; P94-M100 WeakPolarHBondContact O-CB 3.29Å
95T85.2Confident85.5Confident1 Ų146.5 Ų46.51%0.00626%0.261CS..G310 helixtrans-76.3-7.3179.650.50000114.6T82 N83 T93 Q97 N101 L160 I164T82-T95 WeakPolarHBondContact OG1-CG2 3.49Å; N83-T95 WeakPolarHBondContact OD1-CB 3.37Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.44Å; N83-T95 PolarHBondContact OD1-OG1 3.4Å; T93-T95 PolarHBondContact O-N 3.47Å; T95-Q97 VanDerWaalsContact C-N 3.33Å; T95-N101 PolarHBondContact O-ND2 3.36Å; T95-N101 PolarHBondContact O-OD1 3.28Å; T95-L160 HydrophobicContact CG2-CD2 4.42Å; T95-I164 VanDerWaalsContact OG1-CD1 3.28Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.33Å
96T85.3Confident85.5Confident10 Ų1048.5 Ų48.56%0.06127%0.272CS..G310 helixtrans-75.2-26169.656.30000112.4F9 T93 P94 L98 T161 I164 T165F9-T96 HydrophobicContact CD1-CG2 3.86Å; F9-T96 HydrophobicContact CE1-CG2 3.75Å; T93-T96 PolarHBondContact O-N 2.74Å; T93-T96 PolarHBondContact O-OG1 3.24Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.38Å; P94-T96 VanDerWaalsContact C-N 3.28Å; P94-T96 PolarHBondContact O-N 3.32Å; T96-L98 PolarHBondContact O-N 2.71Å; T96-T161 WeakPolarHBondContact O-CG2 3.49Å; T96-I164 HydrophobicContact CG2-CB 4.28Å; T96-I164 HydrophobicContact CG2-CG2 3.62Å; T96-T165 HydrophobicContact CG2-CG2 3.76Å
97Q88.6Confident85.6Confident67 Ų6752.2 Ų52.231%0.31330%0.296SS..SBendtrans-78.8120178.2-65.6-63.4-32.600109.8F9 F92 P94 T95 S99 M100 N101F9-Q97 PolarHBondContact O-NE2 3.32Å; F92-Q97 HydrophobicContact CZ-CG 4.15Å; P94-Q97 PolarHBondContact O-N 3.01Å; T95-Q97 VanDerWaalsContact C-N 3.33Å; Q97-S99 PolarHBondContact O-N 2.81Å; Q97-M100 PolarHBondContact O-N 3.39Å; Q97-M100 VanDerWaalsContact O-N 3.1Å; Q97-N101 PolarHBondContact O-N 3.41Å
98L86.2Confident85.7Confident68 Ų6851.3 Ų51.336%0.35629%0.291SS..Hα-helixtrans-57.6-33.7178.6-177.363.7000112.1T96 M100 N101 L102 A157 V158 T161T96-L98 PolarHBondContact O-N 2.71Å; L98-M100 VanDerWaalsContact C-N 3.32Å; L98-M100 PolarHBondContact O-N 3.18Å; L98-N101 PolarHBondContact O-N 3.4Å; L98-L102 VanDerWaalsContact O-CB 3.25Å; L98-L102 WeakPolarHBondContact O-CB 3.1Å; L98-L102 PolarHBondContact O-N 3.43Å; L98-A157 HydrophobicContact CD1-CB 4.32Å; L98-V158 HydrophobicContact CD1-CG2 3.88Å; L98-T161 VanDerWaalsContact CA-CG2 3.44Å; L98-T161 HydrophobicContact CB-CG2 4.02Å; L98-T161 HydrophobicContact CD1-CG2 4Å
99S87.7Confident85.6Confident85 Ų8548.5 Ų48.559%0.59427%0.273SS*.Hα-helixtrans-56.2-44176.455.30000112.6Q97 A103Q97-S99 PolarHBondContact O-N 2.81Å; S99-A103 WeakPolarHBondContact O-CB 3.32Å; S99-A103 PolarHBondContact O-N 3.21Å
100M87.1Confident85.7Confident42 Ų4244.6 Ų44.621%0.20725%0.25CS..Hα-helixtrans-67.2-45.7-179.3-175.363.5-172.600111.4I24 F78 P94 Q97 L98 L102 A103 M104I24-M100 HydrophobicContact CD1-SD 4.32Å; I24-M100 HydrophobicContact CG2-CE 4.28Å; F78-M100 HydrophobicContact CE1-CE 3.95Å; F78-M100 HydrophobicContact CZ-CE 3.89Å; P94-M100 WeakPolarHBondContact O-CB 3.29Å; Q97-M100 PolarHBondContact O-N 3.39Å; Q97-M100 VanDerWaalsContact O-N 3.1Å; L98-M100 VanDerWaalsContact C-N 3.32Å; L98-M100 PolarHBondContact O-N 3.18Å; M100-L102 PolarHBondContact O-N 2.94Å; M100-A103 PolarHBondContact O-N 3.34Å; M100-M104 HydrophobicContact CE-CE 3.79Å; M100-M104 HydrophobicContact CE-CG 4.46Å; M100-M104 HydrophobicContact CE-SD 4.32Å; M100-M104 HydrophobicContact CG-CE 3.67Å; M100-M104 PolarHBondContact O-N 3.09Å; M100-M104 VanDerWaalsContact O-N 3.09Å; M100-M104 HydrophobicContact SD-CE 4.42Å
101N87.8Confident85.9Confident0 Ų036 Ų360%022%0.216CC..Hα-helixtrans-68.3-37.8-178.7-66.5-6.7000111.7T95 Q97 L98 M104 A105 A157 L160 T161T95-N101 PolarHBondContact O-ND2 3.36Å; T95-N101 PolarHBondContact O-OD1 3.28Å; Q97-N101 PolarHBondContact O-N 3.41Å; L98-N101 PolarHBondContact O-N 3.4Å; N101-M104 PolarHBondContact O-N 3.29Å; N101-A105 VanDerWaalsContact O-CB 3.3Å; N101-A105 WeakPolarHBondContact O-CB 3.09Å; N101-A105 PolarHBondContact O-N 3.1Å; N101-A157 HydrophobicContact CB-CB 3.9Å; N101-A157 PolarHBondContact ND2-O 3.05Å; N101-L160 HydrophobicContact CB-CD2 4.4Å; N101-L160 WeakPolarHBondContact ND2-CB 3.44Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.23Å; N101-L160 WeakPolarHBondContact ND2-CG 3.15Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.4Å; N101-T161 HydrophobicContact CB-CG2 4.29Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.27Å; N101-T161 PolarHBondContact ND2-N 2.85Å
102L85.8Confident85.8Confident40 Ų4034.3 Ų34.321%0.20921%0.205CC..Hα-helixtrans-69.9-38.6177.3-153.674000111.4L98 M100 M104 A105 I106 M154 A157L98-L102 VanDerWaalsContact O-CB 3.25Å; L98-L102 WeakPolarHBondContact O-CB 3.1Å; L98-L102 PolarHBondContact O-N 3.43Å; M100-L102 PolarHBondContact O-N 2.94Å; L102-M104 PolarHBondContact O-N 2.97Å; L102-A105 PolarHBondContact O-N 2.91Å; L102-I106 HydrophobicContact CD1-CD1 4.23Å; L102-I106 HydrophobicContact CD1-CG1 4.37Å; L102-I106 HydrophobicContact CD2-CD1 3.89Å; L102-I106 HydrophobicContact CG-CD1 3.57Å; L102-I106 HydrophobicContact CG-CG1 4.04Å; L102-I106 WeakPolarHBondContact O-CG1 3.43Å; L102-I106 PolarHBondContact O-N 2.84Å; L102-M154 HydrophobicContact CD1-CE 4.43Å; L102-M154 HydrophobicContact CD1-CG 4.49Å; L102-M154 HydrophobicContact CD1-SD 3.96Å; L102-A157 HydrophobicContact CB-CB 4.46Å; L102-A157 HydrophobicContact CD1-CB 3.81Å
103A88.6Confident85.8Confident65 Ų6533.9 Ų33.954%0.53720%0.204SC..Hα-helixtrans-62.9-29.7173.600000112.8S99 M100 P107S99-A103 WeakPolarHBondContact O-CB 3.32Å; S99-A103 PolarHBondContact O-N 3.21Å; M100-A103 PolarHBondContact O-N 3.34Å; A103-P107 WeakPolarHBondContact O-CD 3.49Å; A103-P107 WeakPolarHBondContact O-CG 3.44Å
104M85.5Confident85.8Confident26 Ų2638.5 Ų38.513%0.12823%0.227CC..Hα-helixtrans-79.2-45.8171-71-172.4-96.400112.3F78 M100 N101 L102 L108F78-M104 HydrophobicContact CD1-SD 3.89Å; F78-M104 HydrophobicContact CE1-CE 3.98Å; F78-M104 HydrophobicContact CE1-SD 3.62Å; M100-M104 HydrophobicContact CE-CE 3.79Å; M100-M104 HydrophobicContact CE-CG 4.46Å; M100-M104 HydrophobicContact CE-SD 4.32Å; M100-M104 HydrophobicContact CG-CE 3.67Å; M100-M104 PolarHBondContact O-N 3.09Å; M100-M104 VanDerWaalsContact O-N 3.09Å; M100-M104 HydrophobicContact SD-CE 4.42Å; N101-M104 PolarHBondContact O-N 3.29Å; L102-M104 PolarHBondContact O-N 2.97Å; M104-L108 WeakPolarHBondContact O-CD1 3.47Å; M104-L108 VanDerWaalsContact O-CG 3.22Å; M104-L108 WeakPolarHBondContact O-CG 3.41Å
105A86.5Confident85.6Confident2 Ų240.4 Ų40.42%0.01724%0.236CC..Hα-helixtrans-70.3-44.2-171.600000113.5N101 L102 L108 W109 A157 F214N101-A105 VanDerWaalsContact O-CB 3.3Å; N101-A105 WeakPolarHBondContact O-CB 3.09Å; N101-A105 PolarHBondContact O-N 3.1Å; L102-A105 PolarHBondContact O-N 2.91Å; A105-L108 PolarHBondContact O-N 3.34Å; A105-W109 VanDerWaalsContact O-CB 3.3Å; A105-W109 WeakPolarHBondContact O-CB 3.35Å; A105-W109 PolarHBondContact O-N 3.24Å; A105-A157 HydrophobicContact CB-CB 4.25Å; A105-F214 HydrophobicContact CB-CE2 4.38Å; A105-F214 HydrophobicContact CB-CZ 4.18Å
106I87.5Confident85.1Confident83 Ų8340.4 Ų40.443%0.42624%0.236SC..Hα-helixtrans-62.7-50.4-174.9-66.9174.2000111.8L102 L108 W109 A110L102-I106 HydrophobicContact CD1-CD1 4.23Å; L102-I106 HydrophobicContact CD1-CG1 4.37Å; L102-I106 HydrophobicContact CD2-CD1 3.89Å; L102-I106 HydrophobicContact CG-CD1 3.57Å; L102-I106 HydrophobicContact CG-CG1 4.04Å; L102-I106 WeakPolarHBondContact O-CG1 3.43Å; L102-I106 PolarHBondContact O-N 2.84Å; I106-L108 VanDerWaalsContact C-N 3.34Å; I106-L108 PolarHBondContact O-N 2.93Å; I106-W109 PolarHBondContact O-N 3.38Å; I106-A110 WeakPolarHBondContact O-CB 3.18Å; I106-A110 PolarHBondContact O-N 3.48Å
107P88.7Confident84.7Confident80 Ų8043.8 Ų43.852%0.51925%0.25SS..Hα-helixtrans-64.7-37.5-178.8-24.236.6000113.1A103 G111A103-P107 WeakPolarHBondContact O-CD 3.49Å; A103-P107 WeakPolarHBondContact O-CG 3.44Å; P107-G111 PolarHBondContact O-N 3.24Å
108L87.1Confident84Confident21 Ų2151 Ų5111%0.1128%0.275CS..Hα-helixtrans-64.8-47.1178.2-71.7169.9000111.6M71 L75 M104 A105 I106 G111 A112 F214 V218M71-L108 HydrophobicContact CE-CD2 3.24Å; M71-L108 HydrophobicContact CG-CD2 4.26Å; M71-L108 HydrophobicContact SD-CD2 3.41Å; M71-L108 WeakPolarHBondContact SD-CD2 3.31Å; L75-L108 HydrophobicContact CD1-CD1 3.51Å; L75-L108 HydrophobicContact CD2-CD1 3.77Å; L75-L108 HydrophobicContact CG-CD1 4.29Å; M104-L108 WeakPolarHBondContact O-CD1 3.47Å; M104-L108 VanDerWaalsContact O-CG 3.22Å; M104-L108 WeakPolarHBondContact O-CG 3.41Å; A105-L108 PolarHBondContact O-N 3.34Å; I106-L108 VanDerWaalsContact C-N 3.34Å; I106-L108 PolarHBondContact O-N 2.93Å; L108-G111 PolarHBondContact O-N 3.22Å; L108-A112 PolarHBondContact O-N 3Å; L108-A112 VanDerWaalsContact O-N 3.12Å; L108-F214 HydrophobicContact CD1-CE1 4.07Å; L108-V218 HydrophobicContact CB-CG1 4.41Å
109W85.4Confident83.1Confident42 Ų4250 Ų5016%0.15927%0.274CS..Hα-helixtrans-64.3-47.6176.2172.289.9000111.5A105 I106 G111 A112 V113 L149 L150 P153A105-W109 VanDerWaalsContact O-CB 3.3Å; A105-W109 WeakPolarHBondContact O-CB 3.35Å; A105-W109 PolarHBondContact O-N 3.24Å; I106-W109 PolarHBondContact O-N 3.38Å; W109-G111 VanDerWaalsContact C-N 3.28Å; W109-G111 PolarHBondContact O-N 3.29Å; W109-A112 PolarHBondContact O-N 3.42Å; W109-A112 VanDerWaalsContact O-N 3.15Å; W109-V113 HydrophobicContact CD2-CG2 4.09Å; W109-V113 HydrophobicContact CH2-CG2 4.42Å; W109-V113 HydrophobicContact CZ2-CG2 3.94Å; W109-V113 WeakPolarHBondContact O-CG2 3.47Å; W109-V113 PolarHBondContact O-N 3.12Å; W109-L149 HydrophobicContact CH2-CD2 4.16Å; W109-L149 HydrophobicContact CZ2-CD2 3.45Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.45Å; W109-L149 HydrophobicContact CZ2-CG 3.95Å; W109-L149 VanDerWaalsContact CZ2-O 3.31Å; W109-L149 WeakPolarHBondContact CZ2-O 3.45Å; W109-L149 PolarHBondContact NE1-O 3.11Å; W109-L150 HydrophobicContact CH2-CD2 3.74Å; W109-L150 HydrophobicContact CZ2-CD2 4.24Å; W109-P153 HydrophobicContact CB-CB 3.92Å; W109-P153 HydrophobicContact CB-CG 4.39Å; W109-P153 HydrophobicContact CD2-CB 4.34Å; W109-P153 HydrophobicContact CD2-CG 3.83Å; W109-P153 HydrophobicContact CE3-CG 4.38Å; W109-P153 HydrophobicContact CG-CB 3.86Å; W109-P153 HydrophobicContact CG-CG 3.81Å
