A0A096LUG5_POEFO Loading...

Forkhead box L1

AlphaFold DB , UniProt , Accession A0A096LUG5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 305 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
1M39.3Very low47.8Very low244 Ų244154 Ų154100%1.20285%0.852SS**  088.20-69.1177164.700106.6
2A39.2Very low47.7Very low96 Ų96149.3 Ų149.379%0.79385%0.848SS**  67.899.7100.400000112.3
3L43.4Very low48Very low151 Ų151148.8 Ų148.879%0.79185%0.85SS**  80113.272.7-72.2-176.3000116.2
4F47.8Very low48.1Very low189 Ų189145.2 Ų145.283%0.82984%0.838SS**  trans76.8158.8145.5-79.4-55.6000122.6
5P63Low48.2Very low121 Ų121144 Ų14479%0.78684%0.837SS**  trans-119.8175.3-142.932.4-9000113.9
6G41.6Very low48.3Very low71 Ų71141.9 Ų141.973%0.73283%0.833SS**  trans-158.8109.916900000110.6
7R45Very low48.4Very low246 Ų246138.9 Ų138.993%0.92883%0.828SS**  85.810487.7-164.7178.6-163.5-156.64.5112.2
8L50Low48.3Very low162 Ų162140.2 Ų140.285%0.84883%0.829SS**  trans-61.7158.4166-71.6166.5000111.6
9P60.6Low48.4Very low113 Ų113139.6 Ų139.673%0.73483%0.833SS**  trans-126.5140.7131.832.3-22.6000113.1
10P52Low48.4Very low120 Ų120140.2 Ų140.278%0.77983%0.831SS**  trans-77.5138.1166.831.7-31000110.5A12P10-A12 PolarHBondContact O-N 3.04Å
11L44.3Very low48.8Very low181 Ų181139.8 Ų139.895%0.94884%0.835SS**  trans-66.4100173.3-69.2167.6000109.6
12A46.4Very low49.2Very low98 Ų98130.8 Ų130.881%0.8181%0.805SS**PPolyproline II helixtrans-82.2117.9167.700000109.2P10P10-A12 PolarHBondContact O-N 3.04Å
13V51.3Low50.1Low143 Ų143132.3 Ų132.387%0.86781%0.805SS**PPolyproline II helixtrans-57.6140.2172.2-94.50000112
14S49.6Very low50.4Low98 Ų98130.9 Ų130.969%0.68580%0.804SS**PPolyproline II helixtrans-74.4131.5176.5-176.90000111.8S16S14-S16 PolarHBondContact O-N 3.49Å
15P48.9Very low50.5Low127 Ų127129.3 Ų129.383%0.82580%0.804SS**  trans-92.594.3165.233.8-24.3000108.3
16S49.8Very low50.4Low111 Ų111130 Ų13078%0.77680%0.8SS**  trans-129.680.7167.7-73.10000109.1S14S14-S16 PolarHBondContact O-N 3.49Å
17A51.4Low50.8Low90 Ų90135 Ų13574%0.74480%0.797SS**  trans-158.5143.3155.500000108.1
18L45.9Very low51.5Low163 Ų163130.7 Ų130.785%0.85379%0.792SS**  trans93.157.7179.7-43.3-174.6000116L20L18-L20 PolarHBondContact O-N 3.13Å; L18-L20 VanDerWaalsContact O-N 3.13Å
19S49.8Very low51.2Low129 Ų129132.8 Ų132.890%0.90279%0.79SS**  trans-75.281.8146.6-179.20000108.2
20L49.3Very low50.3Low151 Ų151130.6 Ų130.679%0.79179%0.788SS**  trans-92.2127.3160.7-139.782.3000106L18 G22L18-L20 PolarHBondContact O-N 3.13Å; L18-L20 VanDerWaalsContact O-N 3.13Å; L20-G22 PolarHBondContact O-N 3.22Å
21S56.2Low50.2Low131 Ų131128.9 Ų128.992%0.91679%0.793SS**  trans-68.363.3175.459.20000111.6
22G48.2Very low50.2Low55 Ų55127.3 Ų127.357%0.56779%0.785SS**  trans-103.1135.4177.500000110.5L20L20-G22 PolarHBondContact O-N 3.22Å
23T57.9Low50.4Low129 Ų129128.2 Ų128.279%0.79179%0.785SS**  trans-43.9142.8168.546.90000111.6L25T23-L25 PolarHBondContact O-N 2.88Å
24P50Low50.5Low120 Ų120127 Ų12778%0.77978%0.778SS**  trans-61.511117826.1-32.8000109.6I26P24-I26 PolarHBondContact O-N 3.35Å
25L49.8Very low50.6Low156 Ų156131.2 Ų131.282%0.81779%0.793SS**  trans-78.2101.6175.9-152.7-177.5000107.1T23 Y27T23-L25 PolarHBondContact O-N 2.88Å; L25-Y27 PolarHBondContact O-N 2.83Å
26I60.2Low51Low137 Ų137129.4 Ų129.470%0.70378%0.783SS**  trans-79.5107.8175.3-50.1-178.6000107.4P24 L28P24-I26 PolarHBondContact O-N 3.35Å; I26-L28 HydrophobicContact CG2-CG 4.3Å
27Y50Low51.2Low174 Ų174132.3 Ų132.368%0.68279%0.789SS**  trans-91.4101176.2-171.7-105.8000109.5L25 Y29L25-Y27 PolarHBondContact O-N 2.83Å; Y27-Y29 AromaticContact CE1-CD2 3.52Å; Y27-Y29 HydrophobicContact CE1-CD2 3.52Å; Y27-Y29 HydrophobicContact CE1-CE2 4.33Å; Y27-Y29 HydrophobicContact CE1-CG 4.38Å; Y27-Y29 AromaticContact CZ-CD2 3.8Å; Y27-Y29 WeakPolarHBondContact OH-CD2 3.39Å
28L58.9Low51.6Low156 Ų156133 Ų13382%0.81778%0.783SS**  trans-92.3111.4170.2-69.3171.7000108.4I26 G30I26-L28 HydrophobicContact CG2-CG 4.3Å; L28-G30 PolarHBondContact O-N 2.74Å
29Y44.4Very low52.2Low206 Ų206130.5 Ų130.581%0.80878%0.777SS**  trans-78.5101.1175.1-158.3-103.9000109.2Y27Y27-Y29 AromaticContact CE1-CD2 3.52Å; Y27-Y29 HydrophobicContact CE1-CD2 3.52Å; Y27-Y29 HydrophobicContact CE1-CE2 4.33Å; Y27-Y29 HydrophobicContact CE1-CG 4.38Å; Y27-Y29 AromaticContact CZ-CD2 3.8Å; Y27-Y29 WeakPolarHBondContact OH-CD2 3.39Å
30G41.2Very low52.2Low67 Ų67127.5 Ų127.569%0.69177%0.766SS**  trans-150.9108.717300000108.7L28 D32L28-G30 PolarHBondContact O-N 2.74Å; G30-D32 PolarHBondContact O-N 2.96Å
31G50.3Low52.3Low85 Ų85125.7 Ų125.788%0.87677%0.766SS**  trans-62.7120.2-167.700000114.4
32D44.6Very low52.6Low147 Ų147128.3 Ų128.379%0.78676%0.764SS**  -167.5149.6110.7-157.8-13000107.2G30 T34G30-D32 PolarHBondContact O-N 2.96Å; D32-T34 VanDerWaalsContact C-N 3.33Å; D32-T34 PolarHBondContact O-N 3.24Å
33S51.7Low53.6Low117 Ų117132.9 Ų132.982%0.81877%0.771SS**SBendtrans-77.461.3-155.7-58.10000115.1
34T52.6Low54.5Low117 Ų117131 Ų13172%0.71876%0.761SS**  trans-128.5106167.7620000111.3D32 S36D32-T34 VanDerWaalsContact C-N 3.33Å; D32-T34 PolarHBondContact O-N 3.24Å; T34-S36 PolarHBondContact O-N 3.3Å
35L50.8Low56.1Low188 Ų188128.5 Ų128.598%0.98474%0.744SS**  trans-71.780.3172-63.3177.8000109.2L37L35-L37 PolarHBondContact O-N 2.9Å
36S56.9Low57.9Low89 Ų89128.7 Ų128.762%0.62274%0.741SS**  trans-82111166.658.80000108.8T34 V38T34-S36 PolarHBondContact O-N 3.3Å; S36-V38 PolarHBondContact O-N 3.45Å
37L55.8Low59.3Low171 Ų171128.3 Ų128.390%0.89574%0.735SS**  trans-69.785.1170.3-17171.7000107.7L35 P39L35-L37 PolarHBondContact O-N 2.9Å; L37-P39 VanDerWaalsContact O-CD 3.28Å; L37-P39 WeakPolarHBondContact O-CD 3.28Å
38V59.2Low61.2Low104 Ų104120.8 Ų120.863%0.6371%0.707SS**PPolyproline II helixtrans-68.5116.8171.6-179.80000106.7S36 G40S36-V38 PolarHBondContact O-N 3.45Å; V38-G40 PolarHBondContact O-N 3.05Å
39P57.6Low62.8Low112 Ų112117.5 Ų117.573%0.72770%0.695SS**PPolyproline II helixtrans-59.2118.7169.7-12.826.9000105.9L37 S41L37-P39 VanDerWaalsContact O-CD 3.28Å; L37-P39 WeakPolarHBondContact O-CD 3.28Å; P39-S41 PolarHBondContact O-N 2.78Å
40G50Low65.1Low65 Ų65110.8 Ų110.867%0.6767%0.669SS**PPolyproline II helixtrans-49.3120176.900000108.3V38 Q42V38-G40 PolarHBondContact O-N 3.05Å; G40-Q42 VanDerWaalsContact C-N 3.34Å; G40-Q42 PolarHBondContact O-N 3Å
41S51.8Low67.7Low114 Ų114109.4 Ų109.480%0.79765%0.648SS**  trans-50.1101.9177-58.10000107.6P39 E43P39-S41 PolarHBondContact O-N 2.78Å; S41-E43 PolarHBondContact O-N 3.04Å
42Q63Low69.9Low186 Ų186108.2 Ų108.287%0.86962%0.618SS**  trans-67.5112173-67.2-150.3-1700105.1G40G40-Q42 VanDerWaalsContact C-N 3.34Å; G40-Q42 PolarHBondContact O-N 3Å
43E69.6Low72.3Confident150 Ų150103.2 Ų103.270%0.70159%0.591SS**  trans-40.8130170.9-83-69.8130.500108.7S41S41-E43 PolarHBondContact O-N 3.04Å
44P76.2Confident74.4Confident91 Ų9197.7 Ų97.759%0.59155%0.552SS**PPolyproline II helixtrans-53.9132.5-17421.5-32.2000108.6Q46P44-Q46 PolarHBondContact O-N 3.05Å
45P82.6Confident76.5Confident66 Ų6692.1 Ų92.143%0.42952%0.518SS..PPolyproline II helixtrans-55.2122.1-172.318.7-30.2000109.2P82 F83P45-P82 HydrophobicContact CB-CB 4.23Å; P45-F83 HydrophobicContact CB-CB 4.23Å; P45-F83 WeakPolarHBondContact O-CD2 3.01Å
46Q87.9Confident78.7Confident160 Ų16083.2 Ų83.275%0.74847%0.471SS*.PPolyproline II helixtrans-79.8148.8-175.9-65.1-146.116.300111.7P44 P48P44-Q46 PolarHBondContact O-N 3.05Å; Q46-P48 WeakPolarHBondContact O-CD 3.49Å
47K90.3Very high80.5Confident130 Ų13079 Ų7957%0.56544%0.442SS*.PPolyproline II helixtrans-61.9121.7178.3-176.7172.3-180176.70110.6F83K47-F83 HydrophobicContact CB-CD1 4.13Å; K47-F83 HydrophobicContact CB-CD2 4.3Å; K47-F83 HydrophobicContact CB-CE1 3.79Å; K47-F83 HydrophobicContact CB-CE2 3.94Å; K47-F83 HydrophobicContact CB-CG 4.37Å; K47-F83 HydrophobicContact CB-CZ 3.67Å; K47-F83 HydrophobicContact CD-CE1 4.01Å; K47-F83 HydrophobicContact CD-CZ 4.06Å; K47-F83 HydrophobicContact CG-CD1 4.09Å; K47-F83 HydrophobicContact CG-CE1 3.6Å; K47-F83 HydrophobicContact CG-CZ 3.9Å
48P90.8Very high82.4Confident16 Ų1671.6 Ų71.610%0.10440%0.403CS..PPolyproline II helixtrans-61146.1178.9-23.433.3000112.3Q46 Y50 F81 Y84Q46-P48 WeakPolarHBondContact O-CD 3.49Å; P48-Y50 HydrophobicContact CB-CD2 3.65Å; P48-Y50 HydrophobicContact CB-CE2 4.28Å; P48-Y50 PolarHBondContact O-N 3.2Å; P48-F81 HydrophobicContact CB-CD1 3.89Å; P48-F81 HydrophobicContact CB-CE1 4.04Å; P48-F81 HydrophobicContact CB-CG 4.46Å; P48-F81 HydrophobicContact CG-CB 3.87Å; P48-F81 HydrophobicContact CG-CD1 3.38Å; P48-F81 HydrophobicContact CG-CE1 4.06Å; P48-F81 HydrophobicContact CG-CG 3.71Å; P48-Y84 HydrophobicContact CG-CE2 4.07Å
49P91.1Very high84.2Confident87 Ų8766.7 Ų66.757%0.56537%0.373SS*.SBendtrans-77.841.7179.134.6-37.6000112.8
50Y93.8Very high86.1Confident65 Ų6561.4 Ų61.426%0.25534%0.339SS..BIsolated β-bridgetrans-119.2140-177.7-59.5-55.6000110.6P48 L55 M58 F81 Y136 R137P48-Y50 HydrophobicContact CB-CD2 3.65Å; P48-Y50 HydrophobicContact CB-CE2 4.28Å; P48-Y50 PolarHBondContact O-N 3.2Å; Y50-L55 HydrophobicContact CD2-CD2 4.38Å; Y50-M58 HydrophobicContact CD1-CE 4.35Å; Y50-M58 HydrophobicContact CD2-CE 3.95Å; Y50-M58 HydrophobicContact CE2-CE 4.38Å; Y50-M58 HydrophobicContact CG-CE 3.95Å; Y50-F81 AromaticContact CD2-CE1 3.92Å; Y50-F81 HydrophobicContact CD2-CE1 3.92Å; Y50-F81 AromaticContact CD2-CZ 3.7Å; Y50-F81 HydrophobicContact CD2-CZ 3.7Å; Y50-F81 AromaticContact CE2-CE1 3.78Å; Y50-F81 HydrophobicContact CE2-CE1 3.78Å; Y50-F81 AromaticContact CE2-CZ 3.75Å; Y50-F81 HydrophobicContact CE2-CZ 3.75Å; Y50-Y136 WeakPolarHBondContact CD1-O 3.22Å; Y50-R137 HydrophobicContact CE1-CG 4.38Å
51S94.6Very high88.2Confident38 Ų3864.3 Ų64.327%0.26633%0.33SS..  trans-75.6160.4169.364.90000110.2I53 A54 L55S51-I53 PolarHBondContact O-N 3.06Å; S51-A54 WeakPolarHBondContact O-CB 3.37Å; S51-A54 PolarHBondContact O-N 2.98Å; S51-A54 PolarHBondContact OG-N 3.18Å; S51-L55 WeakPolarHBondContact O-CG 3.41Å; S51-L55 PolarHBondContact O-N 2.92Å
52Y96.4Very high90.2Very high59 Ų5962.2 Ų62.223%0.23132%0.315CS..Hα-helixtrans-57.2-36173.9-64.8-58.4000112.5A54 L55 I56 Y84 W91 S94 I95Y52-A54 PolarHBondContact O-N 3.2Å; Y52-L55 HydrophobicContact CD1-CD1 4.03Å; Y52-L55 PolarHBondContact O-N 3.09Å; Y52-I56 WeakPolarHBondContact O-CD1 3.02Å; Y52-I56 VanDerWaalsContact O-CG1 3.22Å; Y52-I56 WeakPolarHBondContact O-CG1 3.25Å; Y52-I56 PolarHBondContact O-N 3.21Å; Y52-Y84 HydrophobicContact CE1-CE1 4.18Å; Y52-W91 HydrophobicContact CE1-CB 4.32Å; Y52-S94 VanDerWaalsContact CE2-CB 3.4Å; Y52-I95 HydrophobicContact CD1-CD1 3.76Å; Y52-I95 HydrophobicContact CD1-CG1 4.45Å; Y52-I95 HydrophobicContact CG-CD1 4.32Å
