A0A087Y3N4_POEFO Loading...

Syntaxin-7

May be involved in protein trafficking from the plasma membrane to the early endosome (EE) as well as in homotypic fusion of endocytic organelles. Mediates the endocytic trafficking from early endosomes to late endosomes and lysosomes.

AlphaFold DB , UniProt , Accession A0A087Y3N4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 263 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
1V33.7Very low42Very low194 Ų194136.9 Ų136.9100%1.17680%0.804SS**  0105.40175.70000106.9
2A33.3Very low45.3Very low101 Ų101132.3 Ų132.384%0.83577%0.773SS**PPolyproline II helixtrans-74.4126.3-176.900000109.6
3M36.6Very low48.3Very low185 Ų185125.5 Ų125.591%0.91174%0.736SS**PPolyproline II helixtrans-84.6118.2171-81.2-75.2-156.500108.6
4A35.7Very low51Low80 Ų80123 Ų12366%0.66172%0.718SS**PPolyproline II helixtrans-65.5138-172.100000113.5H6A4-H6 PolarHBondContact O-N 2.98Å; A4-H6 PolarHBondContact O-ND1 2.81Å
5Y36.5Very low53.5Low232 Ų232118.7 Ų118.791%0.9169%0.694SS**  trans-40.5115.9161-68.7-97.9000111.7A7Y5-A7 PolarHBondContact O-N 2.95Å
6H40.3Very low55.8Low191 Ų191111.3 Ų111.388%0.88465%0.651SS**  trans-84.198.1164.5-86.951.2000108.7A4 G8A4-H6 PolarHBondContact O-N 2.98Å; A4-H6 PolarHBondContact O-ND1 2.81Å; H6-G8 PolarHBondContact O-N 3.2Å
7A40.9Very low57.8Low97 Ų97106.1 Ų106.180%0.80262%0.621SS**  trans-70.2119.8170.700000110.7Y5Y5-A7 PolarHBondContact O-N 2.95Å
8G42.5Very low59.6Low73 Ų73107.7 Ų107.775%0.75362%0.621SS**  trans42.883.5138.400000119.2H6H6-G8 PolarHBondContact O-N 3.2Å
9I42.8Very low61.3Low152 Ų152105.2 Ų105.278%0.77961%0.605SS**  trans-98.6125135.1-59.3174.6000104.7E11I9-E11 PolarHBondContact O-N 2.71Å
10P54.5Low62.9Low108 Ų108100 Ų10070%0.70158%0.575SS**  trans-58.7115.5169.123.3-29.2000107.1D12P10-D12 PolarHBondContact O-N 3.16Å
11E64.8Low64.3Low93 Ų9397 Ų9744%0.43556%0.561SS.*  trans-54.2128.2176-75.2-167.2138.900108.3I9 L16I9-E11 PolarHBondContact O-N 2.71Å; E11-L16 HydrophobicContact CB-CD1 4.22Å; E11-L16 HydrophobicContact CB-CD2 4.17Å; E11-L16 HydrophobicContact CB-CG 3.96Å; E11-L16 WeakPolarHBondContact OE2-CD2 3.32Å
12D82Confident67.2Low81 Ų8189.5 Ų89.543%0.43352%0.516SS..  trans-52.9125.8179.8-179.3-25.4000108.5P10 N14 V15 L16P10-D12 PolarHBondContact O-N 3.16Å; D12-N14 PolarHBondContact O-N 3.31Å; D12-N14 WeakPolarHBondContact OD1-CB 3.47Å; D12-N14 PolarHBondContact OD1-N 3.14Å; D12-N14 PolarHBondContact OD1-ND2 3.01Å; D12-N14 VanDerWaalsContact OD1-ND2 3.16Å; D12-V15 HydrophobicContact CB-CB 4.19Å; D12-V15 HydrophobicContact CB-CG2 3.85Å; D12-V15 WeakPolarHBondContact O-CA 3.13Å; D12-V15 WeakPolarHBondContact O-CB 3.25Å; D12-V15 PolarHBondContact O-N 3.25Å; D12-L16 PolarHBondContact O-N 3.2Å
13P84.4Confident70.2Confident45 Ų4585.7 Ų85.729%0.29248%0.482SS..Hα-helixtrans-50.6-33.7-179.9-2327.6000112.9L16 V17 F75 L78P13-L16 PolarHBondContact O-N 3.49Å; P13-V17 VanDerWaalsContact O-CG2 3.22Å; P13-V17 WeakPolarHBondContact O-CG2 3.41Å; P13-V17 PolarHBondContact O-N 3.12Å; P13-F75 HydrophobicContact CB-CE2 4.35Å; P13-L78 HydrophobicContact CB-CD1 4Å; P13-L78 HydrophobicContact CG-CD1 3.91Å