110A84.6Confident82.2Confident27 Ų2750.7 Ų50.722%0.22327%0.266CS..Hα-helixtrans-60.7-40.5179.200000111I106 V113 I114I106-A110 WeakPolarHBondContact O-CB 3.18Å; I106-A110 PolarHBondContact O-N 3.48Å; A110-V113 PolarHBondContact O-N 2.88Å; A110-I114 VanDerWaalsContact O-CB 3.31Å; A110-I114 WeakPolarHBondContact O-CB 3.41Å; A110-I114 WeakPolarHBondContact O-CD1 3.43Å; A110-I114 WeakPolarHBondContact O-CG1 3.38Å; A110-I114 PolarHBondContact O-N 3.37Å
111G84.8Confident81.1Confident21 Ų2154 Ų5422%0.21628%0.283CS..Hα-helixtrans-59.5-45.9174.600000113P107 L108 W109 M115P107-G111 PolarHBondContact O-N 3.24Å; L108-G111 PolarHBondContact O-N 3.22Å; W109-G111 VanDerWaalsContact C-N 3.28Å; W109-G111 PolarHBondContact O-N 3.29Å; G111-M115 WeakPolarHBondContact O-CB 3.31Å; G111-M115 PolarHBondContact O-N 3.42Å
112A82.2Confident79.8Confident2 Ų263 Ų632%0.01732%0.322CS..Hα-helixtrans-63.1-45.6177.300000111.9L108 W109 M115 G116L108-A112 PolarHBondContact O-N 3Å; L108-A112 VanDerWaalsContact O-N 3.12Å; W109-A112 PolarHBondContact O-N 3.42Å; W109-A112 VanDerWaalsContact O-N 3.15Å; A112-M115 PolarHBondContact O-N 3.32Å; A112-G116 PolarHBondContact O-N 3.2Å
113V81.6Confident78.8Confident17 Ų1766.1 Ų66.110%0.10334%0.339CS..Hα-helixtrans-64.7-46.7179172.70000111.4W109 A110 M115 G116 F117W109-V113 HydrophobicContact CD2-CG2 4.09Å; W109-V113 HydrophobicContact CH2-CG2 4.42Å; W109-V113 HydrophobicContact CZ2-CG2 3.94Å; W109-V113 WeakPolarHBondContact O-CG2 3.47Å; W109-V113 PolarHBondContact O-N 3.12Å; A110-V113 PolarHBondContact O-N 2.88Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 3.25Å; V113-G116 PolarHBondContact O-N 2.86Å; V113-G116 VanDerWaalsContact O-N 3.14Å; V113-F117 HydrophobicContact CG1-CD2 3.65Å; V113-F117 HydrophobicContact CG1-CE2 3.38Å; V113-F117 WeakPolarHBondContact O-CD2 3.38Å; V113-F117 PolarHBondContact O-N 2.84Å
114I82.8Confident77.5Confident100 Ų10063.9 Ų63.951%0.51332%0.321SS..Hα-helixtrans-61.3-39.4177.2-68.3163.8000110.6A110 G116 F117 R118A110-I114 VanDerWaalsContact O-CB 3.31Å; A110-I114 WeakPolarHBondContact O-CB 3.41Å; A110-I114 WeakPolarHBondContact O-CD1 3.43Å; A110-I114 WeakPolarHBondContact O-CG1 3.38Å; A110-I114 PolarHBondContact O-N 3.37Å; I114-G116 VanDerWaalsContact C-N 3.35Å; I114-F117 PolarHBondContact O-N 2.91Å; I114-R118 HydrophobicContact CG2-CG 4.45Å; I114-R118 WeakPolarHBondContact O-CB 3.46Å; I114-R118 VanDerWaalsContact O-CG 3.32Å; I114-R118 WeakPolarHBondContact O-CG 3.47Å; I114-R118 PolarHBondContact O-N 3.45Å
115M79Confident76.3Confident49 Ų4967.1 Ų67.124%0.24134%0.338CS..Hα-helixtrans-65.6-37.9176.2-171.5169.8-178.800112.1W68 G111 A112 V113 R118 S119 L222W68-M115 HydrophobicContact CZ2-SD 4Å; W68-M115 PolarHBondContact NE1-SD 3.37Å; G111-M115 WeakPolarHBondContact O-CB 3.31Å; G111-M115 PolarHBondContact O-N 3.42Å; A112-M115 PolarHBondContact O-N 3.32Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 3.25Å; M115-R118 PolarHBondContact O-N 2.69Å; M115-S119 WeakPolarHBondContact O-CB 3.32Å; M115-S119 PolarHBondContact O-N 3.5Å; M115-S119 PolarHBondContact O-OG 2.96Å; M115-L222 HydrophobicContact SD-CD1 4.22Å
116G74.3Confident75.1Confident1 Ų169.6 Ų69.61%0.0136%0.358CS..Hα-helixtrans-60.8-50.817300000112.8A112 V113 I114 R118 S119 K120 N225A112-G116 PolarHBondContact O-N 3.2Å; V113-G116 PolarHBondContact O-N 2.86Å; V113-G116 VanDerWaalsContact O-N 3.14Å; I114-G116 VanDerWaalsContact C-N 3.35Å; G116-R118 VanDerWaalsContact C-N 3.31Å; G116-R118 PolarHBondContact O-N 3.37Å; G116-S119 PolarHBondContact O-N 3.48Å; G116-S119 PolarHBondContact O-OG 3.04Å; G116-K120 PolarHBondContact O-N 3.19Å; G116-N225 VanDerWaalsContact CA-O 3.27Å; G116-N225 WeakPolarHBondContact CA-O 3.4Å
117F76.3Confident74Confident82 Ų8271 Ų7136%0.3636%0.363SS..Hα-helixtrans-59.8-40.2175.4-77.4-65.1000112.2V113 I114 I121 A124 L125 F128V113-F117 HydrophobicContact CG1-CD2 3.65Å; V113-F117 HydrophobicContact CG1-CE2 3.38Å; V113-F117 WeakPolarHBondContact O-CD2 3.38Å; V113-F117 PolarHBondContact O-N 2.84Å; I114-F117 PolarHBondContact O-N 2.91Å; F117-I121 WeakPolarHBondContact O-CG1 3.48Å; F117-A124 HydrophobicContact CD1-CB 4.38Å; F117-A124 HydrophobicContact CE1-CB 4.47Å; F117-L125 HydrophobicContact CD1-CD1 4.2Å; F117-L125 HydrophobicContact CE1-CD1 3.81Å; F117-F128 HydrophobicContact CZ-CE2 4.46Å
118R74.9Confident72.6Confident217 Ų21769 Ų6982%0.81935%0.346SS*.Hα-helixtrans-70.5-33.5178.7-73.8-179.569.6-168.12113.6I114 M115 G116I114-R118 HydrophobicContact CG2-CG 4.45Å; I114-R118 WeakPolarHBondContact O-CB 3.46Å; I114-R118 VanDerWaalsContact O-CG 3.32Å; I114-R118 WeakPolarHBondContact O-CG 3.47Å; I114-R118 PolarHBondContact O-N 3.45Å; M115-R118 PolarHBondContact O-N 2.69Å; G116-R118 VanDerWaalsContact C-N 3.31Å; G116-R118 PolarHBondContact O-N 3.37Å
119S67.3Low71.3Confident49 Ų4970.9 Ų70.934%0.34336%0.356SS..Hα-helixtrans-87.6-40.7-17377.50000113.3M115 G116 N225M115-S119 WeakPolarHBondContact O-CB 3.32Å; M115-S119 PolarHBondContact O-N 3.5Å; M115-S119 PolarHBondContact O-OG 2.96Å; G116-S119 PolarHBondContact O-N 3.48Å; G116-S119 PolarHBondContact O-OG 3.04Å; S119-N225 PolarHBondContact OG-O 3.45Å
120K68.5Low70.1Confident99 Ų9972.2 Ų72.243%0.4337%0.37SS..  trans-14974.1-176.7-67.9176.2-177.8156.30111.4G116 K122 N123 A124 T226G116-K120 PolarHBondContact O-N 3.19Å; K120-K122 VanDerWaalsContact C-N 3.27Å; K120-K122 PolarHBondContact O-N 3.14Å; K120-N123 HydrophobicContact CB-CB 3.93Å; K120-N123 HydrophobicContact CD-CB 4.26Å; K120-N123 PolarHBondContact O-N 2.92Å; K120-N123 VanDerWaalsContact O-N 3.12Å; K120-A124 WeakPolarHBondContact O-CB 3.39Å; K120-A124 PolarHBondContact O-N 3.43Å; K120-T226 WeakPolarHBondContact CE-O 3.35Å; K120-T226 PolarHBondContact NZ-O 3.41Å
121I63.3Low68.9Low110 Ų11080.6 Ų80.656%0.56441%0.405SS*.Hα-helixtrans-47.4-48.9176.9-60.1171.1000111.6F117 N123 L125F117-I121 WeakPolarHBondContact O-CG1 3.48Å; I121-N123 PolarHBondContact O-N 3.5Å; I121-L125 HydrophobicContact CG2-CD1 3.78Å; I121-L125 WeakPolarHBondContact O-CD1 3.35Å; I121-L125 PolarHBondContact O-N 2.93Å
122K61Low67.8Low190 Ų19083.6 Ų83.683%0.82644%0.435SS*.Hα-helixtrans-65.9-37.3-176-64.4-175.1-179.6-177.10113.5K120 A126K120-K122 VanDerWaalsContact C-N 3.27Å; K120-K122 PolarHBondContact O-N 3.14Å; K122-A126 VanDerWaalsContact O-CB 3.29Å; K122-A126 WeakPolarHBondContact O-CB 3.27Å; K122-A126 PolarHBondContact O-N 3Å
123N64.8Low67.2Low105 Ų10585 Ų8556%0.56144%0.444SS*.Hα-helixtrans-80.1-35.6-177.7-143.760.7000111.3K120 I121 A126 H127K120-N123 HydrophobicContact CB-CB 3.93Å; K120-N123 HydrophobicContact CD-CB 4.26Å; K120-N123 PolarHBondContact O-N 2.92Å; K120-N123 VanDerWaalsContact O-N 3.12Å; I121-N123 PolarHBondContact O-N 3.5Å; N123-A126 PolarHBondContact O-N 3.37Å; N123-H127 PolarHBondContact O-N 3.17Å; N123-H127 VanDerWaalsContact O-N 3.12Å
124A61.7Low66.7Low18 Ų1887.8 Ų87.815%0.14946%0.462CS..Hα-helixtrans-63.2-42.8172.600000111.5F117 K120 H127F117-A124 HydrophobicContact CD1-CB 4.38Å; F117-A124 HydrophobicContact CE1-CB 4.47Å; K120-A124 WeakPolarHBondContact O-CB 3.39Å; K120-A124 PolarHBondContact O-N 3.43Å; A124-H127 PolarHBondContact O-N 2.85Å
125L61.3Low66.4Low95 Ų9588.8 Ų88.850%0.49747%0.473SS..Hα-helixtrans-70-32.1174.4-87.584000112.8F117 I121 H127 F128F117-L125 HydrophobicContact CD1-CD1 4.2Å; F117-L125 HydrophobicContact CE1-CD1 3.81Å; I121-L125 HydrophobicContact CG2-CD1 3.78Å; I121-L125 WeakPolarHBondContact O-CD1 3.35Å; I121-L125 PolarHBondContact O-N 2.93Å; L125-H127 VanDerWaalsContact C-N 3.27Å; L125-H127 PolarHBondContact O-N 3.26Å; L125-F128 PolarHBondContact O-N 3.05Å
126A61Low66.5Low53 Ų5391.4 Ų91.444%0.43849%0.494SS..Hα-helixtrans-67.8-27.1176.400000112.6K122 N123 F128 L129K122-A126 VanDerWaalsContact O-CB 3.29Å; K122-A126 WeakPolarHBondContact O-CB 3.27Å; K122-A126 PolarHBondContact O-N 3Å; N123-A126 PolarHBondContact O-N 3.37Å; A126-F128 PolarHBondContact O-N 3.21Å; A126-L129 PolarHBondContact O-N 3.29Å
127H63.1Low66.7Low112 Ų11296.4 Ų96.452%0.51952%0.52SS..THydrogen-bonded Turntrans-67.5-19.3176.1-156-62.8000113N123 A124 L125 L129N123-H127 PolarHBondContact O-N 3.17Å; N123-H127 VanDerWaalsContact O-N 3.12Å; A124-H127 PolarHBondContact O-N 2.85Å; L125-H127 VanDerWaalsContact C-N 3.27Å; L125-H127 PolarHBondContact O-N 3.26Å; H127-L129 PolarHBondContact O-N 3.2Å
128F60.7Low66.8Low39 Ų3994.9 Ų94.917%0.17152%0.515CS..THydrogen-bonded Turntrans-70.1-11.1171.6-68.7-57.6000113.3F117 L125 A126 E145 T146 L149F117-F128 HydrophobicContact CZ-CE2 4.46Å; L125-F128 PolarHBondContact O-N 3.05Å; A126-F128 PolarHBondContact O-N 3.21Å; F128-E145 HydrophobicContact CD1-CB 4.25Å; F128-E145 HydrophobicContact CD1-CG 3.88Å; F128-T146 HydrophobicContact CD1-CG2 4.19Å; F128-T146 HydrophobicContact CE1-CG2 3.97Å; F128-T146 HydrophobicContact CZ-CG2 4.47Å; F128-L149 HydrophobicContact CE1-CD1 4.41Å
129L58.8Low67Low61 Ų6188.6 Ų88.632%0.31950%0.502SS..SBendtrans-129.6108.2-178.8-139.677000111.7A126 H127 Q131 I138 V142A126-L129 PolarHBondContact O-N 3.29Å; H127-L129 PolarHBondContact O-N 3.2Å; L129-Q131 PolarHBondContact O-N 3.35Å; L129-I138 HydrophobicContact CD1-CB 4.42Å; L129-I138 HydrophobicContact CD1-CG2 3.75Å; L129-I138 HydrophobicContact CD2-CD1 4.21Å; L129-I138 HydrophobicContact CD2-CG1 4.28Å; L129-I138 HydrophobicContact CD2-CG2 4.18Å; L129-V142 HydrophobicContact CD1-CG2 3.5Å; L129-V142 VanDerWaalsContact CD1-CG2 3.5Å
130P59.7Low67.7Low69 Ų6991.8 Ų91.845%0.44851%0.513SS..  trans-62.8138.417220.4-22.4000109.6G132 T133 L141P130-G132 PolarHBondContact O-N 3.29Å; P130-T133 HydrophobicContact CB-CG2 4.49Å; P130-T133 HydrophobicContact CG-CG2 3.73Å; P130-T133 WeakPolarHBondContact O-CG2 3.28Å; P130-L141 HydrophobicContact CG-CD1 3.78Å; P130-L141 HydrophobicContact CG-CD2 3.87Å; P130-L141 HydrophobicContact CG-CG 4.5Å