53I95.4Very high91.8Very high43 Ų4354.4 Ų54.422%0.22128%0.282CS..Hα-helixtrans-58.5-48.5173.5-56.6174.9000110.2S51 L55 I56 A57 N102 F105 F131S51-I53 PolarHBondContact O-N 3.06Å; I53-L55 VanDerWaalsContact C-N 3.34Å; I53-L55 PolarHBondContact O-N 2.94Å; I53-I56 PolarHBondContact O-N 3.49Å; I53-A57 WeakPolarHBondContact O-CB 3.39Å; I53-A57 PolarHBondContact O-N 3.46Å; I53-N102 WeakPolarHBondContact CD1-OD1 3.41Å; I53-F105 HydrophobicContact CB-CE2 4.46Å; I53-F105 HydrophobicContact CB-CZ 4.41Å; I53-F105 HydrophobicContact CG1-CE2 4.5Å; I53-F105 HydrophobicContact CG2-CE2 4.04Å; I53-F105 HydrophobicContact CG2-CZ 3.8Å; I53-F131 HydrophobicContact CG2-CZ 3.85Å
54A95.2Very high92.9Very high1 Ų153 Ų531%0.00829%0.286CS..Hα-helixtrans-63.7-39.417800000112.3S51 Y52 A57 M58 Y136S51-A54 WeakPolarHBondContact O-CB 3.37Å; S51-A54 PolarHBondContact O-N 2.98Å; S51-A54 PolarHBondContact OG-N 3.18Å; Y52-A54 PolarHBondContact O-N 3.2Å; A54-A57 PolarHBondContact O-N 2.76Å; A54-M58 WeakPolarHBondContact O-CE 3.39Å; A54-M58 WeakPolarHBondContact O-CG 3.37Å; A54-M58 PolarHBondContact O-N 3.4Å; A54-Y136 HydrophobicContact CB-CD1 4.35Å; A54-Y136 VanDerWaalsContact CB-O 3.29Å; A54-Y136 WeakPolarHBondContact CB-O 3.26Å
55L96.4Very high93.7Very high0 Ų051.8 Ų51.80%029%0.29CS..Hα-helixtrans-61.4-46.5176-66.3175.7000112Y50 S51 Y52 I53 M58 A59 I77 F81 Y84Y50-L55 HydrophobicContact CD2-CD2 4.38Å; S51-L55 WeakPolarHBondContact O-CG 3.41Å; S51-L55 PolarHBondContact O-N 2.92Å; Y52-L55 HydrophobicContact CD1-CD1 4.03Å; Y52-L55 PolarHBondContact O-N 3.09Å; I53-L55 VanDerWaalsContact C-N 3.34Å; I53-L55 PolarHBondContact O-N 2.94Å; L55-M58 HydrophobicContact CD2-CE 3.79Å; L55-M58 PolarHBondContact O-N 3.07Å; L55-A59 PolarHBondContact O-N 2.98Å; L55-A59 VanDerWaalsContact O-N 3.08Å; L55-I77 HydrophobicContact CB-CD1 3.99Å; L55-I77 HydrophobicContact CB-CG1 4.25Å; L55-F81 HydrophobicContact CD2-CD2 3.68Å; L55-F81 HydrophobicContact CD2-CE2 3.36Å; L55-F81 HydrophobicContact CD2-CZ 4.1Å; L55-Y84 HydrophobicContact CD1-CE2 3.79Å
56I97.4Very high94.3Very high0 Ų053.8 Ų53.80%029%0.293CS..Hα-helixtrans-64.5-44.2177.9-63.8161.4000110.3Y52 I53 M58 A59 I60 I73 I95 N98 L99 F105Y52-I56 WeakPolarHBondContact O-CD1 3.02Å; Y52-I56 VanDerWaalsContact O-CG1 3.22Å; Y52-I56 WeakPolarHBondContact O-CG1 3.25Å; Y52-I56 PolarHBondContact O-N 3.21Å; I53-I56 PolarHBondContact O-N 3.49Å; I56-M58 PolarHBondContact O-N 3.1Å; I56-A59 WeakPolarHBondContact O-CB 3.47Å; I56-A59 PolarHBondContact O-N 3.04Å; I56-A59 VanDerWaalsContact O-N 3.16Å; I56-I60 HydrophobicContact CG2-CD1 3.77Å; I56-I60 HydrophobicContact CG2-CG1 4.33Å; I56-I60 WeakPolarHBondContact O-CG1 3.44Å; I56-I60 PolarHBondContact O-N 2.98Å; I56-I73 HydrophobicContact CG1-CG2 4.19Å; I56-I73 HydrophobicContact CG2-CD1 4.17Å; I56-I95 HydrophobicContact CD1-CD1 4.14Å; I56-I95 HydrophobicContact CD1-CG2 4.3Å; I56-I95 HydrophobicContact CG1-CD1 3.91Å; I56-I95 HydrophobicContact CG1-CG2 4.31Å; I56-N98 HydrophobicContact CD1-CB 3.9Å; I56-L99 HydrophobicContact CD1-CD2 4.13Å; I56-L99 HydrophobicContact CD1-CG 4.09Å; I56-L99 HydrophobicContact CG2-CD2 3.71Å; I56-F105 HydrophobicContact CB-CE1 3.82Å; I56-F105 HydrophobicContact CB-CE2 4.23Å; I56-F105 HydrophobicContact CB-CZ 3.59Å; I56-F105 HydrophobicContact CD1-CE2 3.94Å; I56-F105 HydrophobicContact CD1-CZ 4.19Å; I56-F105 HydrophobicContact CG2-CD1 3.67Å; I56-F105 HydrophobicContact CG2-CD2 4.45Å; I56-F105 HydrophobicContact CG2-CE1 3.26Å; I56-F105 HydrophobicContact CG2-CE2 4.12Å; I56-F105 HydrophobicContact CG2-CG 4.25Å; I56-F105 HydrophobicContact CG2-CZ 3.52Å
57A95.8Very high94.7Very high0 Ų051.9 Ų51.90%028%0.279CS..Hα-helixtrans-60.5-43178.600000112.1I53 A54 A59 I60 R61 L123 F131 Y136I53-A57 WeakPolarHBondContact O-CB 3.39Å; I53-A57 PolarHBondContact O-N 3.46Å; A54-A57 PolarHBondContact O-N 2.76Å; A57-A59 VanDerWaalsContact C-N 3.35Å; A57-A59 PolarHBondContact O-N 2.92Å; A57-I60 PolarHBondContact O-N 3.12Å; A57-R61 WeakPolarHBondContact O-CB 3.3Å; A57-R61 PolarHBondContact O-N 2.75Å; A57-L123 HydrophobicContact CB-CD1 4.25Å; A57-L123 HydrophobicContact CB-CD2 4.07Å; A57-F131 HydrophobicContact CB-CD1 4.11Å; A57-F131 HydrophobicContact CB-CD2 3.94Å; A57-F131 HydrophobicContact CB-CE1 4.19Å; A57-F131 HydrophobicContact CB-CE2 4.04Å; A57-F131 HydrophobicContact CB-CG 3.99Å; A57-F131 HydrophobicContact CB-CZ 4.16Å; A57-Y136 HydrophobicContact CB-CE1 4.47Å
58M95.9Very high95Very high16 Ų1646.1 Ų46.18%0.07926%0.256CS..Hα-helixtrans-61.4-42.7174.3-73.8-173.8-71.500112Y50 A54 L55 I56 R61 S62 F76 F81 Y136Y50-M58 HydrophobicContact CD1-CE 4.35Å; Y50-M58 HydrophobicContact CD2-CE 3.95Å; Y50-M58 HydrophobicContact CE2-CE 4.38Å; Y50-M58 HydrophobicContact CG-CE 3.95Å; A54-M58 WeakPolarHBondContact O-CE 3.39Å; A54-M58 WeakPolarHBondContact O-CG 3.37Å; A54-M58 PolarHBondContact O-N 3.4Å; L55-M58 HydrophobicContact CD2-CE 3.79Å; L55-M58 PolarHBondContact O-N 3.07Å; I56-M58 PolarHBondContact O-N 3.1Å; M58-R61 PolarHBondContact O-N 3.33Å; M58-S62 WeakPolarHBondContact O-CB 3.49Å; M58-S62 PolarHBondContact O-N 2.97Å; M58-S62 PolarHBondContact O-OG 3.11Å; M58-F76 HydrophobicContact CB-CE1 3.88Å; M58-F76 HydrophobicContact CB-CZ 4.11Å; M58-F81 HydrophobicContact CE-CE2 3.99Å; M58-F81 HydrophobicContact CE-CZ 3.93Å; M58-Y136 HydrophobicContact CG-CD1 3.63Å; M58-Y136 HydrophobicContact CG-CD2 4.29Å; M58-Y136 HydrophobicContact CG-CE1 3.6Å; M58-Y136 HydrophobicContact CG-CE2 4.26Å; M58-Y136 HydrophobicContact CG-CG 3.99Å; M58-Y136 HydrophobicContact SD-CD1 4.3Å; M58-Y136 HydrophobicContact SD-CD2 4.31Å; M58-Y136 HydrophobicContact SD-CG 4.09Å
59A97.2Very high95.3Very high2 Ų246.9 Ų46.92%0.01726%0.26CS..Hα-helixtrans-61.4-48.3178.100000111.5L55 I56 A57 S62 A63 I73 F76L55-A59 PolarHBondContact O-N 2.98Å; L55-A59 VanDerWaalsContact O-N 3.08Å; I56-A59 WeakPolarHBondContact O-CB 3.47Å; I56-A59 PolarHBondContact O-N 3.04Å; I56-A59 VanDerWaalsContact O-N 3.16Å; A57-A59 VanDerWaalsContact C-N 3.35Å; A57-A59 PolarHBondContact O-N 2.92Å; A59-S62 PolarHBondContact O-N 3.05Å; A59-S62 PolarHBondContact O-OG 3.11Å; A59-A63 PolarHBondContact O-N 3.34Å; A59-I73 HydrophobicContact CB-CB 4.47Å; A59-I73 HydrophobicContact CB-CG1 4.2Å; A59-I73 HydrophobicContact CB-CG2 4.3Å; A59-F76 VanDerWaalsContact CA-CD1 3.46Å; A59-F76 HydrophobicContact CB-CB 3.96Å; A59-F76 HydrophobicContact CB-CD1 3.39Å; A59-F76 HydrophobicContact CB-CE1 3.97Å; A59-F76 HydrophobicContact CB-CG 3.7Å
60I96.3Very high95.6Very high0 Ų045.1 Ų45.10%025%0.246CC..Hα-helixtrans-63.7-44.5179.8-67.8174.4000111I56 A57 S62 A63 Q66 A68 F105 W121 L123I56-I60 HydrophobicContact CG2-CD1 3.77Å; I56-I60 HydrophobicContact CG2-CG1 4.33Å; I56-I60 WeakPolarHBondContact O-CG1 3.44Å; I56-I60 PolarHBondContact O-N 2.98Å; A57-I60 PolarHBondContact O-N 3.12Å; I60-S62 VanDerWaalsContact C-N 3.29Å; I60-S62 PolarHBondContact O-N 3.03Å; I60-A63 PolarHBondContact O-N 3.12Å; I60-Q66 WeakPolarHBondContact CG2-O 3.35Å; I60-Q66 WeakPolarHBondContact O-CA 3.5Å; I60-A68 HydrophobicContact CG1-CB 4.08Å; I60-F105 HydrophobicContact CD1-CD1 3.85Å; I60-F105 HydrophobicContact CD1-CE1 4.15Å; I60-W121 HydrophobicContact CD1-CB 4.39Å; I60-L123 HydrophobicContact CB-CD1 4.35Å; I60-L123 HydrophobicContact CB-CG 4.31Å; I60-L123 HydrophobicContact CD1-CG 4.26Å; I60-L123 HydrophobicContact CG2-CD1 4.15Å; I60-L123 HydrophobicContact CG2-CG 3.99Å
61R94.1Very high95.8Very high127 Ų12745.3 Ų45.348%0.47926%0.257SS..Hα-helixtrans-63.6-34.1178.8-173.5178.3175.7170.45.1112.7A57 M58 A63 F131 E132 Y136A57-R61 WeakPolarHBondContact O-CB 3.3Å; A57-R61 PolarHBondContact O-N 2.75Å; M58-R61 PolarHBondContact O-N 3.33Å; R61-A63 VanDerWaalsContact C-N 3.33Å; R61-F131 PolarHBondContact NH1-O 3.13Å; R61-E132 PolarHBondContact NH1-O 2.86Å; R61-Y136 VanDerWaalsContact CD-OH 3.28Å; R61-Y136 WeakPolarHBondContact CD-OH 3.32Å; R61-Y136 PolarHBondContact NH1-OH 3.3Å
62S94.8Very high95.9Very high70 Ų7044.5 Ų44.549%0.4926%0.255SS..Hα-helixtrans-75.4-21.8177.6750000113.8M58 A59 I60 F76M58-S62 WeakPolarHBondContact O-CB 3.49Å; M58-S62 PolarHBondContact O-N 2.97Å; M58-S62 PolarHBondContact O-OG 3.11Å; A59-S62 PolarHBondContact O-N 3.05Å; A59-S62 PolarHBondContact O-OG 3.11Å; I60-S62 VanDerWaalsContact C-N 3.29Å; I60-S62 PolarHBondContact O-N 3.03Å; S62-F76 VanDerWaalsContact OG-CD2 3.25Å; S62-F76 WeakPolarHBondContact OG-CD2 3.49Å; S62-F76 WeakPolarHBondContact OG-CE2 3.17Å
63A95.4Very high95.9Very high21 Ų2141.7 Ų41.717%0.17424%0.244CC..SBendtrans-79144.4-176.200000111.4A59 I60 R61 G65 Q66 R67 A68A59-A63 PolarHBondContact O-N 3.34Å; I60-A63 PolarHBondContact O-N 3.12Å; R61-A63 VanDerWaalsContact C-N 3.33Å; A63-G65 PolarHBondContact O-N 3.38Å; A63-Q66 PolarHBondContact O-N 3.05Å; A63-Q66 VanDerWaalsContact O-N 3.1Å; A63-R67 WeakPolarHBondContact CB-O 3.28Å; A63-A68 HydrophobicContact CB-CB 4.21Å
64P93.4Very high96.1Very high122 Ų12241 Ų4179%0.79224%0.239SC*.G310 helixtrans-61.9132.8176.326.3-34.1000110.7Q66P64-Q66 VanDerWaalsContact C-N 3.29Å; P64-Q66 PolarHBondContact O-N 3.5Å
65G93.4Very high96.2Very high65 Ų6546.2 Ų46.267%0.6726%0.263SS*.G310 helixtrans7220.8-176.700000114.3A63 R67A63-G65 PolarHBondContact O-N 3.38Å; G65-R67 WeakPolarHBondContact O-CG 3.46Å; G65-R67 PolarHBondContact O-N 3.1Å
66Q95.1Very high96.2Very high107 Ų10748.1 Ų48.150%0.527%0.271SS..G310 helixtrans51.334.5174.8-59.3-176.81.600113.5I60 A63 P64 T122I60-Q66 WeakPolarHBondContact CG2-O 3.35Å; I60-Q66 WeakPolarHBondContact O-CA 3.5Å; A63-Q66 PolarHBondContact O-N 3.05Å; A63-Q66 VanDerWaalsContact O-N 3.1Å; P64-Q66 VanDerWaalsContact C-N 3.29Å; P64-Q66 PolarHBondContact O-N 3.5Å; Q66-T122 PolarHBondContact O-OG1 3.01Å
67R95.6Very high96.2Very high120 Ų12048.1 Ų48.145%0.45327%0.271SS..EExtended strand (participates in β ladder)trans-141.7135.9-179.565.4-172.4179.2177-2110.1A63 G65 Y120 W121A63-R67 WeakPolarHBondContact CB-O 3.28Å; G65-R67 WeakPolarHBondContact O-CG 3.46Å; G65-R67 PolarHBondContact O-N 3.1Å; R67-Y120 HydrophobicContact CB-CD1 4.48Å; R67-Y120 HydrophobicContact CG-CD1 4.13Å; R67-Y120 HydrophobicContact CG-CG 4.5Å; R67-W121 CarbonylContact C-O 3.55Å; R67-W121 VanDerWaalsContact CA-O 3.27Å; R67-W121 WeakPolarHBondContact CA-O 3.36Å
68A97Very high96.2Very high9 Ų949.6 Ų49.67%0.07428%0.278CS..EExtended strand (participates in β ladder)trans-129.2152-179.200000111I60 A63 I73 W121I60-A68 HydrophobicContact CG1-CB 4.08Å; A63-A68 HydrophobicContact CB-CB 4.21Å; A68-I73 HydrophobicContact CB-CD1 4.46Å; A68-I73 HydrophobicContact CB-CG1 3.89Å; A68-W121 PolarHBondContact N-O 3.47Å; A68-W121 PolarHBondContact O-N 3.33Å