14N85.9Confident72.9Confident90 Ų9077.5 Ų77.548%0.48144%0.442SS..Hα-helixtrans-70.4-35.7178.3-62.3-56.8000112.4D12 V17 Q18D12-N14 PolarHBondContact O-N 3.31Å; D12-N14 WeakPolarHBondContact OD1-CB 3.47Å; D12-N14 PolarHBondContact OD1-N 3.14Å; D12-N14 PolarHBondContact OD1-ND2 3.01Å; D12-N14 VanDerWaalsContact OD1-ND2 3.16Å; N14-V17 PolarHBondContact O-N 3.49Å; N14-Q18 WeakPolarHBondContact O-CB 3.47Å; N14-Q18 PolarHBondContact O-N 2.92Å
15V88.5Confident75.6Confident59 Ų5976.7 Ų76.736%0.35843%0.425SS..Hα-helixtrans-67.6-41.8175.4174.30000110.1D12 Q18 N19D12-V15 HydrophobicContact CB-CB 4.19Å; D12-V15 HydrophobicContact CB-CG2 3.85Å; D12-V15 WeakPolarHBondContact O-CA 3.13Å; D12-V15 WeakPolarHBondContact O-CB 3.25Å; D12-V15 PolarHBondContact O-N 3.25Å; V15-Q18 PolarHBondContact O-N 2.92Å; V15-N19 WeakPolarHBondContact O-CB 3.39Å; V15-N19 VanDerWaalsContact O-CG 3.22Å; V15-N19 PolarHBondContact O-N 3.26Å; V15-N19 PolarHBondContact O-ND2 3.14Å
16L89.8Confident78.3Confident0 Ų072.2 Ų72.20%041%0.406CS..Hα-helixtrans-58-51.8173.1-74.7171.8000111.4E11 D12 P13 Q18 N19 I20 L71 V74 F75 L78E11-L16 HydrophobicContact CB-CD1 4.22Å; E11-L16 HydrophobicContact CB-CD2 4.17Å; E11-L16 HydrophobicContact CB-CG 3.96Å; E11-L16 WeakPolarHBondContact OE2-CD2 3.32Å; D12-L16 PolarHBondContact O-N 3.2Å; P13-L16 PolarHBondContact O-N 3.49Å; L16-Q18 VanDerWaalsContact C-N 3.27Å; L16-Q18 PolarHBondContact O-N 3.14Å; L16-N19 PolarHBondContact O-N 3.14Å; L16-I20 HydrophobicContact CB-CD1 4.46Å; L16-I20 WeakPolarHBondContact O-CB 3.47Å; L16-I20 WeakPolarHBondContact O-CD1 3.48Å; L16-I20 WeakPolarHBondContact O-CG1 3.34Å; L16-I20 PolarHBondContact O-N 3.45Å; L16-L71 HydrophobicContact CD2-CD2 3.74Å; L16-V74 HydrophobicContact CD1-CG1 3.9Å; L16-V74 HydrophobicContact CD2-CG1 4.2Å; L16-F75 HydrophobicContact CB-CD2 4.09Å; L16-F75 HydrophobicContact CD1-CB 4.3Å; L16-F75 HydrophobicContact CD1-CD2 4.31Å; L16-L78 HydrophobicContact CD1-CD1 3.75Å; L16-L78 HydrophobicContact CD1-CG 4.46Å
17V90.3Very high80.9Confident23 Ų2363.2 Ų63.214%0.13936%0.364CS..Hα-helixtrans-56-43.7177.71700000111.1P13 N14 S21 F75 Q90 L94P13-V17 VanDerWaalsContact O-CG2 3.22Å; P13-V17 WeakPolarHBondContact O-CG2 3.41Å; P13-V17 PolarHBondContact O-N 3.12Å; N14-V17 PolarHBondContact O-N 3.49Å; V17-S21 VanDerWaalsContact O-CB 3.29Å; V17-S21 WeakPolarHBondContact O-CB 3.49Å; V17-S21 PolarHBondContact O-N 3.11Å; V17-S21 PolarHBondContact O-OG 3.03Å; V17-F75 HydrophobicContact CG2-CD2 4.12Å; V17-F75 HydrophobicContact CG2-CE2 3.42Å; V17-F75 VanDerWaalsContact CG2-CE2 3.42Å; V17-F75 HydrophobicContact CG2-CZ 3.7Å; V17-Q90 HydrophobicContact CG2-CB 4.33Å; V17-L94 HydrophobicContact CB-CD1 4.37Å; V17-L94 HydrophobicContact CG1-CD1 4.27Å; V17-L94 HydrophobicContact CG2-CD1 4.03Å