131Q60.3Low68.4Low204 Ų20489.3 Ų89.395%0.95350%0.504SS*.THydrogen-bonded Turntrans-64.9128.8-177.2-62.6-161.5-1.100110.5L129L129-Q131 PolarHBondContact O-N 3.35Å
132G61.3Low69.3Low83 Ų8386.4 Ų86.486%0.85649%0.491SS*.THydrogen-bonded Turntrans99.112.2175.500000116.2P130P130-G132 PolarHBondContact O-N 3.29Å
133T69.2Low70.4Confident33 Ų3381.7 Ų81.720%0.20247%0.474CS..  trans-72.2134.5176.253.70000112.4P130 L141P130-T133 HydrophobicContact CB-CG2 4.49Å; P130-T133 HydrophobicContact CG-CG2 3.73Å; P130-T133 WeakPolarHBondContact O-CG2 3.28Å; T133-L141 HydrophobicContact CG2-CD1 3.83Å
134P72.3Confident71.3Confident75 Ų7581 Ų8149%0.48747%0.47SS..  trans-65.4140.5176.328.7-34.7000110.8P136 L137P134-P136 VanDerWaalsContact C-N 3.35Å; P134-P136 WeakPolarHBondContact O-CD 3.23Å; P134-P136 VanDerWaalsContact O-N 3.1Å; P134-L137 HydrophobicContact CG-CB 4.44Å; P134-L137 HydrophobicContact CG-CD1 3.75Å; P134-L137 HydrophobicContact CG-CG 4.23Å; P134-L137 PolarHBondContact O-N 3.27Å
135T75Confident72.4Confident121 Ų12183 Ų8374%0.74248%0.476SS*.THydrogen-bonded Turntrans-49.2-34.7-171.348.70000117I138T135-I138 HydrophobicContact CG2-CD1 4.47Å
136P81.3Confident73.3Confident104 Ų10481 Ų8168%0.67547%0.468SS*.THydrogen-bonded Turntrans-76.3-21.8178.828.1-35.7000114.7P134 P139P134-P136 VanDerWaalsContact C-N 3.35Å; P134-P136 WeakPolarHBondContact O-CD 3.23Å; P134-P136 VanDerWaalsContact O-N 3.1Å; P136-P139 WeakPolarHBondContact O-CD 2.97Å
137L79.2Confident74.4Confident105 Ų10582.4 Ų82.455%0.5547%0.467SS..THydrogen-bonded Turntrans-87.7-11.3-177.7-66.4177.1000113.3P134 M140 L141P134-L137 HydrophobicContact CG-CB 4.44Å; P134-L137 HydrophobicContact CG-CD1 3.75Å; P134-L137 HydrophobicContact CG-CG 4.23Å; P134-L137 PolarHBondContact O-N 3.27Å; L137-M140 PolarHBondContact O-N 2.88Å; L137-L141 PolarHBondContact O-N 3Å; L137-L141 VanDerWaalsContact O-N 3.13Å
138I78.6Confident75.4Confident51 Ų5179.6 Ų79.626%0.26246%0.46SS..Hα-helixtrans-53.6-49.8-177.3-68.2178.1000112.4L129 T135 M140 L141 V142L129-I138 HydrophobicContact CD1-CB 4.42Å; L129-I138 HydrophobicContact CD1-CG2 3.75Å; L129-I138 HydrophobicContact CD2-CD1 4.21Å; L129-I138 HydrophobicContact CD2-CG1 4.28Å; L129-I138 HydrophobicContact CD2-CG2 4.18Å; T135-I138 HydrophobicContact CG2-CD1 4.47Å; I138-M140 VanDerWaalsContact C-N 3.35Å; I138-M140 PolarHBondContact O-N 2.99Å; I138-L141 PolarHBondContact O-N 2.72Å; I138-V142 WeakPolarHBondContact O-CG2 3.28Å; I138-V142 PolarHBondContact O-N 3.06Å; I138-V142 VanDerWaalsContact O-N 3.16Å
139P78.7Confident76.4Confident84 Ų8479.9 Ų79.955%0.54546%0.463SS..Hα-helixtrans-65.8-37.2-174.8-20.333.5000113P136 I143P136-P139 WeakPolarHBondContact O-CD 2.97Å; P139-I143 WeakPolarHBondContact O-CG1 3.07Å; P139-I143 PolarHBondContact O-N 3.01Å
140M82.4Confident77.4Confident117 Ų11782.1 Ų82.158%0.57647%0.474SS*.Hα-helixtrans-69.6-40.5179.4-173.763.5-172.500111.4L137 I138 I143 I144L137-M140 PolarHBondContact O-N 2.88Å; I138-M140 VanDerWaalsContact C-N 3.35Å; I138-M140 PolarHBondContact O-N 2.99Å; M140-I143 PolarHBondContact O-N 3.1Å; M140-I144 HydrophobicContact CE-CD1 3.98Å; M140-I144 HydrophobicContact CE-CG1 4.18Å; M140-I144 HydrophobicContact CG-CD1 4.12Å; M140-I144 WeakPolarHBondContact O-CG1 3.35Å; M140-I144 PolarHBondContact O-N 2.95Å; M140-I144 VanDerWaalsContact O-N 3.11Å
141L83.9Confident78.6Confident46 Ų4683.6 Ų83.624%0.24148%0.478CS..Hα-helixtrans-67.1-41.3-178.5-165.9152.3000111.8P130 T133 L137 I138 I143 I144 E145P130-L141 HydrophobicContact CG-CD1 3.78Å; P130-L141 HydrophobicContact CG-CD2 3.87Å; P130-L141 HydrophobicContact CG-CG 4.5Å; T133-L141 HydrophobicContact CG2-CD1 3.83Å; L137-L141 PolarHBondContact O-N 3Å; L137-L141 VanDerWaalsContact O-N 3.13Å; I138-L141 PolarHBondContact O-N 2.72Å; L141-I143 VanDerWaalsContact C-N 3.29Å; L141-I143 PolarHBondContact O-N 2.97Å; L141-I144 PolarHBondContact O-N 3.44Å; L141-E145 PolarHBondContact O-N 3.3Å
142V80.3Confident79.7Confident49 Ų4977.2 Ų77.230%0.29745%0.448SS..Hα-helixtrans-58.9-42.7175.6174.30000111L129 I138 I144 E145 T146L129-V142 HydrophobicContact CD1-CG2 3.5Å; L129-V142 VanDerWaalsContact CD1-CG2 3.5Å; I138-V142 WeakPolarHBondContact O-CG2 3.28Å; I138-V142 PolarHBondContact O-N 3.06Å; I138-V142 VanDerWaalsContact O-N 3.16Å; V142-I144 PolarHBondContact O-N 2.91Å; V142-E145 PolarHBondContact O-N 3.39Å; V142-T146 HydrophobicContact CG1-CG2 4.39Å; V142-T146 VanDerWaalsContact O-CG2 3.29Å; V142-T146 WeakPolarHBondContact O-CG2 3.21Å; V142-T146 PolarHBondContact O-N 3.36Å; V142-T146 PolarHBondContact O-OG1 2.96Å
143I84.3Confident80.5Confident91 Ų9173.8 Ų73.847%0.46741%0.41SS..Hα-helixtrans-61-47.7177-66.8167.3000110.4P139 M140 L141 E145 T146 I147P139-I143 WeakPolarHBondContact O-CG1 3.07Å; P139-I143 PolarHBondContact O-N 3.01Å; M140-I143 PolarHBondContact O-N 3.1Å; L141-I143 VanDerWaalsContact C-N 3.29Å; L141-I143 PolarHBondContact O-N 2.97Å; I143-E145 VanDerWaalsContact C-N 3.34Å; I143-E145 PolarHBondContact O-N 3.07Å; I143-T146 PolarHBondContact O-N 3.34Å; I143-T146 PolarHBondContact O-OG1 3.44Å; I143-I147 HydrophobicContact CG2-CD1 3.77Å; I143-I147 VanDerWaalsContact O-CG1 3.3Å; I143-I147 WeakPolarHBondContact O-CG1 3.29Å; I143-I147 PolarHBondContact O-N 3.27Å
144I85.1Confident81.1Confident91 Ų9176.5 Ų76.547%0.46742%0.422SS..Hα-helixtrans-61.8-43.2179.8-64.7165.8000111.1M140 L141 V142 I147 S148M140-I144 HydrophobicContact CE-CD1 3.98Å; M140-I144 HydrophobicContact CE-CG1 4.18Å; M140-I144 HydrophobicContact CG-CD1 4.12Å; M140-I144 WeakPolarHBondContact O-CG1 3.35Å; M140-I144 PolarHBondContact O-N 2.95Å; M140-I144 VanDerWaalsContact O-N 3.11Å; L141-I144 PolarHBondContact O-N 3.44Å; V142-I144 PolarHBondContact O-N 2.91Å; I144-I147 PolarHBondContact O-N 3.08Å; I144-S148 WeakPolarHBondContact O-CB 3.44Å; I144-S148 PolarHBondContact O-N 2.94Å
145E83.1Confident81.7Confident61 Ų6174.9 Ų74.929%0.28542%0.415SS..Hα-helixtrans-66.7-40.1-179.6-16661.1-157.600111.6F128 L141 V142 I143 I147 S148 L149F128-E145 HydrophobicContact CD1-CB 4.25Å; F128-E145 HydrophobicContact CD1-CG 3.88Å; L141-E145 PolarHBondContact O-N 3.3Å; V142-E145 PolarHBondContact O-N 3.39Å; I143-E145 VanDerWaalsContact C-N 3.34Å; I143-E145 PolarHBondContact O-N 3.07Å; E145-I147 VanDerWaalsContact C-N 3.31Å; E145-I147 PolarHBondContact O-N 2.81Å; E145-S148 WeakPolarHBondContact O-CB 3.12Å; E145-S148 PolarHBondContact O-N 2.98Å; E145-L149 WeakPolarHBondContact O-CB 3.28Å; E145-L149 PolarHBondContact O-N 2.75Å
146T80.7Confident81.9Confident52 Ų5269.3 Ų69.332%0.31938%0.38SS..Hα-helixtrans-62.4-38.2173.759.20000112.5F128 V142 I143 L150F128-T146 HydrophobicContact CD1-CG2 4.19Å; F128-T146 HydrophobicContact CE1-CG2 3.97Å; F128-T146 HydrophobicContact CZ-CG2 4.47Å; V142-T146 HydrophobicContact CG1-CG2 4.39Å; V142-T146 VanDerWaalsContact O-CG2 3.29Å; V142-T146 WeakPolarHBondContact O-CG2 3.21Å; V142-T146 PolarHBondContact O-N 3.36Å; V142-T146 PolarHBondContact O-OG1 2.96Å; I143-T146 PolarHBondContact O-N 3.34Å; I143-T146 PolarHBondContact O-OG1 3.44Å; T146-L150 WeakPolarHBondContact O-CG 3.33Å; T146-L150 PolarHBondContact O-N 2.93Å
147I84.8Confident82Confident83 Ų8364.4 Ų64.443%0.42635%0.348SS..Hα-helixtrans-68.5-43.5175.5-67.5167.1000110.6I143 I144 E145 L149 L150 I151I143-I147 HydrophobicContact CG2-CD1 3.77Å; I143-I147 VanDerWaalsContact O-CG1 3.3Å; I143-I147 WeakPolarHBondContact O-CG1 3.29Å; I143-I147 PolarHBondContact O-N 3.27Å; I144-I147 PolarHBondContact O-N 3.08Å; E145-I147 VanDerWaalsContact C-N 3.31Å; E145-I147 PolarHBondContact O-N 2.81Å; I147-L149 VanDerWaalsContact C-N 3.33Å; I147-L149 PolarHBondContact O-N 3.05Å; I147-L150 PolarHBondContact O-N 3.35Å; I147-L150 VanDerWaalsContact O-N 3.16Å; I147-I151 HydrophobicContact CG2-CD1 3.49Å; I147-I151 VanDerWaalsContact CG2-CD1 3.49Å; I147-I151 HydrophobicContact CG2-CG1 4.16Å; I147-I151 WeakPolarHBondContact O-CG1 3.49Å; I147-I151 PolarHBondContact O-N 3.46Å
148S83Confident82.3Confident52 Ų5262.3 Ų62.336%0.36434%0.34SS..Hα-helixtrans-57-46.3177.3-176.40000111.7I144 E145 L150 I151 Q152I144-S148 WeakPolarHBondContact O-CB 3.44Å; I144-S148 PolarHBondContact O-N 2.94Å; E145-S148 WeakPolarHBondContact O-CB 3.12Å; E145-S148 PolarHBondContact O-N 2.98Å; S148-L150 VanDerWaalsContact C-N 3.29Å; S148-L150 PolarHBondContact O-N 3.16Å; S148-I151 PolarHBondContact O-N 3.43Å; S148-Q152 PolarHBondContact O-N 3.47Å; S148-Q152 VanDerWaalsContact O-N 3.13Å
149L81.6Confident82.7Confident45 Ų4564.6 Ų64.624%0.23635%0.345CS..Hα-helixtrans-61.3-35.5177.9-174123.8000112.3W109 F128 E145 I147 P153W109-L149 HydrophobicContact CH2-CD2 4.16Å; W109-L149 HydrophobicContact CZ2-CD2 3.45Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.45Å; W109-L149 HydrophobicContact CZ2-CG 3.95Å; W109-L149 VanDerWaalsContact CZ2-O 3.31Å; W109-L149 WeakPolarHBondContact CZ2-O 3.45Å; W109-L149 PolarHBondContact NE1-O 3.11Å; F128-L149 HydrophobicContact CE1-CD1 4.41Å; E145-L149 WeakPolarHBondContact O-CB 3.28Å; E145-L149 PolarHBondContact O-N 2.75Å; I147-L149 VanDerWaalsContact C-N 3.33Å; I147-L149 PolarHBondContact O-N 3.05Å; L149-P153 WeakPolarHBondContact O-CD 3.48Å
150L81.6Confident82.8Confident108 Ų10860.6 Ų60.657%0.56532%0.319SS*.Hα-helixtrans-77.9-34.8176.7-71.7173.7000113.6W109 T146 I147 S148 P153W109-L150 HydrophobicContact CH2-CD2 3.74Å; W109-L150 HydrophobicContact CZ2-CD2 4.24Å; T146-L150 WeakPolarHBondContact O-CG 3.33Å; T146-L150 PolarHBondContact O-N 2.93Å; I147-L150 PolarHBondContact O-N 3.35Å; I147-L150 VanDerWaalsContact O-N 3.16Å; S148-L150 VanDerWaalsContact C-N 3.29Å; S148-L150 PolarHBondContact O-N 3.16Å; L150-P153 WeakPolarHBondContact O-CD 3.13Å; L150-P153 WeakPolarHBondContact O-CG 3.37Å