69T97.2Very high96.2Very high32 Ų3254.9 Ų54.920%0.19631%0.307CS..EExtended strand (participates in β ladder)trans-86.7161.4168.8660000109.7S71 G72 I73 Y120T69-S71 PolarHBondContact O-N 3.38Å; T69-G72 PolarHBondContact O-N 3.34Å; T69-G72 PolarHBondContact OG1-N 3.03Å; T69-G72 VanDerWaalsContact OG1-N 3.14Å; T69-I73 WeakPolarHBondContact O-CG1 3.41Å; T69-I73 PolarHBondContact O-N 3.37Å; T69-Y120 HydrophobicContact CG2-CD1 3.72Å; T69-Y120 HydrophobicContact CG2-CE1 3.56Å
70L97.1Very high96.2Very high51 Ų5161.9 Ų61.927%0.26733%0.333SS..Hα-helixtrans-53.2-41.4174.2-17962.7000112.3I73 Y74 I95 R96 L99L70-I73 PolarHBondContact O-N 2.96Å; L70-Y74 HydrophobicContact CD1-CD1 4.45Å; L70-Y74 HydrophobicContact CD1-CE1 3.57Å; L70-Y74 HydrophobicContact CD1-CE2 4.36Å; L70-Y74 WeakPolarHBondContact CD1-OH 3.28Å; L70-Y74 HydrophobicContact CD2-CE2 4.39Å; L70-Y74 WeakPolarHBondContact CD2-OH 3.35Å; L70-Y74 HydrophobicContact CG-CE1 4.03Å; L70-Y74 HydrophobicContact CG-CE2 3.9Å; L70-Y74 WeakPolarHBondContact CG-OH 3.5Å; L70-Y74 WeakPolarHBondContact O-CD1 3.44Å; L70-Y74 PolarHBondContact O-N 3.49Å; L70-I95 HydrophobicContact CD1-CG2 4.21Å; L70-R96 HydrophobicContact CD1-CG 4.06Å; L70-R96 HydrophobicContact CD2-CG 4.02Å; L70-L99 HydrophobicContact CD1-CD1 3.57Å
71S97.2Very high96.1Very high68 Ų6862.9 Ų62.948%0.47634%0.337SS..Hα-helixtrans-64.7-41.5176.5-166.10000112T69 I73 Y74 Q75T69-S71 PolarHBondContact O-N 3.38Å; S71-I73 VanDerWaalsContact C-N 3.33Å; S71-I73 PolarHBondContact O-N 3.41Å; S71-Y74 WeakPolarHBondContact O-CB 3.42Å; S71-Y74 PolarHBondContact O-N 3.44Å; S71-Q75 PolarHBondContact O-N 3.16Å; S71-Q75 VanDerWaalsContact O-N 3.1Å
72G97.1Very high96.1Very high22 Ų2259.9 Ų59.923%0.22733%0.334CS..Hα-helixtrans-64.4-37.3177.500000112.6T69 Y74 Q75 F76T69-G72 PolarHBondContact O-N 3.34Å; T69-G72 PolarHBondContact OG1-N 3.03Å; T69-G72 VanDerWaalsContact OG1-N 3.14Å; G72-Y74 VanDerWaalsContact C-N 3.33Å; G72-Y74 PolarHBondContact O-N 2.94Å; G72-Q75 PolarHBondContact O-N 3.47Å; G72-F76 WeakPolarHBondContact O-CB 3.43Å; G72-F76 PolarHBondContact O-N 3.26Å
73I97.9Very high96Very high0 Ų060.1 Ų60.10%033%0.327CS..Hα-helixtrans-63.1-41.5174.9-63.7163.1000110.6I56 A59 A68 T69 L70 S71 I77 I95 L99I56-I73 HydrophobicContact CG1-CG2 4.19Å; I56-I73 HydrophobicContact CG2-CD1 4.17Å; A59-I73 HydrophobicContact CB-CB 4.47Å; A59-I73 HydrophobicContact CB-CG1 4.2Å; A59-I73 HydrophobicContact CB-CG2 4.3Å; A68-I73 HydrophobicContact CB-CD1 4.46Å; A68-I73 HydrophobicContact CB-CG1 3.89Å; T69-I73 WeakPolarHBondContact O-CG1 3.41Å; T69-I73 PolarHBondContact O-N 3.37Å; L70-I73 PolarHBondContact O-N 2.96Å; S71-I73 VanDerWaalsContact C-N 3.33Å; S71-I73 PolarHBondContact O-N 3.41Å; I73-I77 HydrophobicContact CG2-CD1 3.82Å; I73-I77 VanDerWaalsContact O-CG1 3.28Å; I73-I77 WeakPolarHBondContact O-CG1 3.29Å; I73-I77 PolarHBondContact O-N 2.94Å; I73-I77 VanDerWaalsContact O-N 3.12Å; I73-I95 HydrophobicContact CG2-CG2 4.03Å; I73-L99 HydrophobicContact CD1-CD1 4.18Å; I73-L99 HydrophobicContact CD1-CD2 4.14Å
74Y97.6Very high96Very high29 Ų2959.3 Ų59.311%0.11432%0.319CS..Hα-helixtrans-61.7-47.7177-59.8-23.3000111.9L70 S71 G72 I77 M78 W91 Q92 I95 R96L70-Y74 HydrophobicContact CD1-CD1 4.45Å; L70-Y74 HydrophobicContact CD1-CE1 3.57Å; L70-Y74 HydrophobicContact CD1-CE2 4.36Å; L70-Y74 WeakPolarHBondContact CD1-OH 3.28Å; L70-Y74 HydrophobicContact CD2-CE2 4.39Å; L70-Y74 WeakPolarHBondContact CD2-OH 3.35Å; L70-Y74 HydrophobicContact CG-CE1 4.03Å; L70-Y74 HydrophobicContact CG-CE2 3.9Å; L70-Y74 WeakPolarHBondContact CG-OH 3.5Å; L70-Y74 WeakPolarHBondContact O-CD1 3.44Å; L70-Y74 PolarHBondContact O-N 3.49Å; S71-Y74 WeakPolarHBondContact O-CB 3.42Å; S71-Y74 PolarHBondContact O-N 3.44Å; G72-Y74 VanDerWaalsContact C-N 3.33Å; G72-Y74 PolarHBondContact O-N 2.94Å; Y74-I77 PolarHBondContact O-N 3.45Å; Y74-M78 WeakPolarHBondContact O-CE 3.11Å; Y74-M78 VanDerWaalsContact O-CG 3.3Å; Y74-M78 WeakPolarHBondContact O-CG 3.42Å; Y74-M78 PolarHBondContact O-N 2.94Å; Y74-M78 VanDerWaalsContact O-N 3.11Å; Y74-W91 HydrophobicContact CD1-CH2 4.16Å; Y74-W91 AromaticContact CD1-CZ3 3.85Å; Y74-W91 HydrophobicContact CD1-CZ3 3.85Å; Y74-W91 HydrophobicContact CG-CH2 4.35Å; Y74-W91 HydrophobicContact CG-CZ3 4.49Å; Y74-Q92 HydrophobicContact CD1-CG 3.84Å; Y74-Q92 HydrophobicContact CD2-CG 4.36Å; Y74-Q92 HydrophobicContact CE1-CB 3.88Å; Y74-Q92 HydrophobicContact CE1-CG 3.7Å; Y74-Q92 HydrophobicContact CE2-CG 4.23Å; Y74-Q92 HydrophobicContact CG-CG 4.16Å; Y74-I95 HydrophobicContact CD1-CG2 4.35Å; Y74-I95 HydrophobicContact CE1-CB 4.17Å; Y74-I95 HydrophobicContact CE1-CG2 3.89Å; Y74-R96 WeakPolarHBondContact OH-CG 3.47Å; Y74-R96 PolarHBondContact OH-NH1 3.08Å
75Q97.6Very high96.1Very high109 Ų10958 Ų5851%0.50930%0.303SS..Hα-helixtrans-60.6-51.2179.2-72.8174.6-23.500110.8S71 G72 I77 M78 D79S71-Q75 PolarHBondContact O-N 3.16Å; S71-Q75 VanDerWaalsContact O-N 3.1Å; G72-Q75 PolarHBondContact O-N 3.47Å; Q75-I77 VanDerWaalsContact C-N 3.29Å; Q75-I77 PolarHBondContact O-N 3.45Å; Q75-M78 HydrophobicContact CG-CE 4.42Å; Q75-M78 PolarHBondContact O-N 3.43Å; Q75-M78 VanDerWaalsContact O-N 3.09Å; Q75-D79 WeakPolarHBondContact O-CB 3.41Å; Q75-D79 PolarHBondContact O-N 2.97Å
76F97.6Very high96Very high40 Ų4060.8 Ų60.818%0.17530%0.302CS..Hα-helixtrans-52.2-47178179-92.4000112.4M58 A59 S62 G72 D79 R80M58-F76 HydrophobicContact CB-CE1 3.88Å; M58-F76 HydrophobicContact CB-CZ 4.11Å; A59-F76 VanDerWaalsContact CA-CD1 3.46Å; A59-F76 HydrophobicContact CB-CB 3.96Å; A59-F76 HydrophobicContact CB-CD1 3.39Å; A59-F76 HydrophobicContact CB-CE1 3.97Å; A59-F76 HydrophobicContact CB-CG 3.7Å; S62-F76 VanDerWaalsContact OG-CD2 3.25Å; S62-F76 WeakPolarHBondContact OG-CD2 3.49Å; S62-F76 WeakPolarHBondContact OG-CE2 3.17Å; G72-F76 WeakPolarHBondContact O-CB 3.43Å; G72-F76 PolarHBondContact O-N 3.26Å; F76-D79 PolarHBondContact O-N 3Å; F76-R80 HydrophobicContact CE1-CG 4.47Å; F76-R80 HydrophobicContact CE2-CG 4.43Å; F76-R80 HydrophobicContact CZ-CG 4.14Å; F76-R80 WeakPolarHBondContact O-CB 3.27Å; F76-R80 PolarHBondContact O-N 2.95Å
77I97.3Very high95.8Very high0 Ų062 Ų620%031%0.312CS..Hα-helixtrans-65.8-42.9-178.6-66.5170000111.3L55 I73 Y74 Q75 D79 F81 Y84 W91 I95L55-I77 HydrophobicContact CB-CD1 3.99Å; L55-I77 HydrophobicContact CB-CG1 4.25Å; I73-I77 HydrophobicContact CG2-CD1 3.82Å; I73-I77 VanDerWaalsContact O-CG1 3.28Å; I73-I77 WeakPolarHBondContact O-CG1 3.29Å; I73-I77 PolarHBondContact O-N 2.94Å; I73-I77 VanDerWaalsContact O-N 3.12Å; Y74-I77 PolarHBondContact O-N 3.45Å; Q75-I77 VanDerWaalsContact C-N 3.29Å; Q75-I77 PolarHBondContact O-N 3.45Å; I77-D79 VanDerWaalsContact C-N 3.33Å; I77-D79 PolarHBondContact O-N 3.23Å; I77-F81 WeakPolarHBondContact O-CA 3.26Å; I77-F81 WeakPolarHBondContact O-CB 3.03Å; I77-F81 PolarHBondContact O-N 3.41Å; I77-Y84 HydrophobicContact CG2-CD2 3.43Å; I77-Y84 VanDerWaalsContact CG2-CD2 3.43Å; I77-Y84 HydrophobicContact CG2-CE2 4.13Å; I77-Y84 HydrophobicContact CG2-CG 3.67Å; I77-W91 HydrophobicContact CD1-CZ3 4.32Å; I77-W91 HydrophobicContact CG2-CZ3 4.43Å; I77-I95 HydrophobicContact CD1-CD1 3.63Å; I77-I95 HydrophobicContact CD1-CG1 4.21Å
78M96.2Very high95.7Very high31 Ų3160.6 Ų60.615%0.15331%0.309CS..Hα-helixtrans-66.9-34.8-179.8-68.4-178.2-57.100112.6Y74 Q75 Q85 K88 W91Y74-M78 WeakPolarHBondContact O-CE 3.11Å; Y74-M78 VanDerWaalsContact O-CG 3.3Å; Y74-M78 WeakPolarHBondContact O-CG 3.42Å; Y74-M78 PolarHBondContact O-N 2.94Å; Y74-M78 VanDerWaalsContact O-N 3.11Å; Q75-M78 HydrophobicContact CG-CE 4.42Å; Q75-M78 PolarHBondContact O-N 3.43Å; Q75-M78 VanDerWaalsContact O-N 3.09Å; M78-Q85 HydrophobicContact CB-CG 4.3Å; M78-Q85 PolarHBondContact O-NE2 3.37Å; M78-K88 HydrophobicContact SD-CD 4.08Å; M78-K88 PolarHBondContact SD-NZ 3.14Å; M78-W91 HydrophobicContact CG-CH2 3.99Å; M78-W91 HydrophobicContact CG-CZ2 3.75Å; M78-W91 HydrophobicContact SD-CH2 4.36Å; M78-W91 HydrophobicContact SD-CZ2 3.99Å
79D96.3Very high95.6Very high127 Ų12768 Ų6868%0.67934%0.342SS*.Hα-helixtrans-75.3-40.6-179-62.2-14.4000111.1Q75 F76 I77Q75-D79 WeakPolarHBondContact O-CB 3.41Å; Q75-D79 PolarHBondContact O-N 2.97Å; F76-D79 PolarHBondContact O-N 3Å; I77-D79 VanDerWaalsContact C-N 3.33Å; I77-D79 PolarHBondContact O-N 3.23Å
80R95.3Very high95.5Very high150 Ų15068.2 Ų68.257%0.56635%0.35SS*.Hα-helixtrans-81-31.5-178.9-114.2-90.2-154169.54.8113.7F76F76-R80 HydrophobicContact CE1-CG 4.47Å; F76-R80 HydrophobicContact CE2-CG 4.43Å; F76-R80 HydrophobicContact CZ-CG 4.14Å; F76-R80 WeakPolarHBondContact O-CB 3.27Å; F76-R80 PolarHBondContact O-N 2.95Å
81F94.8Very high95.5Very high20 Ų2066.4 Ų66.49%0.08834%0.34CS..  trans-133.691-171.2-58.2-66000110P48 Y50 L55 M58 I77 F83 Y84P48-F81 HydrophobicContact CB-CD1 3.89Å; P48-F81 HydrophobicContact CB-CE1 4.04Å; P48-F81 HydrophobicContact CB-CG 4.46Å; P48-F81 HydrophobicContact CG-CB 3.87Å; P48-F81 HydrophobicContact CG-CD1 3.38Å; P48-F81 HydrophobicContact CG-CE1 4.06Å; P48-F81 HydrophobicContact CG-CG 3.71Å; Y50-F81 AromaticContact CD2-CE1 3.92Å; Y50-F81 HydrophobicContact CD2-CE1 3.92Å; Y50-F81 AromaticContact CD2-CZ 3.7Å; Y50-F81 HydrophobicContact CD2-CZ 3.7Å; Y50-F81 AromaticContact CE2-CE1 3.78Å; Y50-F81 HydrophobicContact CE2-CE1 3.78Å; Y50-F81 AromaticContact CE2-CZ 3.75Å; Y50-F81 HydrophobicContact CE2-CZ 3.75Å; L55-F81 HydrophobicContact CD2-CD2 3.68Å; L55-F81 HydrophobicContact CD2-CE2 3.36Å; L55-F81 HydrophobicContact CD2-CZ 4.1Å; M58-F81 HydrophobicContact CE-CE2 3.99Å; M58-F81 HydrophobicContact CE-CZ 3.93Å; I77-F81 WeakPolarHBondContact O-CA 3.26Å; I77-F81 WeakPolarHBondContact O-CB 3.03Å; I77-F81 PolarHBondContact O-N 3.41Å; F81-F83 PolarHBondContact O-N 3.21Å; F81-Y84 HydrophobicContact CB-CD2 3.78Å; F81-Y84 HydrophobicContact CB-CE2 4.28Å; F81-Y84 PolarHBondContact O-N 3.25Å
82P93.6Very high95.5Very high65 Ų6564.8 Ų64.842%0.42233%0.325SS..G310 helixtrans-54-25.9-177.6-29.636.4000114.6P45 Y84 Q85P45-P82 HydrophobicContact CB-CB 4.23Å; P82-Y84 PolarHBondContact O-N 3.41Å; P82-Q85 WeakPolarHBondContact O-CB 3.39Å; P82-Q85 WeakPolarHBondContact O-CG 3.44Å; P82-Q85 PolarHBondContact O-N 3.47Å
83F94.3Very high95.5Very high74 Ų7468.2 Ų68.233%0.32534%0.338SS..G310 helixtrans-50.3-30.4172.9174.5-102.8000114.1P45 K47 F81P45-F83 HydrophobicContact CB-CB 4.23Å; P45-F83 WeakPolarHBondContact O-CD2 3.01Å; K47-F83 HydrophobicContact CB-CD1 4.13Å; K47-F83 HydrophobicContact CB-CD2 4.3Å; K47-F83 HydrophobicContact CB-CE1 3.79Å; K47-F83 HydrophobicContact CB-CE2 3.94Å; K47-F83 HydrophobicContact CB-CG 4.37Å; K47-F83 HydrophobicContact CB-CZ 3.67Å; K47-F83 HydrophobicContact CD-CE1 4.01Å; K47-F83 HydrophobicContact CD-CZ 4.06Å; K47-F83 HydrophobicContact CG-CD1 4.09Å; K47-F83 HydrophobicContact CG-CE1 3.6Å; K47-F83 HydrophobicContact CG-CZ 3.9Å; F81-F83 PolarHBondContact O-N 3.21Å
84Y95.4Very high95.5Very high5 Ų570 Ų702%0.0235%0.351CS..G310 helixtrans-94.57.4-178.3-66.2-72.4000113.9P48 Y52 L55 I77 F81 P82 D86 W91P48-Y84 HydrophobicContact CG-CE2 4.07Å; Y52-Y84 HydrophobicContact CE1-CE1 4.18Å; L55-Y84 HydrophobicContact CD1-CE2 3.79Å; I77-Y84 HydrophobicContact CG2-CD2 3.43Å; I77-Y84 VanDerWaalsContact CG2-CD2 3.43Å; I77-Y84 HydrophobicContact CG2-CE2 4.13Å; I77-Y84 HydrophobicContact CG2-CG 3.67Å; F81-Y84 HydrophobicContact CB-CD2 3.78Å; F81-Y84 HydrophobicContact CB-CE2 4.28Å; F81-Y84 PolarHBondContact O-N 3.25Å; P82-Y84 PolarHBondContact O-N 3.41Å; Y84-D86 VanDerWaalsContact C-N 3.33Å; Y84-W91 HydrophobicContact CD1-CB 3.91Å; Y84-W91 AromaticContact CD1-CD1 3.87Å; Y84-W91 AromaticContact CD1-CD2 4Å; Y84-W91 HydrophobicContact CD1-CD2 4Å; Y84-W91 AromaticContact CD1-CG 3.67Å; Y84-W91 HydrophobicContact CD1-CG 3.67Å; Y84-W91 HydrophobicContact CE1-CB 4.11Å; Y84-W91 HydrophobicContact CE1-CG 4.37Å; Y84-W91 VanDerWaalsContact O-CE2 3.24Å; Y84-W91 VanDerWaalsContact O-CZ2 3.26Å; Y84-W91 WeakPolarHBondContact O-CZ2 3.22Å; Y84-W91 PolarHBondContact O-NE1 3.49Å
85Q94.4Very high95.5Very high94 Ų9468.6 Ų68.644%0.43935%0.345SS..SBendtrans-69.6-35.2177-69.5-179.27.600111.6M78 P82 K88M78-Q85 HydrophobicContact CB-CG 4.3Å; M78-Q85 PolarHBondContact O-NE2 3.37Å; P82-Q85 WeakPolarHBondContact O-CB 3.39Å; P82-Q85 WeakPolarHBondContact O-CG 3.44Å; P82-Q85 PolarHBondContact O-N 3.47Å; Q85-K88 WeakPolarHBondContact O-CG 3.46Å; Q85-K88 PolarHBondContact O-NZ 3.2Å
86D91.4Very high95.5Very high124 Ų12468 Ų6866%0.66334%0.338SS*.SBendtrans-88.4167.7176.8-59.5-41.3000112.4Y84 K88 W91Y84-D86 VanDerWaalsContact C-N 3.33Å; D86-K88 VanDerWaalsContact C-N 3.27Å; D86-K88 PolarHBondContact O-N 2.84Å; D86-K88 VanDerWaalsContact O-N 3.13Å; D86-W91 PolarHBondContact O-NE1 3.06Å
87N91.2Very high95.6Very high131 Ų13171 Ų7170%0.70135%0.352SS*.  trans47.744.6176.4-161.1-91.6000113.9Q89 G90 W91N87-Q89 PolarHBondContact O-N 3.35Å; N87-Q89 VanDerWaalsContact O-N 3.07Å; N87-G90 PolarHBondContact O-N 3.16Å; N87-G90 VanDerWaalsContact O-N 3.16Å; N87-W91 VanDerWaalsContact O-CD1 3.27Å
88K93.2Very high95.6Very high92 Ų9272.1 Ų72.140%0.436%0.358SS..Hα-helixtrans-50.9-40.4-172.6-62.4-169.3-162.9-61.20113.6M78 Q85 D86 G90 Q92M78-K88 HydrophobicContact SD-CD 4.08Å; M78-K88 PolarHBondContact SD-NZ 3.14Å; Q85-K88 WeakPolarHBondContact O-CG 3.46Å; Q85-K88 PolarHBondContact O-NZ 3.2Å; D86-K88 VanDerWaalsContact C-N 3.27Å; D86-K88 PolarHBondContact O-N 2.84Å; D86-K88 VanDerWaalsContact O-N 3.13Å; K88-G90 VanDerWaalsContact C-N 3.35Å; K88-G90 PolarHBondContact O-N 3.07Å; K88-Q92 WeakPolarHBondContact O-CB 3.41Å; K88-Q92 WeakPolarHBondContact O-CG 3.47Å; K88-Q92 PolarHBondContact O-N 3.41Å
89Q95Very high95.7Very high165 Ų16570.8 Ų70.877%0.77135%0.352SS*.Hα-helixtrans-62.4-37.9-175.2-171.2167.4-800113.6N87 N93N87-Q89 PolarHBondContact O-N 3.35Å; N87-Q89 VanDerWaalsContact O-N 3.07Å; Q89-N93 WeakPolarHBondContact O-CB 3.45Å; Q89-N93 PolarHBondContact O-N 3.47Å
90G95.4Very high95.7Very high35 Ų3569 Ų6936%0.36135%0.35SS..Hα-helixtrans-68.2-58.3-175.900000112.2N87 K88 N93 S94N87-G90 PolarHBondContact O-N 3.16Å; N87-G90 VanDerWaalsContact O-N 3.16Å; K88-G90 VanDerWaalsContact C-N 3.35Å; K88-G90 PolarHBondContact O-N 3.07Å; G90-N93 WeakPolarHBondContact O-CB 3.48Å; G90-N93 PolarHBondContact O-N 3.15Å; G90-S94 PolarHBondContact O-N 3.21Å
91W96.3Very high95.7Very high13 Ų1366.4 Ų66.45%0.04935%0.346CS..Hα-helixtrans-72.2-33.1-177.666.6-101.1000112.5Y52 Y74 I77 M78 Y84 D86 N87 N93 S94 I95Y52-W91 HydrophobicContact CE1-CB 4.32Å; Y74-W91 HydrophobicContact CD1-CH2 4.16Å; Y74-W91 AromaticContact CD1-CZ3 3.85Å; Y74-W91 HydrophobicContact CD1-CZ3 3.85Å; Y74-W91 HydrophobicContact CG-CH2 4.35Å; Y74-W91 HydrophobicContact CG-CZ3 4.49Å; I77-W91 HydrophobicContact CD1-CZ3 4.32Å; I77-W91 HydrophobicContact CG2-CZ3 4.43Å; M78-W91 HydrophobicContact CG-CH2 3.99Å; M78-W91 HydrophobicContact CG-CZ2 3.75Å; M78-W91 HydrophobicContact SD-CH2 4.36Å; M78-W91 HydrophobicContact SD-CZ2 3.99Å; Y84-W91 HydrophobicContact CD1-CB 3.91Å; Y84-W91 AromaticContact CD1-CD1 3.87Å; Y84-W91 AromaticContact CD1-CD2 4Å; Y84-W91 HydrophobicContact CD1-CD2 4Å; Y84-W91 AromaticContact CD1-CG 3.67Å; Y84-W91 HydrophobicContact CD1-CG 3.67Å; Y84-W91 HydrophobicContact CE1-CB 4.11Å; Y84-W91 HydrophobicContact CE1-CG 4.37Å; Y84-W91 VanDerWaalsContact O-CE2 3.24Å; Y84-W91 VanDerWaalsContact O-CZ2 3.26Å; Y84-W91 WeakPolarHBondContact O-CZ2 3.22Å; Y84-W91 PolarHBondContact O-NE1 3.49Å; D86-W91 PolarHBondContact O-NE1 3.06Å; N87-W91 VanDerWaalsContact O-CD1 3.27Å; W91-N93 PolarHBondContact O-N 3.49Å; W91-S94 WeakPolarHBondContact O-CA 3.1Å; W91-S94 WeakPolarHBondContact O-CB 3.45Å; W91-S94 PolarHBondContact O-N 3.17Å; W91-I95 HydrophobicContact CE3-CG1 3.82Å; W91-I95 HydrophobicContact CZ3-CG1 4.09Å; W91-I95 WeakPolarHBondContact O-CG1 3.45Å; W91-I95 PolarHBondContact O-N 2.96Å
92Q97.8Very high95.7Very high35 Ų3567 Ų6716%0.16435%0.35CS..Hα-helixtrans-63.6-32.7175.8-72.9179.13.700112Y74 K88 S94 I95 R96Y74-Q92 HydrophobicContact CD1-CG 3.84Å; Y74-Q92 HydrophobicContact CD2-CG 4.36Å; Y74-Q92 HydrophobicContact CE1-CB 3.88Å; Y74-Q92 HydrophobicContact CE1-CG 3.7Å; Y74-Q92 HydrophobicContact CE2-CG 4.23Å; Y74-Q92 HydrophobicContact CG-CG 4.16Å; K88-Q92 WeakPolarHBondContact O-CB 3.41Å; K88-Q92 WeakPolarHBondContact O-CG 3.47Å; K88-Q92 PolarHBondContact O-N 3.41Å; Q92-S94 VanDerWaalsContact C-N 3.33Å; Q92-I95 PolarHBondContact O-N 3.16Å; Q92-R96 WeakPolarHBondContact O-CG 3.46Å; Q92-R96 PolarHBondContact O-N 3.08Å; Q92-R96 PolarHBondContact O-NH1 3.19Å
93N97.7Very high95.8Very high93 Ų9370.8 Ų70.850%0.49737%0.367SS..Hα-helixtrans-63.7-42.8173.2-165.937.3000111.6Q89 G90 W91 I95 R96 H97Q89-N93 WeakPolarHBondContact O-CB 3.45Å; Q89-N93 PolarHBondContact O-N 3.47Å; G90-N93 WeakPolarHBondContact O-CB 3.48Å; G90-N93 PolarHBondContact O-N 3.15Å; W91-N93 PolarHBondContact O-N 3.49Å; N93-I95 VanDerWaalsContact C-N 3.3Å; N93-I95 PolarHBondContact O-N 3.17Å; N93-R96 PolarHBondContact O-N 3.29Å; N93-R96 PolarHBondContact OD1-NH2 2.89Å; N93-R96 VanDerWaalsContact OD1-NH2 3.16Å; N93-H97 WeakPolarHBondContact O-CB 3.35Å; N93-H97 PolarHBondContact O-N 2.78Å
94S97.6Very high95.8Very high38 Ų3868.6 Ų68.627%0.26636%0.361SS..Hα-helixtrans-62.3-37.4174.6-62.90000111.9Y52 G90 W91 Q92 N98Y52-S94 VanDerWaalsContact CE2-CB 3.4Å; G90-S94 PolarHBondContact O-N 3.21Å; W91-S94 WeakPolarHBondContact O-CA 3.1Å; W91-S94 WeakPolarHBondContact O-CB 3.45Å; W91-S94 PolarHBondContact O-N 3.17Å; Q92-S94 VanDerWaalsContact C-N 3.33Å; S94-N98 WeakPolarHBondContact O-CB 3.45Å; S94-N98 PolarHBondContact O-N 3.35Å; S94-N98 PolarHBondContact O-ND2 3.03Å
95I97.9Very high95.8Very high0 Ų068.8 Ų68.80%036%0.362CS..Hα-helixtrans-63.1-49.9174.6-65.7-65.5000111.2Y52 I56 L70 I73 Y74 I77 W91 Q92 N93 H97 N98 L99Y52-I95 HydrophobicContact CD1-CD1 3.76Å; Y52-I95 HydrophobicContact CD1-CG1 4.45Å; Y52-I95 HydrophobicContact CG-CD1 4.32Å; I56-I95 HydrophobicContact CD1-CD1 4.14Å; I56-I95 HydrophobicContact CD1-CG2 4.3Å; I56-I95 HydrophobicContact CG1-CD1 3.91Å; I56-I95 HydrophobicContact CG1-CG2 4.31Å; L70-I95 HydrophobicContact CD1-CG2 4.21Å; I73-I95 HydrophobicContact CG2-CG2 4.03Å; Y74-I95 HydrophobicContact CD1-CG2 4.35Å; Y74-I95 HydrophobicContact CE1-CB 4.17Å; Y74-I95 HydrophobicContact CE1-CG2 3.89Å; I77-I95 HydrophobicContact CD1-CD1 3.63Å; I77-I95 HydrophobicContact CD1-CG1 4.21Å; W91-I95 HydrophobicContact CE3-CG1 3.82Å; W91-I95 HydrophobicContact CZ3-CG1 4.09Å; W91-I95 WeakPolarHBondContact O-CG1 3.45Å; W91-I95 PolarHBondContact O-N 2.96Å; Q92-I95 PolarHBondContact O-N 3.16Å; N93-I95 VanDerWaalsContact C-N 3.3Å; N93-I95 PolarHBondContact O-N 3.17Å; I95-H97 VanDerWaalsContact C-N 3.3Å; I95-H97 PolarHBondContact O-N 3.01Å; I95-N98 PolarHBondContact O-N 2.93Å; I95-L99 HydrophobicContact CG2-CD1 4.15Å; I95-L99 WeakPolarHBondContact O-CG 3.45Å; I95-L99 PolarHBondContact O-N 3.42Å
96R98Very high95.9Very high97 Ų9767.6 Ų67.637%0.36636%0.357SS..Hα-helixtrans-57.8-44.8178-70.6-172.8-59.7-88.97111.9L70 Y74 Q92 N93 L99 S100L70-R96 HydrophobicContact CD1-CG 4.06Å; L70-R96 HydrophobicContact CD2-CG 4.02Å; Y74-R96 WeakPolarHBondContact OH-CG 3.47Å; Y74-R96 PolarHBondContact OH-NH1 3.08Å; Q92-R96 WeakPolarHBondContact O-CG 3.46Å; Q92-R96 PolarHBondContact O-N 3.08Å; Q92-R96 PolarHBondContact O-NH1 3.19Å; N93-R96 PolarHBondContact O-N 3.29Å; N93-R96 PolarHBondContact OD1-NH2 2.89Å; N93-R96 VanDerWaalsContact OD1-NH2 3.16Å; R96-L99 PolarHBondContact O-N 3.4Å; R96-S100 PolarHBondContact O-N 2.74Å; R96-S100 PolarHBondContact O-OG 3.1Å
97H98.1Very high96.2Very high101 Ų10168.4 Ų68.447%0.46836%0.355SS..Hα-helixtrans-61.2-44.4177171.367.7000112.4N93 I95 L99 S100 L101N93-H97 WeakPolarHBondContact O-CB 3.35Å; N93-H97 PolarHBondContact O-N 2.78Å; I95-H97 VanDerWaalsContact C-N 3.3Å; I95-H97 PolarHBondContact O-N 3.01Å; H97-L99 VanDerWaalsContact C-N 3.35Å; H97-L99 PolarHBondContact O-N 3.17Å; H97-S100 PolarHBondContact O-N 2.94Å; H97-S100 PolarHBondContact O-OG 2.92Å; H97-L101 WeakPolarHBondContact CE1-CD1 3.36Å; H97-L101 VanDerWaalsContact NE2-CD1 3.26Å; H97-L101 WeakPolarHBondContact NE2-CD1 3.5Å; H97-L101 VanDerWaalsContact O-CB 3.22Å; H97-L101 WeakPolarHBondContact O-CB 3.48Å; H97-L101 PolarHBondContact O-N 3.26Å
98N97.9Very high96.4Very high24 Ų2464.8 Ų64.813%0.12834%0.336CS..Hα-helixtrans-66.8-34.7-179.5-85.8-94.2000113I56 S94 I95 S100 L101 N102I56-N98 HydrophobicContact CD1-CB 3.9Å; S94-N98 WeakPolarHBondContact O-CB 3.45Å; S94-N98 PolarHBondContact O-N 3.35Å; S94-N98 PolarHBondContact O-ND2 3.03Å; I95-N98 PolarHBondContact O-N 2.93Å; N98-S100 VanDerWaalsContact C-N 3.29Å; N98-S100 PolarHBondContact O-N 3.23Å; N98-L101 PolarHBondContact O-N 3.49Å; N98-N102 PolarHBondContact O-N 3.22Å; N98-N102 PolarHBondContact O-ND2 3.3Å; N98-N102 PolarHBondContact OD1-ND2 2.93Å