151I84.6Confident82.9Confident100 Ų10055.7 Ų55.751%0.51330%0.296SS..Hα-helixtrans-72.9-30.9-179.4-69.6173.2000111.3I147 S148 M154 A155I147-I151 HydrophobicContact CG2-CD1 3.49Å; I147-I151 VanDerWaalsContact CG2-CD1 3.49Å; I147-I151 HydrophobicContact CG2-CG1 4.16Å; I147-I151 WeakPolarHBondContact O-CG1 3.49Å; I147-I151 PolarHBondContact O-N 3.46Å; S148-I151 PolarHBondContact O-N 3.43Å; I151-M154 WeakPolarHBondContact O-CB 3.42Å; I151-M154 PolarHBondContact O-N 3.44Å; I151-M154 VanDerWaalsContact O-N 3.13Å; I151-A155 HydrophobicContact CG2-CB 4.42Å; I151-A155 WeakPolarHBondContact O-CB 3.43Å; I151-A155 PolarHBondContact O-N 3.33Å
152Q82.3Confident82.9Confident70 Ų7055.4 Ų55.433%0.32730%0.3SS..Hα-helixtrans-50.8-53.4-178-108175.1-14.400116.1S148 M154 A155 L156 Y221S148-Q152 PolarHBondContact O-N 3.47Å; S148-Q152 VanDerWaalsContact O-N 3.13Å; Q152-M154 VanDerWaalsContact C-N 3.27Å; Q152-M154 PolarHBondContact O-N 2.9Å; Q152-A155 PolarHBondContact O-N 3.18Å; Q152-L156 WeakPolarHBondContact O-CB 3.4Å; Q152-L156 PolarHBondContact O-N 3.01Å; Q152-Y221 HydrophobicContact CG-CE1 4.37Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.43Å; Q152-Y221 VanDerWaalsContact NE2-CE1 3.31Å; Q152-Y221 PolarHBondContact NE2-OH 3.38Å; Q152-Y221 PolarHBondContact OE1-OH 2.88Å
153P78.1Confident83.3Confident11 Ų1156.1 Ų56.17%0.07130%0.302CS..Hα-helixtrans-64.4-34.4178.624-34.5000112.1W109 L149 L150 L156 A157W109-P153 HydrophobicContact CB-CB 3.92Å; W109-P153 HydrophobicContact CB-CG 4.39Å; W109-P153 HydrophobicContact CD2-CB 4.34Å; W109-P153 HydrophobicContact CD2-CG 3.83Å; W109-P153 HydrophobicContact CE3-CG 4.38Å; W109-P153 HydrophobicContact CG-CB 3.86Å; W109-P153 HydrophobicContact CG-CG 3.81Å; L149-P153 WeakPolarHBondContact O-CD 3.48Å; L150-P153 WeakPolarHBondContact O-CD 3.13Å; L150-P153 WeakPolarHBondContact O-CG 3.37Å; P153-L156 PolarHBondContact O-N 2.97Å; P153-A157 PolarHBondContact O-N 3.49Å; P153-A157 VanDerWaalsContact O-N 3.14Å
154M82.9Confident83.3Confident91 Ų9152.4 Ų52.445%0.44828%0.283SS..Hα-helixtrans-65.8-46.9175.2-163.9105-169.900110.9L102 I151 Q152 L156 A157 V158L102-M154 HydrophobicContact CD1-CE 4.43Å; L102-M154 HydrophobicContact CD1-CG 4.49Å; L102-M154 HydrophobicContact CD1-SD 3.96Å; I151-M154 WeakPolarHBondContact O-CB 3.42Å; I151-M154 PolarHBondContact O-N 3.44Å; I151-M154 VanDerWaalsContact O-N 3.13Å; Q152-M154 VanDerWaalsContact C-N 3.27Å; Q152-M154 PolarHBondContact O-N 2.9Å; M154-L156 VanDerWaalsContact C-N 3.28Å; M154-L156 PolarHBondContact O-N 3Å; M154-A157 PolarHBondContact O-N 3.16Å; M154-V158 VanDerWaalsContact O-CG2 3.3Å; M154-V158 WeakPolarHBondContact O-CG2 3.29Å; M154-V158 PolarHBondContact O-N 2.87Å
155A84.4Confident83.4Confident40 Ų4049.9 Ų49.933%0.33127%0.272SS..Hα-helixtrans-61.9-37.117900000111.8I151 Q152 R159I151-A155 HydrophobicContact CG2-CB 4.42Å; I151-A155 WeakPolarHBondContact O-CB 3.43Å; I151-A155 PolarHBondContact O-N 3.33Å; Q152-A155 PolarHBondContact O-N 3.18Å; A155-R159 VanDerWaalsContact O-CB 3.31Å; A155-R159 WeakPolarHBondContact O-CB 3.05Å; A155-R159 PolarHBondContact O-N 3.49Å
156L79.2Confident83.6Confident5 Ų549.6 Ų49.63%0.02628%0.28CS..Hα-helixtrans-63.4-48175.3-167.179.1000111.9Q152 P153 M154 R159 L160 F214 L217 V218Q152-L156 WeakPolarHBondContact O-CB 3.4Å; Q152-L156 PolarHBondContact O-N 3.01Å; P153-L156 PolarHBondContact O-N 2.97Å; M154-L156 VanDerWaalsContact C-N 3.28Å; M154-L156 PolarHBondContact O-N 3Å; L156-R159 PolarHBondContact O-N 3.09Å; L156-L160 PolarHBondContact O-N 3.42Å; L156-F214 HydrophobicContact CD1-CD2 4.07Å; L156-F214 HydrophobicContact CD1-CG 4.45Å; L156-F214 HydrophobicContact CD2-CD1 4.13Å; L156-F214 HydrophobicContact CD2-CD2 3.27Å; L156-F214 HydrophobicContact CD2-CE1 4.05Å; L156-F214 HydrophobicContact CD2-CE2 3.17Å; L156-F214 HydrophobicContact CD2-CG 3.75Å; L156-F214 HydrophobicContact CD2-CZ 3.59Å; L156-F214 HydrophobicContact CG-CD2 3.39Å; L156-F214 HydrophobicContact CG-CE2 3.6Å; L156-F214 HydrophobicContact CG-CG 4.13Å; L156-F214 HydrophobicContact CG-CZ 4.47Å; L156-L217 HydrophobicContact CD1-CB 4.17Å; L156-L217 HydrophobicContact CD1-CD1 3.42Å; L156-L217 VanDerWaalsContact CD1-CD1 3.42Å; L156-L217 HydrophobicContact CD1-CG 4.42Å; L156-V218 HydrophobicContact CD2-CG2 4.34Å
157A82.6Confident83.9Confident0 Ų047.6 Ų47.60%027%0.27CS..Hα-helixtrans-63.3-44.5179.200000112L98 N101 L102 A105 P153 M154 R159 L160 T161L98-A157 HydrophobicContact CD1-CB 4.32Å; N101-A157 HydrophobicContact CB-CB 3.9Å; N101-A157 PolarHBondContact ND2-O 3.05Å; L102-A157 HydrophobicContact CB-CB 4.46Å; L102-A157 HydrophobicContact CD1-CB 3.81Å; A105-A157 HydrophobicContact CB-CB 4.25Å; P153-A157 PolarHBondContact O-N 3.49Å; P153-A157 VanDerWaalsContact O-N 3.14Å; M154-A157 PolarHBondContact O-N 3.16Å; A157-R159 VanDerWaalsContact C-N 3.35Å; A157-R159 PolarHBondContact O-N 3.27Å; A157-L160 PolarHBondContact O-N 2.99Å; A157-T161 PolarHBondContact O-N 2.89Å; A157-T161 VanDerWaalsContact O-N 3.11Å; A157-T161 PolarHBondContact O-OG1 3.11Å
158V86.2Confident84Confident62 Ų6245.1 Ų45.138%0.37626%0.257SS..Hα-helixtrans-64.6-38.2177.6172.80000111.5L98 M154 L160 T161 A162L98-V158 HydrophobicContact CD1-CG2 3.88Å; M154-V158 VanDerWaalsContact O-CG2 3.3Å; M154-V158 WeakPolarHBondContact O-CG2 3.29Å; M154-V158 PolarHBondContact O-N 2.87Å; V158-L160 VanDerWaalsContact C-N 3.31Å; V158-L160 PolarHBondContact O-N 3.37Å; V158-T161 WeakPolarHBondContact CA-OG1 3.22Å; V158-T161 PolarHBondContact O-N 3.39Å; V158-T161 PolarHBondContact O-OG1 3.14Å; V158-A162 WeakPolarHBondContact O-CB 3.36Å; V158-A162 PolarHBondContact O-N 3.38Å
159R86.6Confident84.3Confident99 Ų9944.5 Ų44.537%0.37425%0.249SC..Hα-helixtrans-61.3-41.9177.3-168.5-172.9-60.1154.92.1111.6A155 L156 A157 N163 Q210A155-R159 VanDerWaalsContact O-CB 3.31Å; A155-R159 WeakPolarHBondContact O-CB 3.05Å; A155-R159 PolarHBondContact O-N 3.49Å; L156-R159 PolarHBondContact O-N 3.09Å; A157-R159 VanDerWaalsContact C-N 3.35Å; A157-R159 PolarHBondContact O-N 3.27Å; R159-N163 WeakPolarHBondContact O-CB 3.3Å; R159-N163 VanDerWaalsContact O-CG 3.25Å; R159-N163 PolarHBondContact O-N 2.83Å; R159-N163 PolarHBondContact O-ND2 2.98Å; R159-Q210 VanDerWaalsContact C-NE2 3.27Å; R159-Q210 VanDerWaalsContact CG-NE2 3.31Å
160L80.9Confident84.7Confident0 Ų046.1 Ų46.10%026%0.257CS..Hα-helixtrans-67.9-44.5179.5-178.667.4000110.8I79 T95 N101 L156 A157 V158 I164 Q210 F214I79-L160 HydrophobicContact CG2-CD1 4.03Å; I79-L160 HydrophobicContact CG2-CD2 4.15Å; T95-L160 HydrophobicContact CG2-CD2 4.42Å; N101-L160 HydrophobicContact CB-CD2 4.4Å; N101-L160 WeakPolarHBondContact ND2-CB 3.44Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.23Å; N101-L160 WeakPolarHBondContact ND2-CG 3.15Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.4Å; L156-L160 PolarHBondContact O-N 3.42Å; A157-L160 PolarHBondContact O-N 2.99Å; V158-L160 VanDerWaalsContact C-N 3.31Å; V158-L160 PolarHBondContact O-N 3.37Å; L160-I164 HydrophobicContact CD1-CD1 3.81Å; L160-I164 HydrophobicContact CG-CD1 4.26Å; L160-I164 WeakPolarHBondContact O-CG1 3.05Å; L160-I164 PolarHBondContact O-N 2.83Å; L160-Q210 VanDerWaalsContact CA-NE2 3.29Å; L160-Q210 HydrophobicContact CB-CG 4.29Å; L160-Q210 HydrophobicContact CD1-CB 4.35Å; L160-Q210 HydrophobicContact CD1-CG 3.38Å; L160-Q210 HydrophobicContact CG-CG 4.42Å; L160-F214 HydrophobicContact CD2-CD2 4.49Å
161T84.6Confident85.1Confident14 Ų1442.4 Ų42.49%0.08624%0.238CC..Hα-helixtrans-64.3-51.1177.650.30000111.5T96 L98 N101 A157 V158 N163 I164 T165T96-T161 WeakPolarHBondContact O-CG2 3.49Å; L98-T161 VanDerWaalsContact CA-CG2 3.44Å; L98-T161 HydrophobicContact CB-CG2 4.02Å; L98-T161 HydrophobicContact CD1-CG2 4Å; N101-T161 HydrophobicContact CB-CG2 4.29Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.27Å; N101-T161 PolarHBondContact ND2-N 2.85Å; A157-T161 PolarHBondContact O-N 2.89Å; A157-T161 VanDerWaalsContact O-N 3.11Å; A157-T161 PolarHBondContact O-OG1 3.11Å; V158-T161 WeakPolarHBondContact CA-OG1 3.22Å; V158-T161 PolarHBondContact O-N 3.39Å; V158-T161 PolarHBondContact O-OG1 3.14Å; T161-N163 VanDerWaalsContact C-N 3.33Å; T161-N163 PolarHBondContact O-N 3.32Å; T161-I164 PolarHBondContact O-N 3.46Å; T161-T165 WeakPolarHBondContact O-CB 3.37Å; T161-T165 WeakPolarHBondContact O-CG2 3.39Å; T161-T165 PolarHBondContact O-N 3.08Å; T161-T165 PolarHBondContact O-OG1 3.01Å
162A84.5Confident85.3Confident40 Ų4041.1 Ų41.133%0.33123%0.229SC..Hα-helixtrans-60.5-44-171.100000111.5V158 I164 T165 A166V158-A162 WeakPolarHBondContact O-CB 3.36Å; V158-A162 PolarHBondContact O-N 3.38Å; A162-I164 PolarHBondContact O-N 3.16Å; A162-T165 WeakPolarHBondContact CA-OG1 3.32Å; A162-T165 PolarHBondContact O-OG1 3.43Å; A162-T165 VanDerWaalsContact O-OG1 3.12Å; A162-A166 WeakPolarHBondContact O-CB 3.25Å; A162-A166 PolarHBondContact O-N 3.05Å
163N87.8Confident85.6Confident64 Ų6442 Ų4234%0.34224%0.236SC..Hα-helixtrans-64.7-42.1-178.9-71.1-7.6000111.9R159 T161 G167 V206R159-N163 WeakPolarHBondContact O-CB 3.3Å; R159-N163 VanDerWaalsContact O-CG 3.25Å; R159-N163 PolarHBondContact O-N 2.83Å; R159-N163 PolarHBondContact O-ND2 2.98Å; T161-N163 VanDerWaalsContact C-N 3.33Å; T161-N163 PolarHBondContact O-N 3.32Å; N163-G167 PolarHBondContact O-N 2.81Å; N163-G167 VanDerWaalsContact O-N 3.09Å; N163-V206 HydrophobicContact CB-CG1 4.07Å
164I84.8Confident86.2Confident12 Ų1243 Ų436%0.06224%0.24CC..Hα-helixtrans-76.3-40.3-178.5-59.3173.9000110.8N83 T93 T95 T96 L160 T161 A162 H168N83-I164 HydrophobicContact CB-CD1 4.25Å; N83-I164 VanDerWaalsContact CG-CD1 3.41Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.21Å; T93-I164 HydrophobicContact CG2-CG2 4.26Å; T95-I164 VanDerWaalsContact OG1-CD1 3.28Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.33Å; T96-I164 HydrophobicContact CG2-CB 4.28Å; T96-I164 HydrophobicContact CG2-CG2 3.62Å; L160-I164 HydrophobicContact CD1-CD1 3.81Å; L160-I164 HydrophobicContact CG-CD1 4.26Å; L160-I164 WeakPolarHBondContact O-CG1 3.05Å; L160-I164 PolarHBondContact O-N 2.83Å; T161-I164 PolarHBondContact O-N 3.46Å; A162-I164 PolarHBondContact O-N 3.16Å; I164-H168 WeakPolarHBondContact O-CB 3.4Å; I164-H168 PolarHBondContact O-CD2 2.97Å; I164-H168 PolarHBondContact O-N 3.37Å; I164-H168 VanDerWaalsContact O-N 3.16Å
165T87.4Confident86.5Confident39 Ų3939.8 Ų39.824%0.23923%0.23CC..Hα-helixtrans-66.3-43.5176.954.70000111.8F9 T96 T161 A162 L169F9-T165 HydrophobicContact CD1-CG2 4.45Å; F9-T165 HydrophobicContact CE1-CG2 4.18Å; T96-T165 HydrophobicContact CG2-CG2 3.76Å; T161-T165 WeakPolarHBondContact O-CB 3.37Å; T161-T165 WeakPolarHBondContact O-CG2 3.39Å; T161-T165 PolarHBondContact O-N 3.08Å; T161-T165 PolarHBondContact O-OG1 3.01Å; A162-T165 WeakPolarHBondContact CA-OG1 3.32Å; A162-T165 PolarHBondContact O-OG1 3.43Å; A162-T165 VanDerWaalsContact O-OG1 3.12Å; T165-L169 WeakPolarHBondContact O-CB 3.46Å; T165-L169 WeakPolarHBondContact O-CG 3.1Å; T165-L169 PolarHBondContact O-N 3.43Å
166A87.1Confident86.7Confident54 Ų5440.5 Ų40.545%0.44623%0.233SC..Hα-helixtrans-68.6-42-178.100000111.1A162 L169 L170A162-A166 WeakPolarHBondContact O-CB 3.25Å; A162-A166 PolarHBondContact O-N 3.05Å; A166-L169 PolarHBondContact O-N 3.13Å; A166-L170 VanDerWaalsContact O-CB 3.29Å; A166-L170 WeakPolarHBondContact O-CB 3.26Å; A166-L170 PolarHBondContact O-N 2.86Å
167G87.5Confident87.2Confident11 Ų1142.2 Ų42.211%0.11325%0.248CC..Hα-helixtrans-60.2-50.7176.600000112.4N163 L169 L170 M171 E203N163-G167 PolarHBondContact O-N 2.81Å; N163-G167 VanDerWaalsContact O-N 3.09Å; G167-L169 PolarHBondContact O-N 3Å; G167-L170 WeakPolarHBondContact O-CB 3.43Å; G167-L170 PolarHBondContact O-N 2.95Å; G167-M171 PolarHBondContact O-N 3.27Å; G167-E203 VanDerWaalsContact C-CD 3.43Å; G167-E203 WeakPolarHBondContact CA-OE1 3.25Å; G167-E203 VanDerWaalsContact CA-OE2 3.25Å; G167-E203 WeakPolarHBondContact CA-OE2 3.46Å
168H87.6Confident87.5Confident30 Ų3043 Ų4314%0.13925%0.253CS..Hα-helixtrans-57.6-43.3175-91.3-90.3000113.8F9 G86 I164 L170 M171 H172 E203F9-H168 HydrophobicContact CE1-CB 4.12Å; F9-H168 HydrophobicContact CZ-CB 3.85Å; G86-H168 PolarHBondContact O-CE1 3.22Å; G86-H168 PolarHBondContact O-NE2 3.31Å; I164-H168 WeakPolarHBondContact O-CB 3.4Å; I164-H168 PolarHBondContact O-CD2 2.97Å; I164-H168 PolarHBondContact O-N 3.37Å; I164-H168 VanDerWaalsContact O-N 3.16Å; H168-L170 VanDerWaalsContact C-N 3.33Å; H168-M171 PolarHBondContact O-N 3.41Å; H168-H172 WeakPolarHBondContact O-CB 3.36Å; H168-H172 PolarHBondContact O-N 3.04Å; H168-E203 IonicContact CD2-OE1 3.65Å; H168-E203 PolarHBondContact N-OE1 3.18Å; H168-E203 VanDerWaalsContact N-OE1 3.08Å
169L87.7Confident87.7Confident39 Ų3946.1 Ų46.120%0.20427%0.267CS..Hα-helixtrans-62.5-41.9175.1-78.4169.9000111.4L5 F6 F9 T165 A166 G167 H172 L173L5-L169 HydrophobicContact CB-CD2 4.25Å; F6-L169 HydrophobicContact CD1-CD2 4.44Å; F6-L169 HydrophobicContact CE1-CD1 4.07Å; F6-L169 HydrophobicContact CE1-CD2 4.09Å; F6-L169 HydrophobicContact CZ-CD2 4.46Å; F9-L169 HydrophobicContact CE2-CD1 4.4Å; F9-L169 HydrophobicContact CE2-CD2 3.72Å; F9-L169 HydrophobicContact CE2-CG 3.76Å; F9-L169 HydrophobicContact CZ-CD2 4.36Å; F9-L169 HydrophobicContact CZ-CG 3.94Å; T165-L169 WeakPolarHBondContact O-CB 3.46Å; T165-L169 WeakPolarHBondContact O-CG 3.1Å; T165-L169 PolarHBondContact O-N 3.43Å; A166-L169 PolarHBondContact O-N 3.13Å; G167-L169 PolarHBondContact O-N 3Å; L169-H172 PolarHBondContact O-N 3.35Å; L169-L173 WeakPolarHBondContact O-CB 3.3Å; L169-L173 VanDerWaalsContact O-CG 3.3Å; L169-L173 WeakPolarHBondContact O-CG 3.44Å; L169-L173 PolarHBondContact O-N 3.47Å
170L89.8Confident87.7Confident79 Ų7943.8 Ų43.841%0.41427%0.268SS..Hα-helixtrans-67.2-43-179.6-152.3158.6000110.9A166 G167 H168 H172 L173 I174 L199A166-L170 VanDerWaalsContact O-CB 3.29Å; A166-L170 WeakPolarHBondContact O-CB 3.26Å; A166-L170 PolarHBondContact O-N 2.86Å; G167-L170 WeakPolarHBondContact O-CB 3.43Å; G167-L170 PolarHBondContact O-N 2.95Å; H168-L170 VanDerWaalsContact C-N 3.33Å; L170-H172 VanDerWaalsContact C-N 3.33Å; L170-H172 PolarHBondContact O-N 3Å; L170-L173 PolarHBondContact O-N 3.07Å; L170-I174 HydrophobicContact CD2-CD1 3.41Å; L170-I174 VanDerWaalsContact CD2-CD1 3.41Å; L170-I174 HydrophobicContact CD2-CG1 3.95Å; L170-I174 WeakPolarHBondContact O-CG1 3.38Å; L170-I174 PolarHBondContact O-N 2.73Å; L170-L199 HydrophobicContact CB-CD2 4.26Å; L170-L199 HydrophobicContact CD2-CD1 3.77Å; L170-L199 HydrophobicContact CD2-CD2 3.29Å; L170-L199 HydrophobicContact CD2-CG 4.15Å; L170-L199 HydrophobicContact CG-CD2 4.34Å
171M90.3Very high88Confident31 Ų3146.8 Ų46.815%0.15328%0.283CS..Hα-helixtrans-58.1-43.8172.4-74.4-168.6-66.900111.7L87 G167 H168 G175 L199 T200 E203L87-M171 HydrophobicContact CD2-CE 4.05Å; G167-M171 PolarHBondContact O-N 3.27Å; H168-M171 PolarHBondContact O-N 3.41Å; M171-G175 PolarHBondContact O-N 3.26Å; M171-L199 HydrophobicContact CB-CD2 4.32Å; M171-L199 HydrophobicContact CG-CD2 3.61Å; M171-L199 HydrophobicContact CG-CG 4.22Å; M171-T200 HydrophobicContact SD-CG2 3.97Å; M171-E203 VanDerWaalsContact CE-CD 3.44Å; M171-E203 WeakPolarHBondContact CE-OE1 3.42Å; M171-E203 WeakPolarHBondContact CE-OE2 3.3Å; M171-E203 WeakPolarHBondContact CG-OE2 3.34Å; M171-E203 VanDerWaalsContact SD-OE2 3.38Å
172H88.9Confident88.1Confident73 Ų7349 Ų4934%0.33830%0.299SS..Hα-helixtrans-67.6-41.6179-166.3-62.2000112.3L5 H168 L169 L170 G175 S176L5-H172 VanDerWaalsContact CD2-CE1 3.44Å; L5-H172 WeakPolarHBondContact CD2-CE1 3.43Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.23Å; H168-H172 WeakPolarHBondContact O-CB 3.36Å; H168-H172 PolarHBondContact O-N 3.04Å; L169-H172 PolarHBondContact O-N 3.35Å; L170-H172 VanDerWaalsContact C-N 3.33Å; L170-H172 PolarHBondContact O-N 3Å; H172-G175 PolarHBondContact O-N 3.01Å; H172-S176 WeakPolarHBondContact O-CB 3.47Å; H172-S176 PolarHBondContact O-N 3.44Å; H172-S176 PolarHBondContact O-OG 2.83Å
173L89.4Confident88.2Confident88 Ų8852.8 Ų52.846%0.46132%0.318SS..Hα-helixtrans-63.9-48178.1-74.5171.6000111.2L5 L169 L170 G175 S176 A177L5-L173 HydrophobicContact CD1-CD2 3.84Å; L5-L173 HydrophobicContact CD2-CD2 4.4Å; L169-L173 WeakPolarHBondContact O-CB 3.3Å; L169-L173 VanDerWaalsContact O-CG 3.3Å; L169-L173 WeakPolarHBondContact O-CG 3.44Å; L169-L173 PolarHBondContact O-N 3.47Å; L170-L173 PolarHBondContact O-N 3.07Å; L173-G175 VanDerWaalsContact C-N 3.33Å; L173-G175 PolarHBondContact O-N 2.91Å; L173-S176 PolarHBondContact O-N 3.31Å; L173-S176 PolarHBondContact O-OG 3.05Å; L173-A177 WeakPolarHBondContact O-CB 3.44Å; L173-A177 PolarHBondContact O-N 3.08Å
174I90.8Very high88.2Confident32 Ų3254.8 Ų54.816%0.16433%0.328CS..Hα-helixtrans-64.8-39.8176.6-65.1-172.7000110.7L170 S176 A177 T178 I192 I195 L196 L199L170-I174 HydrophobicContact CD2-CD1 3.41Å; L170-I174 VanDerWaalsContact CD2-CD1 3.41Å; L170-I174 HydrophobicContact CD2-CG1 3.95Å; L170-I174 WeakPolarHBondContact O-CG1 3.38Å; L170-I174 PolarHBondContact O-N 2.73Å; I174-S176 PolarHBondContact O-N 3.34Å; I174-A177 CarbonylContact O-C 3.59Å; I174-A177 WeakPolarHBondContact O-CB 3.12Å; I174-A177 PolarHBondContact O-N 2.84Å; I174-A177 VanDerWaalsContact O-N 3.16Å; I174-T178 HydrophobicContact CG2-CG2 4.35Å; I174-T178 WeakPolarHBondContact O-CG2 3.5Å; I174-T178 PolarHBondContact O-N 3.06Å; I174-T178 PolarHBondContact O-OG1 3.44Å; I174-I192 HydrophobicContact CG2-CG2 3.81Å; I174-I195 HydrophobicContact CD1-CG2 4.03Å; I174-L196 HydrophobicContact CB-CD1 4.22Å; I174-L196 HydrophobicContact CG2-CB 3.93Å; I174-L196 HydrophobicContact CG2-CD1 3.99Å; I174-L199 HydrophobicContact CD1-CD2 4.17Å
175G89.4Confident88.4Confident23 Ų2358.8 Ų58.824%0.23735%0.349CS..Hα-helixtrans-61.4-39.117500000113.5M171 H172 L173 A177 T178 L179M171-G175 PolarHBondContact O-N 3.26Å; H172-G175 PolarHBondContact O-N 3.01Å; L173-G175 VanDerWaalsContact C-N 3.33Å; L173-G175 PolarHBondContact O-N 2.91Å; G175-A177 VanDerWaalsContact C-N 3.35Å; G175-T178 PolarHBondContact O-OG1 3.34Å; G175-L179 PolarHBondContact O-N 3.01Å
176S88.6Confident88.4Confident55 Ų5563.8 Ų63.839%0.38537%0.374SS..Hα-helixtrans-68.6-36173.971.20000112H172 L173 I174 L179 A180H172-S176 WeakPolarHBondContact O-CB 3.47Å; H172-S176 PolarHBondContact O-N 3.44Å; H172-S176 PolarHBondContact O-OG 2.83Å; L173-S176 PolarHBondContact O-N 3.31Å; L173-S176 PolarHBondContact O-OG 3.05Å; I174-S176 PolarHBondContact O-N 3.34Å; S176-L179 PolarHBondContact O-N 3.39Å; S176-A180 WeakPolarHBondContact O-CB 3.23Å; S176-A180 PolarHBondContact O-N 3.5Å
177A88.1Confident88.4Confident41 Ų4165.7 Ų65.734%0.33938%0.382SS..Hα-helixtrans-69.1-40.3176.500000112.1L173 I174 G175 L179 A180 M181L173-A177 WeakPolarHBondContact O-CB 3.44Å; L173-A177 PolarHBondContact O-N 3.08Å; I174-A177 CarbonylContact O-C 3.59Å; I174-A177 WeakPolarHBondContact O-CB 3.12Å; I174-A177 PolarHBondContact O-N 2.84Å; I174-A177 VanDerWaalsContact O-N 3.16Å; G175-A177 VanDerWaalsContact C-N 3.35Å; A177-L179 VanDerWaalsContact C-N 3.31Å; A177-L179 PolarHBondContact O-N 3.33Å; A177-A180 PolarHBondContact O-N 3.37Å; A177-M181 WeakPolarHBondContact O-CB 3.25Å; A177-M181 WeakPolarHBondContact O-CG 3.4Å; A177-M181 PolarHBondContact O-N 3.33Å
178T90.2Very high88.4Confident18 Ų1867 Ų6711%0.1139%0.389CS..Hα-helixtrans-62-42.1174.855.60000110.9I174 G175 M181 S182 I192I174-T178 HydrophobicContact CG2-CG2 4.35Å; I174-T178 WeakPolarHBondContact O-CG2 3.5Å; I174-T178 PolarHBondContact O-N 3.06Å; I174-T178 PolarHBondContact O-OG1 3.44Å; G175-T178 PolarHBondContact O-OG1 3.34Å; T178-M181 PolarHBondContact O-N 3.49Å; T178-S182 WeakPolarHBondContact O-CB 3.49Å; T178-S182 PolarHBondContact O-N 3.45Å; T178-I192 HydrophobicContact CG2-CB 3.88Å; T178-I192 HydrophobicContact CG2-CG2 3.37Å
179L89Confident88.6Confident127 Ų12766.7 Ų66.767%0.66539%0.39SS*.Hα-helixtrans-66-43.6179-159.3152.3000111.3G175 S176 A177 M181 S182G175-L179 PolarHBondContact O-N 3.01Å; S176-L179 PolarHBondContact O-N 3.39Å; A177-L179 VanDerWaalsContact C-N 3.31Å; A177-L179 PolarHBondContact O-N 3.33Å; L179-M181 PolarHBondContact O-N 3.31Å; L179-S182 WeakPolarHBondContact O-CB 3.16Å; L179-S182 PolarHBondContact O-N 3.37Å; L179-S182 PolarHBondContact O-OG 3.32Å