99L97.5Very high96.4Very high4 Ų465.8 Ų65.82%0.02135%0.352CS..Hα-helixtrans-63.6-34.5175.8-73.4168.5000112.3I56 L70 I73 I95 R96 H97 F105 W121I56-L99 HydrophobicContact CD1-CD2 4.13Å; I56-L99 HydrophobicContact CD1-CG 4.09Å; I56-L99 HydrophobicContact CG2-CD2 3.71Å; L70-L99 HydrophobicContact CD1-CD1 3.57Å; I73-L99 HydrophobicContact CD1-CD1 4.18Å; I73-L99 HydrophobicContact CD1-CD2 4.14Å; I95-L99 HydrophobicContact CG2-CD1 4.15Å; I95-L99 WeakPolarHBondContact O-CG 3.45Å; I95-L99 PolarHBondContact O-N 3.42Å; R96-L99 PolarHBondContact O-N 3.4Å; H97-L99 VanDerWaalsContact C-N 3.35Å; H97-L99 PolarHBondContact O-N 3.17Å; L99-F105 HydrophobicContact CD2-CB 4.01Å; L99-F105 HydrophobicContact CD2-CD1 4.47Å; L99-F105 HydrophobicContact CD2-CD2 4.24Å; L99-F105 HydrophobicContact CD2-CG 3.98Å; L99-W121 HydrophobicContact CB-CD2 4.36Å; L99-W121 HydrophobicContact CB-CE3 4.27Å; L99-W121 HydrophobicContact CB-CH2 3.94Å; L99-W121 HydrophobicContact CB-CZ2 4.05Å; L99-W121 HydrophobicContact CB-CZ3 4.06Å; L99-W121 HydrophobicContact CD1-CD2 4.4Å; L99-W121 HydrophobicContact CD2-CB 4.31Å; L99-W121 HydrophobicContact CD2-CD2 3.88Å; L99-W121 HydrophobicContact CD2-CE3 4Å; L99-W121 HydrophobicContact CD2-CG 4.03Å; L99-W121 HydrophobicContact CG-CD2 4.45Å; L99-W121 WeakPolarHBondContact O-CZ3 3.2Å
100S96.7Very high96.1Very high90 Ų9061.2 Ų61.263%0.62933%0.327SS*.Hα-helixtrans-88.9-25.3177.253.50000114.2R96 H97 N98R96-S100 PolarHBondContact O-N 2.74Å; R96-S100 PolarHBondContact O-OG 3.1Å; H97-S100 PolarHBondContact O-N 2.94Å; H97-S100 PolarHBondContact O-OG 2.92Å; N98-S100 VanDerWaalsContact C-N 3.29Å; N98-S100 PolarHBondContact O-N 3.23Å
101L96.1Very high95.8Very high94 Ų9466.5 Ų66.549%0.49234%0.342SS..Hα-helixtrans-81.4-38.4-175.1-178.7152.2000112.6H97 N98H97-L101 WeakPolarHBondContact CE1-CD1 3.36Å; H97-L101 VanDerWaalsContact NE2-CD1 3.26Å; H97-L101 WeakPolarHBondContact NE2-CD1 3.5Å; H97-L101 VanDerWaalsContact O-CB 3.22Å; H97-L101 WeakPolarHBondContact O-CB 3.48Å; H97-L101 PolarHBondContact O-N 3.26Å; N98-L101 PolarHBondContact O-N 3.49Å
102N95.1Very high95.1Very high32 Ų3276.5 Ų76.517%0.17139%0.386CS..  trans-102.4128.5-172-57.2-88000110.9I53 N98 C104 F105I53-N102 WeakPolarHBondContact CD1-OD1 3.41Å; N98-N102 PolarHBondContact O-N 3.22Å; N98-N102 PolarHBondContact O-ND2 3.3Å; N98-N102 PolarHBondContact OD1-ND2 2.93Å; N102-C104 PolarHBondContact O-N 2.99Å; N102-C104 VanDerWaalsContact O-N 3.09Å; N102-F105 HydrophobicContact CB-CD2 4.27Å; N102-F105 HydrophobicContact CB-CE2 4.46Å; N102-F105 PolarHBondContact O-N 3.39Å; N102-F105 VanDerWaalsContact O-N 3.16Å
103D94.4Very high94.3Very high145 Ų14577.8 Ų77.878%0.77541%0.409SS*.THydrogen-bonded Turntrans-64.9-14.5178.3-59-31.6000113.6F105D103-F105 PolarHBondContact O-N 3.41Å; D103-F105 VanDerWaalsContact O-N 3.12Å
104C94.2Very high93.5Very high29 Ų2982.2 Ų82.220%0.19642%0.419CS..THydrogen-bonded Turntrans-58.1-22.6172.5-57.70000113.1N102 L123 D124 C127N102-C104 PolarHBondContact O-N 2.99Å; N102-C104 VanDerWaalsContact O-N 3.09Å; C104-L123 WeakPolarHBondContact O-CA 2.93Å; C104-D124 PolarHBondContact O-N 3.37Å; C104-C127 HydrophobicContact CB-CB 3.81Å; C104-C127 VanDerWaalsContact CB-SG 3.58Å; C104-C127 PolarHBondContact O-SG 3.36Å; C104-C127 VanDerWaalsContact O-SG 3.37Å; C104-C127 VanDerWaalsContact SG-CB 3.6Å
105F96.6Very high92.7Very high9 Ų986.7 Ų86.74%0.03945%0.447CS..EExtended strand (participates in β ladder)trans-112.9111.9-178.5-54.8-59.2000110.6I53 I56 I60 L99 N102 D103 W121 T122 L123I53-F105 HydrophobicContact CB-CE2 4.46Å; I53-F105 HydrophobicContact CB-CZ 4.41Å; I53-F105 HydrophobicContact CG1-CE2 4.5Å; I53-F105 HydrophobicContact CG2-CE2 4.04Å; I53-F105 HydrophobicContact CG2-CZ 3.8Å; I56-F105 HydrophobicContact CB-CE1 3.82Å; I56-F105 HydrophobicContact CB-CE2 4.23Å; I56-F105 HydrophobicContact CB-CZ 3.59Å; I56-F105 HydrophobicContact CD1-CE2 3.94Å; I56-F105 HydrophobicContact CD1-CZ 4.19Å; I56-F105 HydrophobicContact CG2-CD1 3.67Å; I56-F105 HydrophobicContact CG2-CD2 4.45Å; I56-F105 HydrophobicContact CG2-CE1 3.26Å; I56-F105 HydrophobicContact CG2-CE2 4.12Å; I56-F105 HydrophobicContact CG2-CG 4.25Å; I56-F105 HydrophobicContact CG2-CZ 3.52Å; I60-F105 HydrophobicContact CD1-CD1 3.85Å; I60-F105 HydrophobicContact CD1-CE1 4.15Å; L99-F105 HydrophobicContact CD2-CB 4.01Å; L99-F105 HydrophobicContact CD2-CD1 4.47Å; L99-F105 HydrophobicContact CD2-CD2 4.24Å; L99-F105 HydrophobicContact CD2-CG 3.98Å; N102-F105 HydrophobicContact CB-CD2 4.27Å; N102-F105 HydrophobicContact CB-CE2 4.46Å; N102-F105 PolarHBondContact O-N 3.39Å; N102-F105 VanDerWaalsContact O-N 3.16Å; D103-F105 PolarHBondContact O-N 3.41Å; D103-F105 VanDerWaalsContact O-N 3.12Å; F105-W121 HydrophobicContact CB-CE3 4.04Å; F105-W121 HydrophobicContact CB-CZ3 4.36Å; F105-T122 WeakPolarHBondContact CA-O 3.42Å; F105-L123 HydrophobicContact CD1-CD2 3.89Å; F105-L123 HydrophobicContact CE1-CD2 3.53Å
106I96.6Very high92.1Very high68 Ų6888.8 Ų88.835%0.34947%0.468SS..EExtended strand (participates in β ladder)trans-102.5137.4-179.966.9179.6000110.6W121 T122 D124I106-W121 WeakPolarHBondContact O-CA 3.48Å; I106-T122 HydrophobicContact CD1-CG2 3.49Å; I106-T122 VanDerWaalsContact CD1-CG2 3.49Å; I106-T122 HydrophobicContact CG1-CG2 3.18Å; I106-T122 PolarHBondContact N-O 2.93Å; I106-T122 PolarHBondContact O-N 3.06Å; I106-T122 VanDerWaalsContact O-N 3.1Å; I106-D124 HydrophobicContact CG2-CB 4.24Å
107K97Very high91.7Very high141 Ų14193.6 Ų93.661%0.61349%0.492SS*.EExtended strand (participates in β ladder)trans-85.1115.3179-175.4-177.4178-176.10109.8S119 W121K107-S119 WeakPolarHBondContact CE-OG 3.38Å; K107-W121 HydrophobicContact CB-CE3 4.22Å; K107-W121 HydrophobicContact CB-CH2 4.04Å; K107-W121 HydrophobicContact CB-CZ2 4.42Å; K107-W121 HydrophobicContact CB-CZ3 3.93Å; K107-W121 HydrophobicContact CG-CH2 4.49Å; K107-W121 HydrophobicContact CG-CZ2 4.42Å
108L94.9Very high91.4Very high56 Ų5691.2 Ų91.229%0.29349%0.494SS..EExtended strand (participates in β ladder)trans-94.7133.5176.6-68.5176.5000111.6Y120 T122L108-Y120 PolarHBondContact N-O 3.23Å; L108-Y120 PolarHBondContact O-N 3.26Å; L108-T122 HydrophobicContact CD1-CG2 3.51Å; L108-T122 HydrophobicContact CD2-CG2 4.32Å; L108-T122 HydrophobicContact CG-CG2 3.79Å
109P92.8Very high91.2Very high113 Ų11391.5 Ų91.573%0.73450%0.498SS*.PPolyproline II helixtrans-64148.8171.428-32.9000110.4
110R90Very high91.2Very high69 Ų6994.2 Ų94.226%0.2651%0.509SS..PPolyproline II helixtrans-77.7150.5172-77.2-176.2163.2-117.72.1110.2K112 G116 K117 G118 Y120R110-K112 PolarHBondContact O-N 3.32Å; R110-G116 WeakPolarHBondContact CD-O 3.38Å; R110-G116 VanDerWaalsContact CZ-C 3.46Å; R110-G116 PolarHBondContact NE-O 3.29Å; R110-G116 VanDerWaalsContact NH1-CA 3.26Å; R110-K117 PolarHBondContact NH2-O 3.34Å; R110-G118 WeakPolarHBondContact CD-O 3.47Å; R110-G118 PolarHBondContact NE-O 3.07Å; R110-Y120 HydrophobicContact CG-CD2 3.98Å; R110-Y120 HydrophobicContact CG-CE2 3.98Å
111E87.9Confident91.2Very high145 Ų14591.9 Ų91.968%0.67849%0.486SS*.PPolyproline II helixtrans-61.4133.6170.2-171.8177.9-17200110.3G113 R114E111-G113 PolarHBondContact O-N 3.35Å; E111-R114 PolarHBondContact O-N 3.27Å; E111-R114 VanDerWaalsContact O-N 3.17Å
112K81.6Confident91.3Very high223 Ų22388.4 Ų88.497%0.9747%0.469SS*.THydrogen-bonded Turntrans-64-10.8-172.7-63.6178.4-178.9178.10114R110R110-K112 PolarHBondContact O-N 3.32Å
113G82.3Confident91.3Very high62 Ų6287.9 Ų87.964%0.63947%0.466SS*.THydrogen-bonded Turntrans-96.2-7178.400000115.8E111 P115E111-G113 PolarHBondContact O-N 3.35Å; G113-P115 WeakPolarHBondContact O-CD 3.21Å
114R81Confident91.3Very high186 Ų18683.4 Ų83.470%0.70244%0.442SS*.  trans-119.489.8-178-65-157.6-175.2-122.82.7111.7E111 G116E111-R114 PolarHBondContact O-N 3.27Å; E111-R114 VanDerWaalsContact O-N 3.17Å; R114-G116 PolarHBondContact O-N 3.49Å; R114-G116 VanDerWaalsContact O-N 3.17Å
115P79.9Confident91.2Very high133 Ų13386.5 Ų86.586%0.86446%0.464SS*.  trans-61.8121.5176.826.4-33.1000109.1G113G113-P115 WeakPolarHBondContact O-CD 3.21Å
116G86.5Confident90.8Very high43 Ų4390 Ų9044%0.44349%0.49SS..  trans-169.2163.4174.400000112.5R110 R114R110-G116 WeakPolarHBondContact CD-O 3.38Å; R110-G116 VanDerWaalsContact CZ-C 3.46Å; R110-G116 PolarHBondContact NE-O 3.29Å; R110-G116 VanDerWaalsContact NH1-CA 3.26Å; R114-G116 PolarHBondContact O-N 3.49Å; R114-G116 VanDerWaalsContact O-N 3.17Å
117K88.2Confident90.3Very high199 Ų19986.8 Ų86.887%0.86547%0.473SS*.SBendtrans-73.2135.2-168.8-170.6174.3-178.7176.40112.4R110R110-K117 PolarHBondContact NH2-O 3.34Å
118G91.6Very high89.8Confident50 Ų5082.7 Ų82.752%0.51546%0.458SS..SBendtrans72.5-179.6171.300000114.4R110R110-G118 WeakPolarHBondContact CD-O 3.47Å; R110-G118 PolarHBondContact NE-O 3.07Å
119S95.1Very high89.2Confident30 Ų3085.2 Ų85.221%0.2147%0.471CS..  trans-100.2163.6176.2-59.30000111.2K107K107-S119 WeakPolarHBondContact CE-OG 3.38Å
120Y96.3Very high88.7Confident62 Ų6285.2 Ų85.224%0.24346%0.463CS..EExtended strand (participates in β ladder)trans-81.7148.7166.4-72.6-71.8000109.6R67 T69 L108 R110R67-Y120 HydrophobicContact CB-CD1 4.48Å; R67-Y120 HydrophobicContact CG-CD1 4.13Å; R67-Y120 HydrophobicContact CG-CG 4.5Å; T69-Y120 HydrophobicContact CG2-CD1 3.72Å; T69-Y120 HydrophobicContact CG2-CE1 3.56Å; L108-Y120 PolarHBondContact N-O 3.23Å; L108-Y120 PolarHBondContact O-N 3.26Å; R110-Y120 HydrophobicContact CG-CD2 3.98Å; R110-Y120 HydrophobicContact CG-CE2 3.98Å
121W97.6Very high88.2Confident41 Ų4183 Ų8316%0.15546%0.455CS..EExtended strand (participates in β ladder)trans-119.8132.8172.2-67.393.1000107.9I60 R67 A68 L99 F105 I106 K107I60-W121 HydrophobicContact CD1-CB 4.39Å; R67-W121 CarbonylContact C-O 3.55Å; R67-W121 VanDerWaalsContact CA-O 3.27Å; R67-W121 WeakPolarHBondContact CA-O 3.36Å; A68-W121 PolarHBondContact N-O 3.47Å; A68-W121 PolarHBondContact O-N 3.33Å; L99-W121 HydrophobicContact CB-CD2 4.36Å; L99-W121 HydrophobicContact CB-CE3 4.27Å; L99-W121 HydrophobicContact CB-CH2 3.94Å; L99-W121 HydrophobicContact CB-CZ2 4.05Å; L99-W121 HydrophobicContact CB-CZ3 4.06Å; L99-W121 HydrophobicContact CD1-CD2 4.4Å; L99-W121 HydrophobicContact CD2-CB 4.31Å; L99-W121 HydrophobicContact CD2-CD2 3.88Å; L99-W121 HydrophobicContact CD2-CE3 4Å; L99-W121 HydrophobicContact CD2-CG 4.03Å; L99-W121 HydrophobicContact CG-CD2 4.45Å; L99-W121 WeakPolarHBondContact O-CZ3 3.2Å; F105-W121 HydrophobicContact CB-CE3 4.04Å; F105-W121 HydrophobicContact CB-CZ3 4.36Å; I106-W121 WeakPolarHBondContact O-CA 3.48Å; K107-W121 HydrophobicContact CB-CE3 4.22Å; K107-W121 HydrophobicContact CB-CH2 4.04Å; K107-W121 HydrophobicContact CB-CZ2 4.42Å; K107-W121 HydrophobicContact CB-CZ3 3.93Å; K107-W121 HydrophobicContact CG-CH2 4.49Å; K107-W121 HydrophobicContact CG-CZ2 4.42Å