180A88Confident88.8Confident49 Ų4970.5 Ų70.541%0.40541%0.41SS..Hα-helixtrans-65.9-35.1175.400000113.5S176 A177 T183S176-A180 WeakPolarHBondContact O-CB 3.23Å; S176-A180 PolarHBondContact O-N 3.5Å; A177-A180 PolarHBondContact O-N 3.37Å; A180-T183 PolarHBondContact O-OG1 3.33Å
181M86.9Confident88.9Confident63 Ų6371.9 Ų71.931%0.3142%0.416SS..Hα-helixtrans-77-24.4178.3-69.5-66.910900112.7A177 T178 L179 T183 I184 N185 T189 I192A177-M181 WeakPolarHBondContact O-CB 3.25Å; A177-M181 WeakPolarHBondContact O-CG 3.4Å; A177-M181 PolarHBondContact O-N 3.33Å; T178-M181 PolarHBondContact O-N 3.49Å; L179-M181 PolarHBondContact O-N 3.31Å; M181-T183 PolarHBondContact O-N 3.26Å; M181-I184 HydrophobicContact CE-CD1 3.57Å; M181-I184 PolarHBondContact O-N 2.89Å; M181-I184 HydrophobicContact SD-CD1 4.34Å; M181-N185 PolarHBondContact O-N 2.87Å; M181-N185 VanDerWaalsContact O-N 3.07Å; M181-T189 PolarHBondContact O-OG1 2.96Å; M181-T189 VanDerWaalsContact O-OG1 3.1Å; M181-I192 HydrophobicContact CB-CD1 4.19Å; M181-I192 HydrophobicContact CG-CD1 3.67Å
182S87.3Confident89Confident61 Ų6172.4 Ų72.443%0.42742%0.419SS..Hα-helixtrans-58.7-30.4179.376.30000112.9T178 L179 T189T178-S182 WeakPolarHBondContact O-CB 3.49Å; T178-S182 PolarHBondContact O-N 3.45Å; L179-S182 WeakPolarHBondContact O-CB 3.16Å; L179-S182 PolarHBondContact O-N 3.37Å; L179-S182 PolarHBondContact O-OG 3.32Å; S182-T189 WeakPolarHBondContact CA-OG1 3.4Å; S182-T189 PolarHBondContact N-OG1 3.45Å
183T86.6Confident89.2Confident119 Ų11973.9 Ų73.973%0.7343%0.425SS*.THydrogen-bonded Turntrans-82.2-15.4178.458.80000113.4A180 M181A180-T183 PolarHBondContact O-OG1 3.33Å; M181-T183 PolarHBondContact O-N 3.26Å
184I87.4Confident89.3Confident107 Ų10773.4 Ų73.455%0.54943%0.425SS..THydrogen-bonded Turntrans-100.3-61-174.2-54.6177.8000110.2M181M181-I184 HydrophobicContact CE-CD1 3.57Å; M181-I184 PolarHBondContact O-N 2.89Å; M181-I184 HydrophobicContact SD-CD1 4.34Å
185N87.9Confident89.5Confident95 Ų9575.8 Ų75.851%0.50844%0.438SS..  trans-145.5123.4-173.1-83-21.9000111.4M181 S188 T189M181-N185 PolarHBondContact O-N 2.87Å; M181-N185 VanDerWaalsContact O-N 3.07Å; N185-S188 VanDerWaalsContact CB-OG 3.25Å; N185-S188 WeakPolarHBondContact CB-OG 3.18Å; N185-S188 PolarHBondContact O-OG 3.41Å; N185-T189 PolarHBondContact O-N 2.97Å; N185-T189 PolarHBondContact O-OG1 2.79Å
186L86.8Confident89.7Confident145 Ų14576.1 Ų76.176%0.75943%0.434SS*.Hα-helixtrans-62.8-45.2177.8-15785.7000114.2S188 T189 L190L186-S188 PolarHBondContact O-N 2.88Å; L186-T189 WeakPolarHBondContact O-CB 3.29Å; L186-T189 PolarHBondContact O-N 2.61Å; L186-L190 PolarHBondContact O-N 3.05Å
187P88.7Confident89.9Confident94 Ų9477.2 Ų77.261%0.6143%0.434SS*.Hα-helixtrans-69.2-36.7-174.924.9-32.8000113T189 L190 I191P187-T189 VanDerWaalsContact C-N 3.33Å; P187-L190 PolarHBondContact O-N 3.34Å; P187-I191 PolarHBondContact O-N 3.43Å
188S87.2Confident90.2Very high39 Ų3980.9 Ų80.927%0.27345%0.448SS..Hα-helixtrans-67.7-34.9174.652.90000112.1N185 L186 L190 I191 I192N185-S188 VanDerWaalsContact CB-OG 3.25Å; N185-S188 WeakPolarHBondContact CB-OG 3.18Å; N185-S188 PolarHBondContact O-OG 3.41Å; L186-S188 PolarHBondContact O-N 2.88Å; S188-L190 VanDerWaalsContact C-N 3.31Å; S188-L190 PolarHBondContact O-N 3.49Å; S188-I191 PolarHBondContact O-N 2.94Å; S188-I192 WeakPolarHBondContact O-CG1 3.3Å; S188-I192 PolarHBondContact O-N 3.04Å; S188-I192 VanDerWaalsContact O-N 3.13Å
189T91.6Very high90.3Very high23 Ų2381.2 Ų81.214%0.14145%0.449CS..Hα-helixtrans-61.3-41.2175.1-59.50000111.3M181 S182 N185 L186 P187 I191 I192 F193M181-T189 PolarHBondContact O-OG1 2.96Å; M181-T189 VanDerWaalsContact O-OG1 3.1Å; S182-T189 WeakPolarHBondContact CA-OG1 3.4Å; S182-T189 PolarHBondContact N-OG1 3.45Å; N185-T189 PolarHBondContact O-N 2.97Å; N185-T189 PolarHBondContact O-OG1 2.79Å; L186-T189 WeakPolarHBondContact O-CB 3.29Å; L186-T189 PolarHBondContact O-N 2.61Å; P187-T189 VanDerWaalsContact C-N 3.33Å; T189-I191 VanDerWaalsContact C-N 3.3Å; T189-I191 PolarHBondContact O-N 2.96Å; T189-I192 PolarHBondContact O-N 3.45Å; T189-F193 VanDerWaalsContact O-CB 3.29Å; T189-F193 WeakPolarHBondContact O-CB 3.47Å; T189-F193 PolarHBondContact O-N 3.27Å
190L91Very high90.4Very high119 Ų11977.6 Ų77.662%0.62343%0.432SS*.Hα-helixtrans-60.3-41.2177.5-155.888.5000111.6L186 P187 S188 F193 T194L186-L190 PolarHBondContact O-N 3.05Å; P187-L190 PolarHBondContact O-N 3.34Å; S188-L190 VanDerWaalsContact C-N 3.31Å; S188-L190 PolarHBondContact O-N 3.49Å; L190-F193 PolarHBondContact O-N 3.17Å; L190-T194 WeakPolarHBondContact O-CG2 3.47Å; L190-T194 PolarHBondContact O-N 2.99Å; L190-T194 PolarHBondContact O-OG1 2.85Å
191I92.6Very high90.7Very high107 Ų10780 Ų8055%0.54944%0.437SS..Hα-helixtrans-65.2-44.1178.5-62.1166.3000111.1P187 S188 T189 F193 T194 I195P187-I191 PolarHBondContact O-N 3.43Å; S188-I191 PolarHBondContact O-N 2.94Å; T189-I191 VanDerWaalsContact C-N 3.3Å; T189-I191 PolarHBondContact O-N 2.96Å; I191-F193 VanDerWaalsContact C-N 3.3Å; I191-F193 PolarHBondContact O-N 2.92Å; I191-T194 PolarHBondContact O-N 3.36Å; I191-T194 PolarHBondContact O-OG1 2.97Å; I191-I195 HydrophobicContact CG2-CD1 4.35Å; I191-I195 WeakPolarHBondContact O-CG1 3.2Å; I191-I195 PolarHBondContact O-N 3.39Å
192I92.6Very high90.9Very high42 Ų4281.9 Ų81.922%0.21545%0.448CS..Hα-helixtrans-70.4-33.8179.6-57166.9000110.2I174 T178 M181 S188 T189 I195 L196I174-I192 HydrophobicContact CG2-CG2 3.81Å; T178-I192 HydrophobicContact CG2-CB 3.88Å; T178-I192 HydrophobicContact CG2-CG2 3.37Å; M181-I192 HydrophobicContact CB-CD1 4.19Å; M181-I192 HydrophobicContact CG-CD1 3.67Å; S188-I192 WeakPolarHBondContact O-CG1 3.3Å; S188-I192 PolarHBondContact O-N 3.04Å; S188-I192 VanDerWaalsContact O-N 3.13Å; T189-I192 PolarHBondContact O-N 3.45Å; I192-I195 WeakPolarHBondContact O-CB 3.29Å; I192-I195 PolarHBondContact O-N 2.95Å; I192-L196 PolarHBondContact O-N 3.45Å
193F92.2Very high91.1Very high105 Ų10579.6 Ų79.646%0.46143%0.431SS..Hα-helixtrans-65.9-39175.2-173.3-105.5000112.7T189 L190 I191 I195 L196 I197T189-F193 VanDerWaalsContact O-CB 3.29Å; T189-F193 WeakPolarHBondContact O-CB 3.47Å; T189-F193 PolarHBondContact O-N 3.27Å; L190-F193 PolarHBondContact O-N 3.17Å; I191-F193 VanDerWaalsContact C-N 3.3Å; I191-F193 PolarHBondContact O-N 2.92Å; F193-I195 VanDerWaalsContact C-N 3.32Å; F193-I195 PolarHBondContact O-N 2.96Å; F193-L196 HydrophobicContact CD2-CD2 4.41Å; F193-L196 WeakPolarHBondContact O-CB 3.32Å; F193-L196 PolarHBondContact O-N 2.97Å; F193-I197 HydrophobicContact CD1-CD1 3.87Å; F193-I197 HydrophobicContact CE1-CD1 3.54Å; F193-I197 HydrophobicContact CE1-CG1 4.27Å; F193-I197 HydrophobicContact CZ-CD1 4.18Å; F193-I197 HydrophobicContact CZ-CG1 4.5Å; F193-I197 PolarHBondContact O-N 3.45Å
194T93.4Very high91.3Very high77 Ų7778 Ų7847%0.47242%0.416SS..Hα-helixtrans-65.4-36.7173.556.80000111.8L190 I191 L196 I197 L198L190-T194 WeakPolarHBondContact O-CG2 3.47Å; L190-T194 PolarHBondContact O-N 2.99Å; L190-T194 PolarHBondContact O-OG1 2.85Å; I191-T194 PolarHBondContact O-N 3.36Å; I191-T194 PolarHBondContact O-OG1 2.97Å; T194-L196 VanDerWaalsContact C-N 3.35Å; T194-I197 PolarHBondContact O-N 3.29Å; T194-L198 PolarHBondContact O-N 3.18Å
195I94.1Very high91.5Very high82 Ų8275 Ų7542%0.42141%0.408SS..Hα-helixtrans-62.2-42.2172.6-65.6166.6000110.9I174 I191 I192 F193 I197 L198 L199I174-I195 HydrophobicContact CD1-CG2 4.03Å; I191-I195 HydrophobicContact CG2-CD1 4.35Å; I191-I195 WeakPolarHBondContact O-CG1 3.2Å; I191-I195 PolarHBondContact O-N 3.39Å; I192-I195 WeakPolarHBondContact O-CB 3.29Å; I192-I195 PolarHBondContact O-N 2.95Å; F193-I195 VanDerWaalsContact C-N 3.32Å; F193-I195 PolarHBondContact O-N 2.96Å; I195-I197 PolarHBondContact O-N 2.8Å; I195-L198 PolarHBondContact O-N 2.98Å; I195-L199 WeakPolarHBondContact O-CB 3.27Å; I195-L199 PolarHBondContact O-N 2.76Å
196L93.2Very high91.6Very high31 Ų3172.7 Ų72.716%0.16240%0.397CS..Hα-helixtrans-59.1-46.8176.1-177.966.3000111.2I174 I192 F193 T194 L198 L199 T200I174-L196 HydrophobicContact CB-CD1 4.22Å; I174-L196 HydrophobicContact CG2-CB 3.93Å; I174-L196 HydrophobicContact CG2-CD1 3.99Å; I192-L196 PolarHBondContact O-N 3.45Å; F193-L196 HydrophobicContact CD2-CD2 4.41Å; F193-L196 WeakPolarHBondContact O-CB 3.32Å; F193-L196 PolarHBondContact O-N 2.97Å; T194-L196 VanDerWaalsContact C-N 3.35Å; L196-L198 VanDerWaalsContact C-N 3.34Å; L196-L198 PolarHBondContact O-N 3.45Å; L196-L199 WeakPolarHBondContact O-CB 3.49Å; L196-L199 PolarHBondContact O-N 2.88Å; L196-T200 WeakPolarHBondContact O-CG2 3.39Å; L196-T200 PolarHBondContact O-N 3.03Å
197I92.6Very high91.7Very high77 Ų7766.1 Ų66.140%0.39536%0.364SS..Hα-helixtrans-58.7-47.5176.4-67.3166000110.6F193 T194 I195 L199 T200 I201F193-I197 HydrophobicContact CD1-CD1 3.87Å; F193-I197 HydrophobicContact CE1-CD1 3.54Å; F193-I197 HydrophobicContact CE1-CG1 4.27Å; F193-I197 HydrophobicContact CZ-CD1 4.18Å; F193-I197 HydrophobicContact CZ-CG1 4.5Å; F193-I197 PolarHBondContact O-N 3.45Å; T194-I197 PolarHBondContact O-N 3.29Å; I195-I197 PolarHBondContact O-N 2.8Å; I197-L199 VanDerWaalsContact C-N 3.28Å; I197-L199 PolarHBondContact O-N 3.39Å; I197-T200 PolarHBondContact O-N 3.46Å; I197-T200 VanDerWaalsContact O-N 3.16Å; I197-T200 PolarHBondContact O-OG1 3.16Å; I197-I201 HydrophobicContact CG2-CD1 4.12Å; I197-I201 WeakPolarHBondContact O-CG1 3.34Å; I197-I201 PolarHBondContact O-N 2.99Å; I197-I201 VanDerWaalsContact O-N 3.15Å
198L94.6Very high91.8Very high118 Ų11867.1 Ų67.162%0.61836%0.363SS*.Hα-helixtrans-60.3-40.2179.5-175.764.3000112T194 I195 L196 I201 L202T194-L198 PolarHBondContact O-N 3.18Å; I195-L198 PolarHBondContact O-N 2.98Å; L196-L198 VanDerWaalsContact C-N 3.34Å; L196-L198 PolarHBondContact O-N 3.45Å; L198-I201 PolarHBondContact O-N 2.82Å; L198-L202 PolarHBondContact O-N 3.16Å
199L93.3Very high91.9Very high25 Ų2569.9 Ų69.913%0.13137%0.374CS..Hα-helixtrans-62.1-44.1175.5-177.772.7000111.7L170 M171 I174 I195 L196 I197 I201 L202 E203L170-L199 HydrophobicContact CB-CD2 4.26Å; L170-L199 HydrophobicContact CD2-CD1 3.77Å; L170-L199 HydrophobicContact CD2-CD2 3.29Å; L170-L199 HydrophobicContact CD2-CG 4.15Å; L170-L199 HydrophobicContact CG-CD2 4.34Å; M171-L199 HydrophobicContact CB-CD2 4.32Å; M171-L199 HydrophobicContact CG-CD2 3.61Å; M171-L199 HydrophobicContact CG-CG 4.22Å; I174-L199 HydrophobicContact CD1-CD2 4.17Å; I195-L199 WeakPolarHBondContact O-CB 3.27Å; I195-L199 PolarHBondContact O-N 2.76Å; L196-L199 WeakPolarHBondContact O-CB 3.49Å; L196-L199 PolarHBondContact O-N 2.88Å; I197-L199 VanDerWaalsContact C-N 3.28Å; I197-L199 PolarHBondContact O-N 3.39Å; L199-I201 VanDerWaalsContact C-N 3.28Å; L199-I201 PolarHBondContact O-N 2.96Å; L199-L202 HydrophobicContact CD1-CD2 4.48Å; L199-L202 WeakPolarHBondContact O-CB 3.45Å; L199-L202 PolarHBondContact O-N 3.48Å; L199-L202 VanDerWaalsContact O-N 3.15Å; L199-E203 PolarHBondContact O-N 2.86Å
200T91.2Very high91.8Very high51 Ų5169.2 Ų69.231%0.31337%0.369SS..Hα-helixtrans-60.5-39.2177.964.40000112.1M171 L196 I197 E203 I204M171-T200 HydrophobicContact SD-CG2 3.97Å; L196-T200 WeakPolarHBondContact O-CG2 3.39Å; L196-T200 PolarHBondContact O-N 3.03Å; I197-T200 PolarHBondContact O-N 3.46Å; I197-T200 VanDerWaalsContact O-N 3.16Å; I197-T200 PolarHBondContact O-OG1 3.16Å; T200-E203 PolarHBondContact O-N 3.29Å; T200-I204 VanDerWaalsContact O-CG1 3.3Å; T200-I204 WeakPolarHBondContact O-CG1 3.45Å; T200-I204 PolarHBondContact O-N 3.14Å
201I92.8Very high91.7Very high101 Ų10163.6 Ų63.652%0.51834%0.34SS..Hα-helixtrans-64.6-43.3176.2-64.4167.5000110.6I197 L198 L199 E203 I204 A205I197-I201 HydrophobicContact CG2-CD1 4.12Å; I197-I201 WeakPolarHBondContact O-CG1 3.34Å; I197-I201 PolarHBondContact O-N 2.99Å; I197-I201 VanDerWaalsContact O-N 3.15Å; L198-I201 PolarHBondContact O-N 2.82Å; L199-I201 VanDerWaalsContact C-N 3.28Å; L199-I201 PolarHBondContact O-N 2.96Å; I201-E203 VanDerWaalsContact C-N 3.3Å; I201-E203 PolarHBondContact O-N 2.99Å; I201-I204 PolarHBondContact O-N 3.45Å; I201-A205 PolarHBondContact O-N 3.02Å; I201-A205 VanDerWaalsContact O-N 3.14Å
202L91.9Very high91.6Very high102 Ų10263.5 Ų63.553%0.53433%0.333SS..Hα-helixtrans-59.4-43.5175.4179.167.2000111L198 L199 A205 V206L198-L202 PolarHBondContact O-N 3.16Å; L199-L202 HydrophobicContact CD1-CD2 4.48Å; L199-L202 WeakPolarHBondContact O-CB 3.45Å; L199-L202 PolarHBondContact O-N 3.48Å; L199-L202 VanDerWaalsContact O-N 3.15Å; L202-A205 WeakPolarHBondContact O-CB 3.23Å; L202-A205 PolarHBondContact O-N 3.13Å; L202-V206 HydrophobicContact CD1-CG2 4.36Å; L202-V206 HydrophobicContact CG-CG2 4.35Å; L202-V206 WeakPolarHBondContact O-CG2 3.43Å; L202-V206 PolarHBondContact O-N 3.23Å
203E90.6Very high91.4Very high13 Ų1363.5 Ų63.56%0.06134%0.335CS..Hα-helixtrans-70.5-35.8-176.4-150.5168.2155.200112.7L87 G167 H168 M171 L199 T200 I201 A205 V206 A207L87-E203 HydrophobicContact CD2-CB 4.09Å; L87-E203 HydrophobicContact CD2-CG 3.67Å; G167-E203 VanDerWaalsContact C-CD 3.43Å; G167-E203 WeakPolarHBondContact CA-OE1 3.25Å; G167-E203 VanDerWaalsContact CA-OE2 3.25Å; G167-E203 WeakPolarHBondContact CA-OE2 3.46Å; H168-E203 IonicContact CD2-OE1 3.65Å; H168-E203 PolarHBondContact N-OE1 3.18Å; H168-E203 VanDerWaalsContact N-OE1 3.08Å; M171-E203 VanDerWaalsContact CE-CD 3.44Å; M171-E203 WeakPolarHBondContact CE-OE1 3.42Å; M171-E203 WeakPolarHBondContact CE-OE2 3.3Å; M171-E203 WeakPolarHBondContact CG-OE2 3.34Å; M171-E203 VanDerWaalsContact SD-OE2 3.38Å; L199-E203 PolarHBondContact O-N 2.86Å; T200-E203 PolarHBondContact O-N 3.29Å; I201-E203 VanDerWaalsContact C-N 3.3Å; I201-E203 PolarHBondContact O-N 2.99Å; E203-A205 VanDerWaalsContact C-N 3.3Å; E203-A205 PolarHBondContact O-N 2.89Å; E203-V206 PolarHBondContact O-N 3.15Å; E203-A207 VanDerWaalsContact O-CB 3.29Å; E203-A207 WeakPolarHBondContact O-CB 3.5Å; E203-A207 PolarHBondContact O-N 3.08Å
204I90.8Very high91.1Very high84 Ų8458.5 Ų58.543%0.43131%0.314SS..Hα-helixtrans-58.7-44.3169.5-66.9164.3000110.4L84 L87 T200 I201 A207 L208L84-I204 HydrophobicContact CD1-CG2 4.33Å; L87-I204 HydrophobicContact CD1-CB 4.19Å; L87-I204 HydrophobicContact CD1-CG1 3.6Å; T200-I204 VanDerWaalsContact O-CG1 3.3Å; T200-I204 WeakPolarHBondContact O-CG1 3.45Å; T200-I204 PolarHBondContact O-N 3.14Å; I201-I204 PolarHBondContact O-N 3.45Å; I204-A207 PolarHBondContact O-N 2.91Å; I204-L208 PolarHBondContact O-N 3.41Å
205A91.6Very high90.9Very high45 Ų4554.9 Ų54.937%0.37229%0.291SS..Hα-helixtrans-64.8-45.9177.600000111.7I201 L202 E203 A207 L208 I209I201-A205 PolarHBondContact O-N 3.02Å; I201-A205 VanDerWaalsContact O-N 3.14Å; L202-A205 WeakPolarHBondContact O-CB 3.23Å; L202-A205 PolarHBondContact O-N 3.13Å; E203-A205 VanDerWaalsContact C-N 3.3Å; E203-A205 PolarHBondContact O-N 2.89Å; A205-A207 VanDerWaalsContact C-N 3.34Å; A205-A207 PolarHBondContact O-N 3Å; A205-L208 PolarHBondContact O-N 2.64Å; A205-I209 WeakPolarHBondContact O-CB 3.3Å; A205-I209 VanDerWaalsContact O-CG1 3.27Å; A205-I209 WeakPolarHBondContact O-CG1 3.49Å; A205-I209 PolarHBondContact O-N 3.47Å
206V91.5Very high90.5Very high47 Ų4753.8 Ų53.829%0.28529%0.286SS..Hα-helixtrans-61.7-41.6178.1172.20000111.1N163 L202 E203 L208 I209 Q210N163-V206 HydrophobicContact CB-CG1 4.07Å; L202-V206 HydrophobicContact CD1-CG2 4.36Å; L202-V206 HydrophobicContact CG-CG2 4.35Å; L202-V206 WeakPolarHBondContact O-CG2 3.43Å; L202-V206 PolarHBondContact O-N 3.23Å; E203-V206 PolarHBondContact O-N 3.15Å; V206-L208 VanDerWaalsContact C-N 3.32Å; V206-L208 PolarHBondContact O-N 3.36Å; V206-I209 PolarHBondContact O-N 2.97Å; V206-Q210 WeakPolarHBondContact O-CB 3.5Å; V206-Q210 PolarHBondContact O-N 3.38Å
207A89.1Confident90.2Very high7 Ų754 Ų546%0.05829%0.287CS..Hα-helixtrans-58-41.9178.100000112.7N83 L87 E203 I204 A205 A211N83-A207 HydrophobicContact CB-CB 3.88Å; N83-A207 PolarHBondContact ND2-O 3.3Å; L87-A207 HydrophobicContact CD1-CB 4.13Å; E203-A207 VanDerWaalsContact O-CB 3.29Å; E203-A207 WeakPolarHBondContact O-CB 3.5Å; E203-A207 PolarHBondContact O-N 3.08Å; I204-A207 PolarHBondContact O-N 2.91Å; A205-A207 VanDerWaalsContact C-N 3.34Å; A205-A207 PolarHBondContact O-N 3Å; A207-A211 PolarHBondContact O-N 3.34Å
208L89.1Confident89.7Confident115 Ų11550.8 Ų50.860%0.60227%0.271SS*.Hα-helixtrans-75.6-44.5179-170.4146.4000112.1I204 A205 V206 Q210 A211 Y212I204-L208 PolarHBondContact O-N 3.41Å; A205-L208 PolarHBondContact O-N 2.64Å; V206-L208 VanDerWaalsContact C-N 3.32Å; V206-L208 PolarHBondContact O-N 3.36Å; L208-Q210 VanDerWaalsContact C-N 3.27Å; L208-Q210 PolarHBondContact O-N 3.49Å; L208-A211 PolarHBondContact O-N 3.15Å; L208-Y212 PolarHBondContact O-N 2.69Å; L208-Y212 VanDerWaalsContact O-N 3.16Å
209I90.6Very high89.3Confident96 Ų9645.7 Ų45.749%0.49225%0.245SC..Hα-helixtrans-60.4-40.9177.6-69.2166.6000110.3A205 V206 A211 Y212 V213A205-I209 WeakPolarHBondContact O-CB 3.3Å; A205-I209 VanDerWaalsContact O-CG1 3.27Å; A205-I209 WeakPolarHBondContact O-CG1 3.49Å; A205-I209 PolarHBondContact O-N 3.47Å; V206-I209 PolarHBondContact O-N 2.97Å; I209-A211 PolarHBondContact O-N 3.35Å; I209-Y212 WeakPolarHBondContact O-CB 3.44Å; I209-Y212 PolarHBondContact O-N 2.91Å; I209-V213 HydrophobicContact CG2-CG2 4.03Å; I209-V213 WeakPolarHBondContact O-CG2 3.47Å; I209-V213 PolarHBondContact O-N 3.35Å
210Q88.9Confident88.8Confident9 Ų948.1 Ų48.14%0.04226%0.258CS..Hα-helixtrans-67.1-37.7-177.5-174.163.99.700112.2R159 L160 V206 L208 Y212 F214R159-Q210 VanDerWaalsContact C-NE2 3.27Å; R159-Q210 VanDerWaalsContact CG-NE2 3.31Å; L160-Q210 VanDerWaalsContact CA-NE2 3.29Å; L160-Q210 HydrophobicContact CB-CG 4.29Å; L160-Q210 HydrophobicContact CD1-CB 4.35Å; L160-Q210 HydrophobicContact CD1-CG 3.38Å; L160-Q210 HydrophobicContact CG-CG 4.42Å; V206-Q210 WeakPolarHBondContact O-CB 3.5Å; V206-Q210 PolarHBondContact O-N 3.38Å; L208-Q210 VanDerWaalsContact C-N 3.27Å; L208-Q210 PolarHBondContact O-N 3.49Å; Q210-Y212 VanDerWaalsContact C-N 3.33Å; Q210-F214 VanDerWaalsContact O-CB 3.31Å; Q210-F214 WeakPolarHBondContact O-CB 3.43Å; Q210-F214 PolarHBondContact O-N 3.48Å
211A89.4Confident88.2Confident1 Ų146.7 Ų46.71%0.00825%0.247CC..Hα-helixtrans-62.4-41.1172.200000111.7I76 I79 A80 A207 L208 I209 T215I76-A211 HydrophobicContact CG1-CB 4.42Å; I79-A211 HydrophobicContact CB-CB 4.04Å; I79-A211 HydrophobicContact CG2-CB 3.74Å; A80-A211 HydrophobicContact CB-CB 3.93Å; A207-A211 PolarHBondContact O-N 3.34Å; L208-A211 PolarHBondContact O-N 3.15Å; I209-A211 PolarHBondContact O-N 3.35Å; A211-T215 WeakPolarHBondContact O-CG2 3.37Å; A211-T215 PolarHBondContact O-N 3.23Å; A211-T215 PolarHBondContact O-OG1 3.25Å
212Y89.4Confident87.6Confident105 Ų10542 Ų4241%0.41222%0.223SC..Hα-helixtrans-65.8-49176.2177.1-101000112.5M57 I76 L208 I209 Q210 F214 T215 L216M57-Y212 HydrophobicContact CE-CD2 4.45Å; M57-Y212 HydrophobicContact CE-CE2 4.49Å; I76-Y212 HydrophobicContact CD1-CD2 4.23Å; L208-Y212 PolarHBondContact O-N 2.69Å; L208-Y212 VanDerWaalsContact O-N 3.16Å; I209-Y212 WeakPolarHBondContact O-CB 3.44Å; I209-Y212 PolarHBondContact O-N 2.91Å; Q210-Y212 VanDerWaalsContact C-N 3.33Å; Y212-F214 VanDerWaalsContact C-N 3.3Å; Y212-F214 PolarHBondContact O-N 3.24Å; Y212-T215 PolarHBondContact O-N 2.9Å; Y212-T215 PolarHBondContact O-OG1 3.29Å; Y212-L216 HydrophobicContact CE1-CD1 3.63Å; Y212-L216 HydrophobicContact CE2-CD1 4.46Å; Y212-L216 VanDerWaalsContact O-CB 3.27Å; Y212-L216 WeakPolarHBondContact O-CB 3.39Å; Y212-L216 PolarHBondContact O-N 3.48Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.46Å
213V89.3Confident87Confident42 Ų4241 Ų4126%0.25522%0.215SC..Hα-helixtrans-62.5-38.6179.7172.30000111.3I209 L217I209-V213 HydrophobicContact CG2-CG2 4.03Å; I209-V213 WeakPolarHBondContact O-CG2 3.47Å; I209-V213 PolarHBondContact O-N 3.35Å; V213-L217 HydrophobicContact CG1-CD1 3.89Å; V213-L217 WeakPolarHBondContact O-CB 3.48Å; V213-L217 WeakPolarHBondContact O-CG 3.44Å; V213-L217 PolarHBondContact O-N 3.05Å