122T96.9Very high87.6Confident21 Ų2181.2 Ų81.213%0.12945%0.447CS..EExtended strand (participates in β ladder)trans-126.5163.8173.5-174.60000109.6Q66 F105 I106 L108Q66-T122 PolarHBondContact O-OG1 3.01Å; F105-T122 WeakPolarHBondContact CA-O 3.42Å; I106-T122 HydrophobicContact CD1-CG2 3.49Å; I106-T122 VanDerWaalsContact CD1-CG2 3.49Å; I106-T122 HydrophobicContact CG1-CG2 3.18Å; I106-T122 PolarHBondContact N-O 2.93Å; I106-T122 PolarHBondContact O-N 3.06Å; I106-T122 VanDerWaalsContact O-N 3.1Å; L108-T122 HydrophobicContact CD1-CG2 3.51Å; L108-T122 HydrophobicContact CD2-CG2 4.32Å; L108-T122 HydrophobicContact CG-CG2 3.79Å
123L95.6Very high87.3Confident20 Ų2077.7 Ų77.711%0.10544%0.439CS..EExtended strand (participates in β ladder)trans-77.4140.8168.9-74.2164.3000109.4A57 I60 C104 F105A57-L123 HydrophobicContact CB-CD1 4.25Å; A57-L123 HydrophobicContact CB-CD2 4.07Å; I60-L123 HydrophobicContact CB-CD1 4.35Å; I60-L123 HydrophobicContact CB-CG 4.31Å; I60-L123 HydrophobicContact CD1-CG 4.26Å; I60-L123 HydrophobicContact CG2-CD1 4.15Å; I60-L123 HydrophobicContact CG2-CG 3.99Å; C104-L123 WeakPolarHBondContact O-CA 2.93Å; F105-L123 HydrophobicContact CD1-CD2 3.89Å; F105-L123 HydrophobicContact CE1-CD2 3.53Å
124D95Very high87Confident51 Ų5176.9 Ų76.927%0.27343%0.43SS..  trans-69.4150.2167.2-176.532.7000110.8C104 I106 S126 C127 L128C104-D124 PolarHBondContact O-N 3.37Å; I106-D124 HydrophobicContact CG2-CB 4.24Å; D124-S126 VanDerWaalsContact C-N 3.26Å; D124-S126 PolarHBondContact O-N 3.49Å; D124-S126 WeakPolarHBondContact OD2-CB 3.43Å; D124-S126 PolarHBondContact OD2-N 2.79Å; D124-S126 PolarHBondContact OD2-OG 3.16Å; D124-C127 PolarHBondContact O-N 3.43Å; D124-C127 PolarHBondContact O-SG 3.17Å; D124-L128 PolarHBondContact O-N 3.06Å
125S92.4Very high87Confident95 Ų9572 Ų7266%0.66442%0.418SS*.Hα-helixtrans-63.1-34.7-179.9-57.60000111.5C127 L128S125-C127 PolarHBondContact O-N 2.97Å; S125-L128 WeakPolarHBondContact O-CB 3.32Å; S125-L128 PolarHBondContact O-N 3.46Å
126S87.9Confident87.1Confident83 Ų8367.2 Ų67.258%0.5838%0.383SS*.Hα-helixtrans-65.7-24.718072.10000114.1D124D124-S126 VanDerWaalsContact C-N 3.26Å; D124-S126 PolarHBondContact O-N 3.49Å; D124-S126 WeakPolarHBondContact OD2-CB 3.43Å; D124-S126 PolarHBondContact OD2-N 2.79Å; D124-S126 PolarHBondContact OD2-OG 3.16Å
127C87Confident86.9Confident0 Ų073.9 Ų73.90%040%0.395CS..Hα-helixtrans-100.1-7.1-177.776.20000113C104 D124 S125 D129 M130 F131C104-C127 HydrophobicContact CB-CB 3.81Å; C104-C127 VanDerWaalsContact CB-SG 3.58Å; C104-C127 PolarHBondContact O-SG 3.36Å; C104-C127 VanDerWaalsContact O-SG 3.37Å; C104-C127 VanDerWaalsContact SG-CB 3.6Å; D124-C127 PolarHBondContact O-N 3.43Å; D124-C127 PolarHBondContact O-SG 3.17Å; S125-C127 PolarHBondContact O-N 2.97Å; C127-D129 PolarHBondContact O-N 3.2Å; C127-M130 WeakPolarHBondContact O-CB 3.45Å; C127-M130 PolarHBondContact O-N 2.96Å; C127-F131 WeakPolarHBondContact O-CD2 3.38Å
128L84.4Confident86.2Confident55 Ų5574.4 Ų74.429%0.28839%0.391SS..Hα-helixtrans-63.6-44.9-175.5-153.8129.8000111D124 S125 M130 F131 E132D124-L128 PolarHBondContact O-N 3.06Å; S125-L128 WeakPolarHBondContact O-CB 3.32Å; S125-L128 PolarHBondContact O-N 3.46Å; L128-M130 PolarHBondContact O-N 3.43Å; L128-F131 PolarHBondContact O-N 3.46Å; L128-F131 VanDerWaalsContact O-N 3.08Å; L128-E132 PolarHBondContact O-N 3.47Å
129D84.2Confident85.4Confident109 Ų10981.5 Ų81.558%0.58340%0.403SS*.Hα-helixtrans-59-30.6177.6-62.77.2000112.7C127 F131 E132C127-D129 PolarHBondContact O-N 3.2Å; D129-F131 PolarHBondContact O-N 3.38Å; D129-F131 VanDerWaalsContact O-N 3.15Å; D129-E132 PolarHBondContact O-N 3.31Å
130M81.4Confident84.4Confident113 Ų11389.3 Ų89.356%0.55743%0.433SS*.Hα-helixtrans-64.4-23.2-179.5-57.8-169.9-171.400112.6C127 L128C127-M130 WeakPolarHBondContact O-CB 3.45Å; C127-M130 PolarHBondContact O-N 2.96Å; L128-M130 PolarHBondContact O-N 3.43Å
131F78.6Confident83.2Confident23 Ų2397.9 Ų97.910%0.10147%0.465CS..Hα-helixtrans-116.6-6.9-174.3-59.4-66.9000113.3I53 A57 R61 C127 L128 D129 G134 Y136I53-F131 HydrophobicContact CG2-CZ 3.85Å; A57-F131 HydrophobicContact CB-CD1 4.11Å; A57-F131 HydrophobicContact CB-CD2 3.94Å; A57-F131 HydrophobicContact CB-CE1 4.19Å; A57-F131 HydrophobicContact CB-CE2 4.04Å; A57-F131 HydrophobicContact CB-CG 3.99Å; A57-F131 HydrophobicContact CB-CZ 4.16Å; R61-F131 PolarHBondContact NH1-O 3.13Å; C127-F131 WeakPolarHBondContact O-CD2 3.38Å; L128-F131 PolarHBondContact O-N 3.46Å; L128-F131 VanDerWaalsContact O-N 3.08Å; D129-F131 PolarHBondContact O-N 3.38Å; D129-F131 VanDerWaalsContact O-N 3.15Å; F131-G134 PolarHBondContact O-N 2.96Å; F131-Y136 HydrophobicContact CB-CD1 4.43Å; F131-Y136 HydrophobicContact CB-CE1 3.66Å; F131-Y136 AromaticContact CD1-CD1 3.68Å; F131-Y136 HydrophobicContact CD1-CD1 3.68Å; F131-Y136 AromaticContact CD1-CE1 3.72Å; F131-Y136 HydrophobicContact CD1-CE1 3.72Å; F131-Y136 HydrophobicContact CE1-CD1 4.47Å; F131-Y136 HydrophobicContact CG-CD1 4.43Å; F131-Y136 HydrophobicContact CG-CE1 4.01Å; F131-Y136 PolarHBondContact O-OH 2.77Å; F131-Y136 VanDerWaalsContact O-OH 3.12Å
132E76.4Confident81.8Confident107 Ų107107.5 Ų107.550%0.550%0.501SS..Hα-helixtrans-64.7-46.8-171.6-167.3170.3-161.500112R61 L128 D129 G134R61-E132 PolarHBondContact NH1-O 2.86Å; L128-E132 PolarHBondContact O-N 3.47Å; D129-E132 PolarHBondContact O-N 3.31Å; E132-G134 PolarHBondContact O-N 3.3Å; E132-G134 VanDerWaalsContact O-N 3.11Å
133N75.4Confident80.3Confident149 Ų149111 Ų11180%0.79753%0.532SS*.THydrogen-bonded Turntrans-78.815.6-179.5-49.693.5000114.8N135N133-N135 VanDerWaalsContact C-N 3.31Å; N133-N135 PolarHBondContact O-N 3.4Å
134G75.3Confident78.7Confident45 Ų45119.1 Ų119.146%0.46457%0.567SS.*SBendtrans78.111176.500000115.1F131 E132 Y136F131-G134 PolarHBondContact O-N 2.96Å; E132-G134 PolarHBondContact O-N 3.3Å; E132-G134 VanDerWaalsContact O-N 3.11Å; G134-Y136 VanDerWaalsContact C-N 3.27Å; G134-Y136 WeakPolarHBondContact O-CD2 3.36Å; G134-Y136 PolarHBondContact O-N 3.16Å
135N81.1Confident76.6Confident84 Ų84121.5 Ų121.545%0.44959%0.587SS.*  trans-80.371.1176.9-169.413.1000112.2N133 R137N133-N135 VanDerWaalsContact C-N 3.31Å; N133-N135 PolarHBondContact O-N 3.4Å; N135-R137 VanDerWaalsContact C-N 3.33Å
136Y81.8Confident74.8Confident32 Ų32125.5 Ų125.513%0.12560%0.596CS.*  trans-86.1-8.7175.9-63.8-73.6000113.1Y50 A54 A57 M58 R61 F131 G134Y50-Y136 WeakPolarHBondContact CD1-O 3.22Å; A54-Y136 HydrophobicContact CB-CD1 4.35Å; A54-Y136 VanDerWaalsContact CB-O 3.29Å; A54-Y136 WeakPolarHBondContact CB-O 3.26Å; A57-Y136 HydrophobicContact CB-CE1 4.47Å; M58-Y136 HydrophobicContact CG-CD1 3.63Å; M58-Y136 HydrophobicContact CG-CD2 4.29Å; M58-Y136 HydrophobicContact CG-CE1 3.6Å; M58-Y136 HydrophobicContact CG-CE2 4.26Å; M58-Y136 HydrophobicContact CG-CG 3.99Å; M58-Y136 HydrophobicContact SD-CD1 4.3Å; M58-Y136 HydrophobicContact SD-CD2 4.31Å; M58-Y136 HydrophobicContact SD-CG 4.09Å; R61-Y136 VanDerWaalsContact CD-OH 3.28Å; R61-Y136 WeakPolarHBondContact CD-OH 3.32Å; R61-Y136 PolarHBondContact NH1-OH 3.3Å; F131-Y136 HydrophobicContact CB-CD1 4.43Å; F131-Y136 HydrophobicContact CB-CE1 3.66Å; F131-Y136 AromaticContact CD1-CD1 3.68Å; F131-Y136 HydrophobicContact CD1-CD1 3.68Å; F131-Y136 AromaticContact CD1-CE1 3.72Å; F131-Y136 HydrophobicContact CD1-CE1 3.72Å; F131-Y136 HydrophobicContact CE1-CD1 4.47Å; F131-Y136 HydrophobicContact CG-CD1 4.43Å; F131-Y136 HydrophobicContact CG-CE1 4.01Å; F131-Y136 PolarHBondContact O-OH 2.77Å; F131-Y136 VanDerWaalsContact O-OH 3.12Å; G134-Y136 VanDerWaalsContact C-N 3.27Å; G134-Y136 WeakPolarHBondContact O-CD2 3.36Å; G134-Y136 PolarHBondContact O-N 3.16Å
137R82.2Confident73.4Confident182 Ų182129.4 Ų129.469%0.68761%0.605SS**BIsolated β-bridgetrans-73.4140.2-177.1-66.7-179.171.1-175.43110.2Y50 N135 R139Y50-R137 HydrophobicContact CE1-CG 4.38Å; N135-R137 VanDerWaalsContact C-N 3.33Å; R137-R139 PolarHBondContact O-N 3.44Å; R137-R139 VanDerWaalsContact O-N 3.16Å
138R73.9Confident71.3Confident210 Ų210137.6 Ų137.679%0.79265%0.648SS**PPolyproline II helixtrans-62.7118.9178.9-167.4177.9-171.9-167.72.7110.3K140R138-K140 PolarHBondContact O-N 3.12Å
139R74.5Confident69.7Low199 Ų199139.3 Ų139.375%0.75167%0.671SS**PPolyproline II helixtrans-66.4126.8172.4-157-178.6-67139.6-1.3109.4R137 R141R137-R139 PolarHBondContact O-N 3.44Å; R137-R139 VanDerWaalsContact O-N 3.16Å; R139-R141 PolarHBondContact O-N 2.55Å
140K73.7Confident68.2Low195 Ų195140 Ų14085%0.84868%0.681SS**PPolyproline II helixtrans-66.2127.9173.6-171.4175.9-179.6178.80108.3R138 R142R138-K140 PolarHBondContact O-N 3.12Å; K140-R142 PolarHBondContact O-N 3.09Å; K140-R142 VanDerWaalsContact O-N 3.17Å
141R71.2Confident66.5Low241 Ų241141.3 Ų141.391%0.90969%0.69SS**PPolyproline II helixtrans-60.4119.7170.9-87.2-174153.4-176.9-6.5108R139R139-R141 PolarHBondContact O-N 2.55Å
142R69.4Low65.4Low243 Ų243145.5 Ų145.592%0.91772%0.722SS**PPolyproline II helixtrans-69.8128.7167.5-64.9-175179.4-152.70.4106.8K140 K144K140-R142 PolarHBondContact O-N 3.09Å; K140-R142 VanDerWaalsContact O-N 3.17Å; R142-K144 PolarHBondContact O-N 3.01Å
143A65.6Low63.9Low95 Ų95149.5 Ų149.579%0.78574%0.738SS**PPolyproline II helixtrans-61.2130.8171.100000107.8S145A143-S145 PolarHBondContact O-N 3.22Å
144K60.3Low62.5Low190 Ų190149.7 Ų149.783%0.82674%0.739SS**  trans-69.197.4178.3-172.178.3158.2173.50107.5R142 Q146R142-K144 PolarHBondContact O-N 3.01Å; K144-Q146 PolarHBondContact O-N 3.37Å
145S51.3Low61.2Low101 Ų101153.3 Ų153.371%0.70675%0.754SS**  trans-66116.6164.636.90000107.9A143 Q147A143-S145 PolarHBondContact O-N 3.22Å; S145-Q147 PolarHBondContact O-N 3.38Å
146Q55.4Low59.2Low180 Ų180152.9 Ų152.984%0.84177%0.77SS**  trans-70.280.4169.9-70.6-79.1-3.700108.4K144K144-Q146 PolarHBondContact O-N 3.37Å
147Q57.8Low57.4Low165 Ų165157.1 Ų157.177%0.77180%0.804SS**  trans-144.788.7165.5-80.9-171.3-8.400106.8S145S145-Q147 PolarHBondContact O-N 3.38Å
148D44.5Very low55.7Low172 Ų172160.3 Ų160.392%0.9282%0.817SS**  trans-162.671.7157.2-80.6-39.4000106.4
149A50.8Low54Low91 Ų91162.1 Ų162.175%0.75282%0.823SS**  trans-94.4128.5157.300000106.6D151A149-D151 PolarHBondContact O-N 3.27Å
150P51.9Low52.2Low122 Ų122156.6 Ų156.679%0.79282%0.82SS**  trans-70.5113176.526.9-30.9000109.9S152P150-S152 PolarHBondContact O-N 2.93Å
151D46.4Very low50.4Low141 Ų141156.8 Ų156.875%0.75482%0.821SS**  trans-72.7101171.7-176.826.8000109.6A149 K153A149-D151 PolarHBondContact O-N 3.27Å; D151-K153 PolarHBondContact O-N 2.88Å
152S54.7Low48.6Very low112 Ų112151.7 Ų151.778%0.78382%0.816SS**  trans-7899.6169.1-630000109.1P150 D154P150-S152 PolarHBondContact O-N 2.93Å; S152-D154 PolarHBondContact O-N 3.3Å
153K44Very low46.9Very low190 Ų190145 Ų14583%0.82681%0.806SS**  trans-56.8127.6167.4-76.9177.2174.11760111.4D151D151-K153 PolarHBondContact O-N 2.88Å