214F86.8Confident86.3Confident1 Ų144 Ų440%0.00423%0.232CC..Hα-helixtrans-57.7-52.7175.6-171.9-80000111.6L75 I79 A105 L108 L156 L160 Q210 Y212 L217 V218L75-F214 HydrophobicContact CD1-CE1 4.04Å; L75-F214 HydrophobicContact CD2-CD1 3.89Å; L75-F214 HydrophobicContact CD2-CE1 3.79Å; L75-F214 HydrophobicContact CG-CD1 4.28Å; L75-F214 HydrophobicContact CG-CE1 4.17Å; I79-F214 HydrophobicContact CD1-CB 4.23Å; I79-F214 HydrophobicContact CD1-CD1 3.34Å; I79-F214 HydrophobicContact CD1-CD2 4.32Å; I79-F214 HydrophobicContact CD1-CE1 3.7Å; I79-F214 HydrophobicContact CD1-CG 3.71Å; I79-F214 HydrophobicContact CD1-CZ 4.33Å; A105-F214 HydrophobicContact CB-CE2 4.38Å; A105-F214 HydrophobicContact CB-CZ 4.18Å; L108-F214 HydrophobicContact CD1-CE1 4.07Å; L156-F214 HydrophobicContact CD1-CD2 4.07Å; L156-F214 HydrophobicContact CD1-CG 4.45Å; L156-F214 HydrophobicContact CD2-CD1 4.13Å; L156-F214 HydrophobicContact CD2-CD2 3.27Å; L156-F214 HydrophobicContact CD2-CE1 4.05Å; L156-F214 HydrophobicContact CD2-CE2 3.17Å; L156-F214 HydrophobicContact CD2-CG 3.75Å; L156-F214 HydrophobicContact CD2-CZ 3.59Å; L156-F214 HydrophobicContact CG-CD2 3.39Å; L156-F214 HydrophobicContact CG-CE2 3.6Å; L156-F214 HydrophobicContact CG-CG 4.13Å; L156-F214 HydrophobicContact CG-CZ 4.47Å; L160-F214 HydrophobicContact CD2-CD2 4.49Å; Q210-F214 VanDerWaalsContact O-CB 3.31Å; Q210-F214 WeakPolarHBondContact O-CB 3.43Å; Q210-F214 PolarHBondContact O-N 3.48Å; Y212-F214 VanDerWaalsContact C-N 3.3Å; Y212-F214 PolarHBondContact O-N 3.24Å; F214-L217 PolarHBondContact O-N 3.44Å; F214-V218 HydrophobicContact CD1-CG2 4.39Å; F214-V218 HydrophobicContact CE1-CG2 4.21Å; F214-V218 WeakPolarHBondContact O-CG2 3.41Å; F214-V218 PolarHBondContact O-N 2.94Å
215T87.8Confident85.3Confident0 Ų041.6 Ų41.60%022%0.22CC..Hα-helixtrans-72.2-35-176.451.90000112.6M57 L75 I76 A211 Y212 V218 S219M57-T215 WeakPolarHBondContact CE-OG1 3.43Å; L75-T215 HydrophobicContact CB-CG2 4.06Å; L75-T215 HydrophobicContact CD2-CG2 3.54Å; L75-T215 HydrophobicContact CG-CG2 3.72Å; I76-T215 VanDerWaalsContact CA-CG2 3.49Å; I76-T215 HydrophobicContact CB-CG2 3.51Å; I76-T215 HydrophobicContact CG1-CG2 4.15Å; A211-T215 WeakPolarHBondContact O-CG2 3.37Å; A211-T215 PolarHBondContact O-N 3.23Å; A211-T215 PolarHBondContact O-OG1 3.25Å; Y212-T215 PolarHBondContact O-N 2.9Å; Y212-T215 PolarHBondContact O-OG1 3.29Å; T215-V218 PolarHBondContact O-N 3.48Å; T215-S219 WeakPolarHBondContact O-CB 3.42Å; T215-S219 PolarHBondContact O-N 3.01Å
216L86.9Confident84.2Confident59 Ų5941 Ų4131%0.30921%0.211SC..Hα-helixtrans-62.6-45.4174.2-175.3148.9000111.6Y212 V218 S219 L220Y212-L216 HydrophobicContact CE1-CD1 3.63Å; Y212-L216 HydrophobicContact CE2-CD1 4.46Å; Y212-L216 VanDerWaalsContact O-CB 3.27Å; Y212-L216 WeakPolarHBondContact O-CB 3.39Å; Y212-L216 PolarHBondContact O-N 3.48Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.46Å; L216-V218 PolarHBondContact O-N 3.18Å; L216-S219 CarbonylContact O-C 3.6Å; L216-S219 WeakPolarHBondContact O-CB 3.38Å; L216-S219 PolarHBondContact O-N 3.2Å; L216-S219 VanDerWaalsContact O-N 3.14Å; L216-S219 PolarHBondContact O-OG 2.98Å; L216-L220 PolarHBondContact O-N 3.1Å
217L85.3Confident83.8Confident37 Ų3740.7 Ų40.719%0.19421%0.208CC..Hα-helixtrans-63.2-43.2178.1-77.2167.4000111.6L156 V213 F214 S219 L220 Y221L156-L217 HydrophobicContact CD1-CB 4.17Å; L156-L217 HydrophobicContact CD1-CD1 3.42Å; L156-L217 VanDerWaalsContact CD1-CD1 3.42Å; L156-L217 HydrophobicContact CD1-CG 4.42Å; V213-L217 HydrophobicContact CG1-CD1 3.89Å; V213-L217 WeakPolarHBondContact O-CB 3.48Å; V213-L217 WeakPolarHBondContact O-CG 3.44Å; V213-L217 PolarHBondContact O-N 3.05Å; F214-L217 PolarHBondContact O-N 3.44Å; L217-S219 VanDerWaalsContact C-N 3.26Å; L217-S219 PolarHBondContact O-N 3.24Å; L217-L220 PolarHBondContact O-N 2.8Å; L217-Y221 HydrophobicContact CB-CE2 4.14Å; L217-Y221 WeakPolarHBondContact O-CD2 3.18Å; L217-Y221 WeakPolarHBondContact O-CE2 3.35Å; L217-Y221 PolarHBondContact O-N 3.28Å
218V84.1Confident83.5Confident8 Ų842.4 Ų42.45%0.04822%0.216CC..Hα-helixtrans-59.5-40.4173.3177.40000111.4L72 L108 L156 F214 T215 L216 Y221 L222L72-V218 HydrophobicContact CD2-CB 4.21Å; L72-V218 HydrophobicContact CD2-CG1 3.85Å; L108-V218 HydrophobicContact CB-CG1 4.41Å; L156-V218 HydrophobicContact CD2-CG2 4.34Å; F214-V218 HydrophobicContact CD1-CG2 4.39Å; F214-V218 HydrophobicContact CE1-CG2 4.21Å; F214-V218 WeakPolarHBondContact O-CG2 3.41Å; F214-V218 PolarHBondContact O-N 2.94Å; T215-V218 PolarHBondContact O-N 3.48Å; L216-V218 PolarHBondContact O-N 3.18Å; V218-Y221 PolarHBondContact O-N 3.27Å; V218-L222 PolarHBondContact O-N 3.35Å
219S84.9Confident83.2Confident12 Ų1238.4 Ų38.48%0.08419%0.194CC..Hα-helixtrans-66.6-38.3177.186.20000112.3H61 T215 L216 L217 L222 H223H61-S219 PolarHBondContact NE2-O 3.07Å; T215-S219 WeakPolarHBondContact O-CB 3.42Å; T215-S219 PolarHBondContact O-N 3.01Å; L216-S219 CarbonylContact O-C 3.6Å; L216-S219 WeakPolarHBondContact O-CB 3.38Å; L216-S219 PolarHBondContact O-N 3.2Å; L216-S219 VanDerWaalsContact O-N 3.14Å; L216-S219 PolarHBondContact O-OG 2.98Å; L217-S219 VanDerWaalsContact C-N 3.26Å; L217-S219 PolarHBondContact O-N 3.24Å; S219-L222 WeakPolarHBondContact O-CB 3.47Å; S219-L222 PolarHBondContact O-N 3.48Å; S219-H223 PolarHBondContact O-N 3.25Å
220L83Confident82.8Confident75 Ų7535 Ų3539%0.39318%0.176SC..Hα-helixtrans-65.7-41.8176.4-170.7149.4000111L216 L217 L222 H223 D224L216-L220 PolarHBondContact O-N 3.1Å; L217-L220 PolarHBondContact O-N 2.8Å; L220-L222 VanDerWaalsContact C-N 3.27Å; L220-L222 PolarHBondContact O-N 3.3Å; L220-H223 WeakPolarHBondContact O-CB 3.49Å; L220-H223 PolarHBondContact O-N 3.4Å; L220-H223 VanDerWaalsContact O-N 3.09Å; L220-D224 WeakPolarHBondContact CD2-OD2 3.25Å; L220-D224 PolarHBondContact O-N 3.48Å
221Y78.6Confident82.4Confident22 Ų2236.6 Ų36.69%0.08619%0.185CC..Hα-helixtrans-61.3-38.1173.1-60.8-47.5000112.5Q152 L217 V218 H223 N225Q152-Y221 HydrophobicContact CG-CE1 4.37Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.43Å; Q152-Y221 VanDerWaalsContact NE2-CE1 3.31Å; Q152-Y221 PolarHBondContact NE2-OH 3.38Å; Q152-Y221 PolarHBondContact OE1-OH 2.88Å; L217-Y221 HydrophobicContact CB-CE2 4.14Å; L217-Y221 WeakPolarHBondContact O-CD2 3.18Å; L217-Y221 WeakPolarHBondContact O-CE2 3.35Å; L217-Y221 PolarHBondContact O-N 3.28Å; V218-Y221 PolarHBondContact O-N 3.27Å; Y221-H223 VanDerWaalsContact C-N 3.32Å; Y221-N225 VanDerWaalsContact O-CB 3.32Å; Y221-N225 WeakPolarHBondContact O-CB 3.43Å; Y221-N225 PolarHBondContact O-N 3.03Å; Y221-N225 VanDerWaalsContact O-N 3.16Å; Y221-N225 PolarHBondContact O-ND2 3.35Å
222L79.4Confident81.9Confident3 Ų339 Ų392%0.01620%0.197CC..Hα-helixtrans-64.2-42.7175.3-169.973.9000110.5W68 M115 V218 S219 L220 N225 T226W68-L222 HydrophobicContact CB-CD2 3.47Å; W68-L222 VanDerWaalsContact CB-CD2 3.47Å; W68-L222 HydrophobicContact CD2-CD1 3.83Å; W68-L222 HydrophobicContact CD2-CD2 4.18Å; W68-L222 HydrophobicContact CE3-CD1 4.14Å; W68-L222 HydrophobicContact CG-CD1 3.99Å; W68-L222 HydrophobicContact CG-CD2 3.63Å; W68-L222 HydrophobicContact CG-CG 4.49Å; M115-L222 HydrophobicContact SD-CD1 4.22Å; V218-L222 PolarHBondContact O-N 3.35Å; S219-L222 WeakPolarHBondContact O-CB 3.47Å; S219-L222 PolarHBondContact O-N 3.48Å; L220-L222 VanDerWaalsContact C-N 3.27Å; L220-L222 PolarHBondContact O-N 3.3Å; L222-N225 PolarHBondContact O-N 3.13Å; L222-T226 HydrophobicContact CD1-CG2 4.39Å; L222-T226 HydrophobicContact CG-CG2 4.28Å; L222-T226 WeakPolarHBondContact O-CB 3.34Å; L222-T226 WeakPolarHBondContact O-CG2 3.29Å; L222-T226 PolarHBondContact O-N 3.17Å; L222-T226 VanDerWaalsContact O-N 3.13Å; L222-T226 PolarHBondContact O-OG1 3.39Å; L222-T226 VanDerWaalsContact O-OG1 3.06Å
223H79.6Confident81.4Confident80 Ų8034.3 Ų34.337%0.3718%0.181SC..Hα-helixtrans-58.9-51.3176.7-174.686.5000111.9M60 S219 L220 Y221 N225 T226M60-H223 PolarHBondContact O-CE1 3.43Å; M60-H223 PolarHBondContact O-ND1 2.97Å; S219-H223 PolarHBondContact O-N 3.25Å; L220-H223 WeakPolarHBondContact O-CB 3.49Å; L220-H223 PolarHBondContact O-N 3.4Å; L220-H223 VanDerWaalsContact O-N 3.09Å; Y221-H223 VanDerWaalsContact C-N 3.32Å; H223-N225 PolarHBondContact O-N 2.98Å; H223-T226 PolarHBondContact O-N 2.79Å; H223-T226 VanDerWaalsContact O-N 3.11Å; H223-T226 PolarHBondContact O-OG1 3.48Å
224D75.6Confident80.8Confident76 Ų7633.7 Ų33.741%0.40618%0.176SC..Hα-helixtrans-61-30.1-179.4-65.8-14.7000112.5L220L220-D224 WeakPolarHBondContact CD2-OD2 3.25Å; L220-D224 PolarHBondContact O-N 3.48Å
225N71.3Confident80.3Confident33 Ų3336.4 Ų36.418%0.17619%0.19CC..THydrogen-bonded Turntrans-91.8-1.5-180-74.7-68.9000114.5G116 S119 Y221 L222 H223G116-N225 VanDerWaalsContact CA-O 3.27Å; G116-N225 WeakPolarHBondContact CA-O 3.4Å; S119-N225 PolarHBondContact OG-O 3.45Å; Y221-N225 VanDerWaalsContact O-CB 3.32Å; Y221-N225 WeakPolarHBondContact O-CB 3.43Å; Y221-N225 PolarHBondContact O-N 3.03Å; Y221-N225 VanDerWaalsContact O-N 3.16Å; Y221-N225 PolarHBondContact O-ND2 3.35Å; L222-N225 PolarHBondContact O-N 3.13Å; H223-N225 PolarHBondContact O-N 2.98Å
226T67Low79.6Confident32 Ų3239.7 Ų39.720%0.19621%0.207CC..  trans-111.20-179.256.60000114.4K120 L222 H223K120-T226 WeakPolarHBondContact CE-O 3.35Å; K120-T226 PolarHBondContact NZ-O 3.41Å; L222-T226 HydrophobicContact CD1-CG2 4.39Å; L222-T226 HydrophobicContact CG-CG2 4.28Å; L222-T226 WeakPolarHBondContact O-CB 3.34Å; L222-T226 WeakPolarHBondContact O-CG2 3.29Å; L222-T226 PolarHBondContact O-N 3.17Å; L222-T226 VanDerWaalsContact O-N 3.13Å; L222-T226 PolarHBondContact O-OG1 3.39Å; L222-T226 VanDerWaalsContact O-OG1 3.06Å; H223-T226 PolarHBondContact O-N 2.79Å; H223-T226 VanDerWaalsContact O-N 3.11Å; H223-T226 PolarHBondContact O-OG1 3.48Å

Retrieved 226 of 226 residues in 136 ms (Link to these results)