154D46.8Very low45.5Very low154 Ų154147.1 Ų147.182%0.82481%0.809SS**  trans-136122.3150.5-160.2-0.8000109.3S152S152-D154 PolarHBondContact O-N 3.3Å
155P47.8Very low44.2Very low120 Ų120143.1 Ų143.178%0.77981%0.806SS**  trans-101.1110.5178.334.6-23.5000110.7
156G38.5Very low43.6Very low76 Ų76143.8 Ų143.878%0.78481%0.81SS**  trans148.4103.8155.300000116.3
157S44.1Very low42.5Very low121 Ų121147 Ų14785%0.84682%0.815SS**  -173.7118.2122.4-171.40000109.8
158R47.3Very low41.2Very low249 Ų249142.5 Ų142.594%0.9481%0.812SS**  trans-80.7122.7166.9-72.7-175-99.1-167.7-6.8108.3
159R37.6Very low40.7Very low248 Ų248140.6 Ų140.694%0.93681%0.807SS**  trans-155.5141.9145.4-153.4165.2-179.5174.9-1.2111.7
160A37.6Very low39.9Very low82 Ų82144.5 Ų144.568%0.67881%0.814SS**  trans-100.4161.6-158.500000114.5
161K34.9Very low39.1Very low199 Ų199145 Ų14587%0.86581%0.81SS**  trans66.5123.1154.3-56.6-177.1-176.8177.90117.8
162V33.2Very low38.8Very low135 Ų135142.6 Ų142.682%0.81881%0.805SS**  179.7144.892.3160.60000109
163S34.5Very low37.6Very low101 Ų101143.5 Ų143.571%0.70680%0.801SS**  trans-54148.6172.649.30000115.2
164V35.5Very low37.3Very low140 Ų140143.5 Ų143.585%0.84880%0.795SS**  -166129.2128.5142.30000109.4
165S34.7Very low36.6Very low107 Ų107146.6 Ų146.675%0.74880%0.796SS**  trans-74.9136.4168.7170.10000109.7
166S37.3Very low36.1Very low115 Ų115147.5 Ų147.580%0.80480%0.799SS**  trans-166.6136.3148.1-80.60000112.7
167R32.6Very low36Very low248 Ų248147.9 Ų147.994%0.93680%0.795SS**  trans-58.2157.1175.6-68.8162.6-109.6-165.6-5.5112.7
168G30.6Very low36Very low69 Ų69148.2 Ų148.271%0.71179%0.794SS**  trans152.494.6150.100000116.7
169T35Very low35.6Very low132 Ų132142.3 Ų142.381%0.8179%0.786SS**  trans53102.9134.9-40.70000119.4N171T169-N171 PolarHBondContact O-N 2.99Å
170L33.3Very low36.2Very low173 Ų173135.8 Ų135.891%0.90678%0.775SS**  trans-66.1113.8152.9-178.280.8000108.3
171N34.6Very low36Very low133 Ų133139.1 Ų139.171%0.71178%0.782SS**  trans-127.9114.9157.3-147.711.5000108.5T169T169-N171 PolarHBondContact O-N 2.99Å
172S40.8Very low36Very low91 Ų91139.7 Ų139.764%0.63679%0.785SS**  trans-69.7124.416744.50000108.7
173D30.1Very low36.2Very low131 Ų131141.5 Ų141.570%0.70178%0.784SS**  trans-153.5152.4155.1-90.8-34.5000112.7
174W36.4Very low36.8Very low189 Ų189142 Ų14272%0.71679%0.785SS**  trans-96.8150.2-159.138.6-83.9000110.9
175R33.3Very low36.7Very low220 Ų220141.7 Ų141.783%0.8378%0.778SS**  trans71.2122.7168.2-58.7178.4-161.9-100.70.8116.5
176T36.7Very low36.7Very low139 Ų139143.4 Ų143.485%0.85378%0.784SS**  -175.9134.9101.6-61.60000108.7
177A36.7Very low37.2Very low83 Ų83145.9 Ų145.969%0.68678%0.783SS**  trans-70.3165.2176.200000112
178P42.7Very low37.9Very low128 Ų128139.6 Ų139.683%0.83178%0.775SS**  -143.2139.6105.833-16.7000114.7
179T40.4Very low38.4Very low126 Ų126142.5 Ų142.577%0.77378%0.779SS**  trans-70.7156.2156.451.70000109.6
180P49.8Very low38.4Very low110 Ų110143 Ų14371%0.71478%0.775SS**  -149.9150.67534.5-12.4000118.3
181N33.8Very low38.7Very low153 Ų153141.8 Ų141.882%0.81877%0.769SS**  trans63.6111.7138.5-62.4-6.4000121.7
182K34.3Very low38.6Very low211 Ų211143.5 Ų143.592%0.91777%0.77SS**  -167.4115.4107.6-104.7175.6-178.3-176.40111.7
183E37.9Very low38.2Very low172 Ų172148.9 Ų148.980%0.80478%0.782SS**  trans-75.6159157.9-111.8-179.6-158.600109.7
184P46.1Very low38.6Very low112 Ų112147.7 Ų147.773%0.72778%0.78SS**  -146.1154.363.337.3-16.8000118.8
185N33Very low39Very low133 Ų133148 Ų14871%0.71179%0.789SS**  trans49.1114.6139-74-33.1000121.6
186T36.6Very low39.3Very low143 Ų143145.8 Ų145.888%0.87779%0.789SS**  -157.4117.1123.5-41.90000110.3
187E47Very low39.7Very low167 Ų167146.4 Ų146.478%0.7879%0.787SS**PPolyproline II helixtrans-76.5144.4173.1-77-85139.700112.3
188P46.6Very low40.3Very low116 Ų116148.1 Ų148.175%0.75379%0.791SS**PPolyproline II helixtrans-102.3122.315432.4-25.3000111.9L190P188-L190 PolarHBondContact O-N 3.04Å
189V40.8Very low39.9Very low131 Ų131146.3 Ų146.379%0.79479%0.787SS**PPolyproline II helixtrans-55.6123.5177.1171.20000112.5
190L36Very low39.7Very low141 Ų141144.8 Ų144.874%0.73879%0.787SS**  trans-79.4106.3169.6-179.272.2000110.4P188 K192P188-L190 PolarHBondContact O-N 3.04Å; L190-K192 HydrophobicContact CD2-CG 4.35Å; L190-K192 HydrophobicContact CG-CG 4.46Å; L190-K192 PolarHBondContact O-N 3.46Å; L190-K192 VanDerWaalsContact O-N 3.13Å
191L38.4Very low39.3Very low148 Ų148148.5 Ų148.578%0.77580%0.795SS**  trans-74.799.2169.4-77.6168.1000110.4
192K33.4Very low39.6Very low170 Ų170152.3 Ų152.374%0.73980%0.798SS**  trans-76.2111.4161.6-67.6179.1178.8176.80108.6L190 T194L190-K192 HydrophobicContact CD2-CG 4.35Å; L190-K192 HydrophobicContact CG-CG 4.46Å; L190-K192 PolarHBondContact O-N 3.46Å; L190-K192 VanDerWaalsContact O-N 3.13Å; K192-T194 PolarHBondContact O-N 2.9Å
193F32.5Very low40Very low203 Ų203151.1 Ų151.189%0.8980%0.795SS**  trans-7896.7165.3-105.9-87.6000108.9
194T38.6Very low39.9Very low107 Ų107152.4 Ų152.466%0.65680%0.798SS**  trans-77.5120.7165.8-62.80000108.6K192 Q196K192-T194 PolarHBondContact O-N 2.9Å; T194-Q196 HydrophobicContact CG2-CG 4.47Å; T194-Q196 PolarHBondContact O-N 3.31Å
195Q44.3Very low39.4Very low194 Ų194151.5 Ų151.591%0.90780%0.8SS**  trans-70111.9170179.8163.477.100109.1
196Q39.9Very low39.3Very low175 Ų175154.2 Ų154.282%0.81881%0.808SS**  trans-117.1120.2168.3-92.1179.9-16.300110T194T194-Q196 HydrophobicContact CG2-CG 4.47Å; T194-Q196 PolarHBondContact O-N 3.31Å
197N44.3Very low39.1Very low152 Ų152155 Ų15581%0.81381%0.806SS**  trans-84.9135.7167.2-169.99.7000108.4
198P49.6Very low38.4Very low118 Ų118151.5 Ų151.577%0.76680%0.799SS**  trans-118.1134154.223-6.7000112.4
199A33.8Very low37.9Very low91 Ų91152.3 Ų152.375%0.75280%0.802SS**  trans-68.5151173.400000112.9
200A36.8Very low37.7Very low93 Ų93153.1 Ų153.177%0.76980%0.797SS**  trans40.9105.6142.400000119.1
201Q42.7Very low38.4Very low189 Ų189152.4 Ų152.488%0.88380%0.801SS**  trans-143.9116.9139.9-143.7134.8-9.800112.2
202R39.1Very low38.3Very low233 Ų233152.4 Ų152.488%0.87980%0.802SS**  trans-74.2119.4177175.7-178.9166.3-163.8-2108.9
203Q42.2Very low38.5Very low185 Ų185149.2 Ų149.286%0.86481%0.807SS**  trans-135.2137.6164.6-74.1-167.6-33.100111.6
204K35.9Very low38.9Very low200 Ų200147.5 Ų147.587%0.8781%0.807SS**  trans-75.4154.1-169.4-76.3173.7172.71800112.2
205A35.3Very low39.4Very low93 Ų93148.3 Ų148.377%0.76982%0.815SS**  trans-58149.4174.600000115.2
206H31.1Very low38.9Very low189 Ų189142.4 Ų142.488%0.87581%0.805SS**  trans-170.2145.5141.2-121.9-95.2000109.2
207I33.2Very low38.6Very low161 Ų161139.8 Ų139.883%0.82681%0.806SS**  trans111.3120-177.4-69165.1000110.5
208S31.8Very low38.3Very low92 Ų92136.1 Ų136.164%0.64380%0.798SS**  cis-169172.75.1-77.40000110.4
209T36.6Very low37.7Very low133 Ų133139.3 Ų139.382%0.81680%0.802SS**  trans92.5110.4142.2-28.60000119.2
210E37.2Very low37.8Very low148 Ų148145.8 Ų145.869%0.69281%0.807SS**  trans-31.4150.4147.9-71.1-83.9130.900115.2
211P49.7Very low37.7Very low127 Ų127145.2 Ų145.283%0.82580%0.803SS**  -144.4157.184.934.5-15.7000116.9
212N36.8Very low37.4Very low148 Ų148143.9 Ų143.979%0.79180%0.801SS**  trans-56.2141.1168.6-85.6-70.4000115.2
213A36.6Very low37.1Very low103 Ų103140.3 Ų140.385%0.85180%0.799SS**  trans-169142.5135.200000111.5
214D41.9Very low37.7Very low167 Ų167136.9 Ų136.989%0.89379%0.793SS**  trans-61.5167.9-165.3-85.5-46.1000119.8
215P49.7Very low37.5Very low124 Ų124131.9 Ų131.981%0.80579%0.788SS**  trans-98.4153.7-178.638.1-30.6000113.9
216G32.1Very low37.4Very low69 Ų69131.9 Ų131.971%0.71179%0.789SS**  trans-17594.5172.800000116.4
217S35.2Very low37.5Very low120 Ų120127.2 Ų127.284%0.83978%0.783SS**  trans65.2111.7143.452.50000122.9
218A36.9Very low37.8Very low76 Ų76129.4 Ų129.463%0.62879%0.789SS**  87.9115.9116.100000122.6
219Q37.5Very low38Very low184 Ų184133.4 Ų133.486%0.8680%0.798SS**  trans71.3142.3132.7-65169.2-46.900119.1
220R34.8Very low38Very low227 Ų227133.3 Ų133.386%0.85780%0.797SS**  cis-178.6146.5-9.9176.5173.9-170.7-163.25.3106.9
221A35.3Very low38.2Very low82 Ų82131.7 Ų131.768%0.67880%0.8SS**  trans67.5145.2162.300000117.7
222N36.8Very low37.3Very low160 Ų160137.6 Ų137.686%0.85681%0.806SS**  cis-161.8146.59.7-121.4-5.2000109.4
223L33.4Very low37.1Very low159 Ų159135.6 Ų135.683%0.83281%0.809SS**  trans-80.5-177.5162.7-82.7153.2000109.9
224P53.2Low37Very low113 Ų113137.6 Ų137.673%0.73481%0.806SS**  cis-145.2169.313.841-20000119.2
225A32.2Very low36.7Very low94 Ų94138.9 Ų138.978%0.77781%0.806SS**  trans61.5123.5132.600000124.1
226A32.8Very low36.1Very low94 Ų94140.7 Ų140.778%0.77780%0.804SS**  164.8105.7111.200000108.9
227A34.7Very low36.2Very low90 Ų90148.9 Ų148.974%0.74481%0.814SS**  65.7106.68100000115.1
228Q38.2Very low36.7Very low207 Ų207148.8 Ų148.897%0.96781%0.808SS**  -171.4137.6129.8-100.3163.161.300112.2
229Q36.2Very low36.7Very low177 Ų177150.7 Ų150.783%0.82781%0.808SS**  trans-109.2136.4-175.3-69.1170.2-0.600110.8
230T36.2Very low37.6Very low131 Ų131153.3 Ų153.380%0.80481%0.81SS**  trans57.8160.3141.161.90000120.4
231P41.7Very low38.6Very low114 Ų114147 Ų14774%0.7480%0.8SS**  cis-145.616825.940.1-17.7000120
232R30.4Very low39.7Very low251 Ų251152.3 Ų152.395%0.94781%0.808SS**  trans34.8121.6147.9-77.1-172.1173.1-177.9-0.8121.2
233A32.6Very low40.5Very low105 Ų105147.2 Ų147.287%0.86879%0.793SS**  trans-142.3146.713200000110.7
234N34.5Very low41.6Very low146 Ų146149.8 Ų149.878%0.78180%0.798SS**  trans-87.2107.1-159.1-172.430.4000111.1Q236N234-Q236 PolarHBondContact O-N 2.55Å
235E37.4Very low42.6Very low193 Ų193148.1 Ų148.190%0.90279%0.786SS**  trans-89.4107.1173.5-123.7174.8165.600110R237E235-R237 PolarHBondContact O-N 3.49Å
236Q37.1Very low44.5Very low162 Ų162149.7 Ų149.776%0.75778%0.78SS**  trans-60.5100.2178.8-76.9162.2-41.200110.5N234 T238N234-Q236 PolarHBondContact O-N 2.55Å; Q236-T238 VanDerWaalsContact C-N 3.3Å; Q236-T238 PolarHBondContact O-N 3.11Å
237R33Very low46.4Very low242 Ų242150.2 Ų150.291%0.91377%0.77SS**  trans-57.295.1156.4-169.6-178.8-168.8-157.23.1107.7E235 D239E235-R237 PolarHBondContact O-N 3.49Å; R237-D239 VanDerWaalsContact C-N 3.3Å; R237-D239 PolarHBondContact O-N 2.94Å
238T45.2Very low48.2Very low117 Ų117149.6 Ų149.672%0.71876%0.76SS**  trans-72.994.5170.851.30000107.9Q236 R240Q236-T238 VanDerWaalsContact C-N 3.3Å; Q236-T238 PolarHBondContact O-N 3.11Å; T238-R240 PolarHBondContact O-N 3.16Å
239D38.6Very low49.9Very low116 Ų116144.9 Ų144.962%0.6274%0.74SS**  trans-54.3107.9163.9-170.1-4.9000108.3R237 S241R237-D239 VanDerWaalsContact C-N 3.3Å; R237-D239 PolarHBondContact O-N 2.94Å; D239-S241 PolarHBondContact O-N 3.25Å; D239-S241 VanDerWaalsContact O-N 3.16Å; D239-S241 WeakPolarHBondContact OD1-CB 3.18Å; D239-S241 PolarHBondContact OD1-N 2.79Å; D239-S241 VanDerWaalsContact OD1-N 3.11Å; D239-S241 PolarHBondContact OD1-OG 2.94Å
240R55.4Low51.5Low239 Ų239141.6 Ų141.690%0.90273%0.728SS**  trans-77.417.3176.7-85.2-174.5172.4160-0.5112.6T238 K242T238-R240 PolarHBondContact O-N 3.16Å; R240-K242 VanDerWaalsContact C-N 3.3Å; R240-K242 PolarHBondContact O-N 2.97Å
241S56.1Low52.8Low94 Ų94139.2 Ų139.266%0.65772%0.716SS**  trans-89.753.6174.4-39.10000111.9D239D239-S241 PolarHBondContact O-N 3.25Å; D239-S241 VanDerWaalsContact O-N 3.16Å; D239-S241 WeakPolarHBondContact OD1-CB 3.18Å; D239-S241 PolarHBondContact OD1-N 2.79Å; D239-S241 VanDerWaalsContact OD1-N 3.11Å; D239-S241 PolarHBondContact OD1-OG 2.94Å
242K58Low53.6Low194 Ų194142.1 Ų142.184%0.84372%0.718SS**  trans-92.4101158.3-71.8-175-178.3179.80106.6R240R240-K242 VanDerWaalsContact C-N 3.3Å; R240-K242 PolarHBondContact O-N 2.97Å
243G53.3Low54.7Low53 Ų53136.1 Ų136.155%0.54670%0.704SS.*  trans-50.1150.4178.900000111.8T245G243-T245 PolarHBondContact O-N 3.25Å
244F57.7Low55.7Low214 Ų214138.2 Ų138.294%0.93970%0.696SS**  trans-60.285.8167.1-92.7-98.4000109.2
245T72.8Confident56.6Low77 Ų77138 Ų13847%0.47270%0.695SS.*  trans-105.9136.3168.2-50.90000108G243 D247 S248G243-T245 PolarHBondContact O-N 3.25Å; T245-D247 HydrophobicContact CG2-CB 4.26Å; T245-D247 WeakPolarHBondContact CG2-OD2 3.42Å; T245-D247 PolarHBondContact O-N 3.13Å; T245-D247 VanDerWaalsContact O-N 3.13Å; T245-S248 WeakPolarHBondContact O-CB 3.47Å; T245-S248 PolarHBondContact O-N 3.41Å
246I72.9Confident57.1Low127 Ų127137.6 Ų137.665%0.65169%0.693SS**Hα-helixtrans-53.7-35-178.6-65.4170.8000111.1S248 I249 L250I246-S248 VanDerWaalsContact C-N 3.26Å; I246-S248 PolarHBondContact O-N 3.05Å; I246-I249 WeakPolarHBondContact O-CB 3.48Å; I246-I249 PolarHBondContact O-N 3.27Å; I246-L250 HydrophobicContact CG2-CD1 4.04Å; I246-L250 HydrophobicContact CG2-CG 4.44Å; I246-L250 PolarHBondContact O-N 3.05Å
247D73.6Confident57.7Low105 Ų105134.1 Ų134.156%0.56169%0.692SS**Hα-helixtrans-60.5-32.1178.8-53.3-41.2000112.9T245 I249 L250 S251T245-D247 HydrophobicContact CG2-CB 4.26Å; T245-D247 WeakPolarHBondContact CG2-OD2 3.42Å; T245-D247 PolarHBondContact O-N 3.13Å; T245-D247 VanDerWaalsContact O-N 3.13Å; D247-I249 VanDerWaalsContact C-N 3.26Å; D247-I249 PolarHBondContact O-N 2.92Å; D247-L250 PolarHBondContact O-N 3.29Å; D247-S251 WeakPolarHBondContact O-CB 3.44Å; D247-S251 PolarHBondContact O-N 3.32Å; D247-S251 PolarHBondContact O-OG 3.27Å; D247-S251 VanDerWaalsContact O-OG 3.05Å
248S71.4Confident58.5Low78 Ų78133.5 Ų133.555%0.54569%0.689SS.*Hα-helixtrans-69-23.7177.5-175.20000113.2T245 I246T245-S248 WeakPolarHBondContact O-CB 3.47Å; T245-S248 PolarHBondContact O-N 3.41Å; I246-S248 VanDerWaalsContact C-N 3.26Å; I246-S248 PolarHBondContact O-N 3.05Å
249I73.3Confident58.4Low107 Ų107131.2 Ų131.255%0.54969%0.689SS.*Hα-helixtrans-81.7-38.9176.8-59174.3000109.3I246 D247I246-I249 WeakPolarHBondContact O-CB 3.48Å; I246-I249 PolarHBondContact O-N 3.27Å; D247-I249 VanDerWaalsContact C-N 3.26Å; D247-I249 PolarHBondContact O-N 2.92Å
250L70.8Confident58.8Low109 Ų109137.4 Ų137.457%0.57170%0.704SS**Hα-helixtrans-75-34.7-178.6-63.2176.2000112.6I246 D247 K252I246-L250 HydrophobicContact CG2-CD1 4.04Å; I246-L250 HydrophobicContact CG2-CG 4.44Å; I246-L250 PolarHBondContact O-N 3.05Å; D247-L250 PolarHBondContact O-N 3.29Å; L250-K252 VanDerWaalsContact C-N 3.31Å; L250-K252 PolarHBondContact O-N 3.27Å
251S63.8Low58.3Low80 Ų80132 Ų13256%0.55970%0.697SS**G310 helixtrans-68.5-27178-62.10000113.5D247 N253D247-S251 WeakPolarHBondContact O-CB 3.44Å; D247-S251 PolarHBondContact O-N 3.32Å; D247-S251 PolarHBondContact O-OG 3.27Å; D247-S251 VanDerWaalsContact O-OG 3.05Å; S251-N253 VanDerWaalsContact C-N 3.26Å; S251-N253 PolarHBondContact O-N 3.18Å
252K58.2Low57.4Low176 Ų176135.6 Ų135.677%0.76571%0.708SS**G310 helixtrans-75.9-11.2-175.2-160.7165.7-178.7174.60114.1L250L250-K252 VanDerWaalsContact C-N 3.31Å; L250-K252 PolarHBondContact O-N 3.27Å
253N53Low56.2Low124 Ų124134 Ų13466%0.66371%0.709SS**G310 helixtrans-100.2-2.4-178.2-73.8-11.9000114.3S251S251-N253 VanDerWaalsContact C-N 3.26Å; S251-N253 PolarHBondContact O-N 3.18Å
254Q54Low55.3Low149 Ų149137.6 Ų137.670%0.69672%0.72SS**SBendtrans-91.7-20.9-179.4-87.5-175.632.600114.8
255D52.9Low54Low142 Ų142133.3 Ų133.376%0.75972%0.716SS**G310 helixtrans-83.4-16.4-176.9-68.4-36.3000114A257D255-A257 VanDerWaalsContact C-N 3.32Å; D255-A257 PolarHBondContact O-N 3.46Å
256E48.8Very low52.3Low185 Ų185133.9 Ų133.986%0.86473%0.729SS**G310 helixtrans-79.5-14.1177.8-127-165.6136.400113.5
257A49.8Very low50.5Low88 Ų88137 Ų13773%0.72774%0.741SS**G310 helixtrans-91.50.8-175.100000114.7D255D255-A257 VanDerWaalsContact C-N 3.32Å; D255-A257 PolarHBondContact O-N 3.46Å
258R48.6Very low48.6Very low230 Ų230137 Ų13787%0.86875%0.749SS**SBendtrans-119.23.6-178.4-71.5-174.3173.2160.8-0.8115.3
259G42.6Very low47.1Very low69 Ų69141.3 Ų141.371%0.71177%0.765SS**SBendtrans-93.514.4-175.400000117.2
260R47.1Very low45.1Very low245 Ų245142.7 Ų142.793%0.92578%0.783SS**SBendtrans-132.154.4178.7-80.1-161.4-1701794.7113.5
261V45.7Very low43.6Very low127 Ų127141.8 Ų141.877%0.7779%0.791SS**SBendtrans-149.4135.9156.2-167.50000107.8
262L37.5Very low43.5Very low168 Ų168143.6 Ų143.688%0.8880%0.801SS**  trans9481.7172.4-46.9-179.4000116.4
263D32.9Very low43.1Very low161 Ų161141.5 Ų141.586%0.86181%0.805SS**  -149.7157.1124-16413.2000108.9
264V33.5Very low42.7Very low129 Ų129143 Ų14378%0.78281%0.812SS**  trans104.890.6-177.9-171.70000114.6
265S31.5Very low42Very low123 Ų123143.2 Ų143.286%0.8682%0.817SS**  trans-148.6106145.7-86.70000110.2
266A36.2Very low41Very low90 Ų90147.6 Ų147.674%0.74482%0.823SS**  trans175.1111.8132.200000108.8
267E35.3Very low40.3Very low192 Ų192143.2 Ų143.290%0.89781%0.812SS**  163132116.5-84.1-156.1148.100113.1
268S33Very low39.5Very low104 Ų104147.8 Ų147.873%0.72782%0.818SS**  trans71.3102140.1-141.90000122.7
269L40.6Very low39.9Very low169 Ų169141.1 Ų141.189%0.88581%0.805SS**  22.2117129.4-62.4164.3000119.4
270C32.5Very low39.7Very low137 Ų137145.4 Ų145.493%0.92681%0.806SS**  179.6151.8108.6-146.20000111.1
271A37.9Very low39.5Very low90 Ų90141.1 Ų141.174%0.74480%0.796SS**  trans-80.8176.7-175.200000113.1
272P61.2Low39.3Very low118 Ų118143.5 Ų143.577%0.76680%0.803SS**  trans-94.9-178.8-148.140.5-39.3000115.3
273P50.8Low39.8Very low131 Ų131140.6 Ų140.685%0.85179%0.793SS**  -144.6175.7117.835-17.1000116.8
274L45.6Very low40.2Very low156 Ų156142.2 Ų142.282%0.81780%0.795SS**  trans-79.9171.8-168.3-71.7165000117.2
275I38Very low40.8Very low154 Ų154142.4 Ų142.479%0.7980%0.796SS**  trans82.9119.2156.4-58.9144.3000117.2
276R31.4Very low41.1Very low234 Ų234139.7 Ų139.788%0.88379%0.787SS**  173.8153101.8-155155.6-178.6175.1-0.4114
277S34.3Very low41.5Very low92 Ų92143 Ų14364%0.64379%0.792SS**  trans-61.1144.3-171.751.10000120.4
278H34.2Very low42.7Very low185 Ų185139.6 Ų139.686%0.85679%0.786SS**  trans26.9167.5132.5-76.47000122.6
279P55.9Low43.4Very low90 Ų90143.8 Ų143.858%0.58479%0.792SS**  cis-139.6-174.7-48.438.9-19.3000112.1
280H38.4Very low43.4Very low158 Ų158142 Ų14273%0.73179%0.792SS**  trans153.2131.4131.7-83.6-71000116.3
281H43.2Very low43.9Very low155 Ų155140.8 Ų140.872%0.71879%0.785SS**  trans68.292.6146.1-80.6-80.9000121.6
282L41.4Very low44.5Very low177 Ų177146.2 Ų146.293%0.92779%0.788SS**  trans-107.8117.2140.6-109165.9000108.6
283V48.3Very low44.1Very low108 Ų108145.8 Ų145.866%0.65578%0.778SS**  trans-79.9122.1173.6169.60000108.4V285V283-V285 HydrophobicContact CG1-CG2 3.6Å
284Q40.7Very low43.9Very low195 Ų195145 Ų14591%0.91178%0.776SS**  trans-112.4112.1168.8-177.1157.1-15.900108.7
285V46.2Very low44Very low133 Ų133145 Ų14581%0.80678%0.776SS**  trans-127.3129.7167.2-123.30000103.9V283V283-V285 HydrophobicContact CG1-CG2 3.6Å
286G37.4Very low44.5Very low65 Ų65143.8 Ų143.867%0.6778%0.776SS**  cis162.7104.66.900000103.7
287L45.8Very low45.1Very low161 Ų161139 Ų13984%0.84378%0.777SS**  trans-91.3124.7175.9-73167.9000108.1F289L287-F289 PolarHBondContact O-N 3.37Å
288P59.8Low45.5Very low120 Ų120139.9 Ų139.978%0.77978%0.783SS**  trans-76.7113.8176.528.6-30.8000110.4C290P288-C290 PolarHBondContact O-N 3.34Å
289F47.6Very low46.1Very low191 Ų191138.3 Ų138.384%0.83878%0.781SS**  trans-68.9116.4164.1-85.4-92.7000109.6L287 S291L287-F289 PolarHBondContact O-N 3.37Å; F289-S291 PolarHBondContact O-N 3.2Å
290C41.8Very low45.6Very low133 Ų133138.9 Ų138.990%0.89979%0.787SS**  trans-65.8110165.8-70.30000109.6P288P288-C290 PolarHBondContact O-N 3.34Å
291S42.9Very low45.9Very low111 Ų111135.6 Ų135.678%0.77679%0.788SS**  trans-101.9111.7164.2-56.50000107.8F289F289-S291 PolarHBondContact O-N 3.2Å
292Y49.6Very low46.2Very low204 Ų204136 Ų13680%0.879%0.794SS**  trans-149.8117.8164.1-153.7-122.8000112.7
293L53.3Low46.4Very low108 Ų108138.4 Ų138.457%0.56579%0.791SS**  trans73.993.3158.1-62.5176.6000120.4L295L293-L295 PolarHBondContact O-N 3.13Å
294S45.6Very low46.2Very low116 Ų116142.8 Ų142.881%0.81180%0.801SS**  trans-59.6116.1134.3-63.10000110.1
295L49.4Very low46.9Very low154 Ų154145.6 Ų145.681%0.80681%0.814SS**  trans-111.1100.2158.4-92157.1000107.5L293 C297L293-L295 PolarHBondContact O-N 3.13Å; L295-C297 PolarHBondContact O-N 3.43Å
296T47.4Very low46.9Very low130 Ų130146.3 Ų146.380%0.79881%0.814SS**  trans-66.9115.6162.251.30000107.8
297C44.1Very low47.4Very low132 Ų132150.5 Ų150.589%0.89282%0.822SS**PPolyproline II helixtrans-99.8122.3166.9-1640000108.5L295L295-C297 PolarHBondContact O-N 3.43Å
298S42.6Very low47.5Very low112 Ų112149.9 Ų149.978%0.78382%0.821SS**PPolyproline II helixtrans-69.2138.3-179.6-62.50000112.3
299D46.1Very low46.8Very low151 Ų151151.7 Ų151.781%0.80782%0.823SS**PPolyproline II helixtrans-71.4126.1159.4-177.6-97.6000109.4
300S46.1Very low46.8Very low103 Ų103149.3 Ų149.372%0.7282%0.822SS**  trans166.1121.7143.2-78.10000112.5
301A44.6Very low47.1Very low89 Ų89150.3 Ų150.374%0.73682%0.817SS**  trans68.3113.9144.100000119.6
302L49Very low47.4Very low162 Ų162153.1 Ų153.185%0.84882%0.82SS**  -176131.889.6-91169.6000112.1
303R45.8Very low47.2Very low229 Ų229149.2 Ų149.286%0.86482%0.822SS**  trans-54.5151.9164.2-62.2173.5171.2159.4-3.2110.7
304F44.1Very low46.7Very low199 Ų199152.7 Ų152.787%0.87384%0.843SS**  -164.8120123.6-103.9-74.5000111
305H56.1Low46.8Very low255 Ų255156 Ų156100%1.18185%0.846SS**  trans27.50150.8-121.6-78.2000122.3

Retrieved 305 of 305 residues in 357.5 ms (Link to these results)