18Q89.8Confident83.3Confident134 Ų13460.5 Ų60.563%0.62634%0.338SS*.Hα-helixtrans-65-44.6178.8-173.1176.98.300112.1N14 V15 L16 S21 S22N14-Q18 WeakPolarHBondContact O-CB 3.47Å; N14-Q18 PolarHBondContact O-N 2.92Å; V15-Q18 PolarHBondContact O-N 2.92Å; L16-Q18 VanDerWaalsContact C-N 3.27Å; L16-Q18 PolarHBondContact O-N 3.14Å; Q18-S21 PolarHBondContact O-N 3.27Å; Q18-S22 WeakPolarHBondContact O-CB 3.41Å; Q18-S22 PolarHBondContact O-N 3.09Å
19N92.1Very high85.6Confident61 Ų6158.9 Ų58.933%0.32631%0.312SS..Hα-helixtrans-65.4-45.7179.5-71.8-17.5000111.5V15 L16 S22 N23 L71V15-N19 WeakPolarHBondContact O-CB 3.39Å; V15-N19 VanDerWaalsContact O-CG 3.22Å; V15-N19 PolarHBondContact O-N 3.26Å; V15-N19 PolarHBondContact O-ND2 3.14Å; L16-N19 PolarHBondContact O-N 3.14Å; N19-S22 PolarHBondContact O-N 2.68Å; N19-N23 PolarHBondContact O-N 2.7Å; N19-L71 HydrophobicContact CB-CD1 3.93Å
20I93.4Very high88Confident0 Ų052.2 Ų52.20%028%0.277CS..Hα-helixtrans-58.9-51.4175.8-65.3160.5000109.5L16 S22 N23 I24 T68 L71 M72 F75 L94L16-I20 HydrophobicContact CB-CD1 4.46Å; L16-I20 WeakPolarHBondContact O-CB 3.47Å; L16-I20 WeakPolarHBondContact O-CD1 3.48Å; L16-I20 WeakPolarHBondContact O-CG1 3.34Å; L16-I20 PolarHBondContact O-N 3.45Å; I20-S22 VanDerWaalsContact C-N 3.29Å; I20-S22 PolarHBondContact O-N 3.41Å; I20-N23 PolarHBondContact O-N 3Å; I20-I24 HydrophobicContact CG2-CD1 3.75Å; I20-I24 HydrophobicContact CG2-CG1 4.39Å; I20-I24 VanDerWaalsContact O-CG1 3.29Å; I20-I24 WeakPolarHBondContact O-CG1 3.48Å; I20-I24 PolarHBondContact O-N 3.34Å; I20-T68 HydrophobicContact CG2-CG2 3.91Å; I20-L71 HydrophobicContact CD1-CB 4.05Å; I20-L71 HydrophobicContact CG1-CB 3.53Å; I20-L71 HydrophobicContact CG1-CD1 4.22Å; I20-M72 HydrophobicContact CD1-CG 4.36Å; I20-M72 HydrophobicContact CD1-SD 3.77Å; I20-M72 HydrophobicContact CG1-SD 4.38Å; I20-M72 HydrophobicContact CG2-CG 4.16Å; I20-M72 HydrophobicContact CG2-SD 3.7Å; I20-F75 HydrophobicContact CD1-CB 4.02Å; I20-F75 HydrophobicContact CD1-CG 4.38Å; I20-L94 HydrophobicContact CB-CD1 4.39Å; I20-L94 HydrophobicContact CB-CD2 4.36Å; I20-L94 HydrophobicContact CD1-CD1 4.15Å; I20-L94 HydrophobicContact CG2-CB 4.28Å; I20-L94 HydrophobicContact CG2-CD1 4.13Å; I20-L94 HydrophobicContact CG2-CD2 3.83Å; I20-L94 HydrophobicContact CG2-CG 4.3Å
21S93.6Very high89.7Confident39 Ų3947.1 Ų47.127%0.27324%0.244SC..Hα-helixtrans-58.2-42.4179.1-57.50000112V17 Q18 I24 Q25 L94V17-S21 VanDerWaalsContact O-CB 3.29Å; V17-S21 WeakPolarHBondContact O-CB 3.49Å; V17-S21 PolarHBondContact O-N 3.11Å; V17-S21 PolarHBondContact O-OG 3.03Å; Q18-S21 PolarHBondContact O-N 3.27Å; S21-I24 PolarHBondContact O-N 3.28Å; S21-Q25 VanDerWaalsContact O-CG 3.31Å; S21-Q25 WeakPolarHBondContact O-CG 3.29Å; S21-Q25 PolarHBondContact O-N 3.17Å; S21-L94 WeakPolarHBondContact OG-CD2 3.38Å
22S94.3Very high90.9Very high35 Ų3543.9 Ų43.925%0.24523%0.232CC..Hα-helixtrans-65.2-41.3178.6-171.60000112.1Q18 N19 I20 Q25 R26Q18-S22 WeakPolarHBondContact O-CB 3.41Å; Q18-S22 PolarHBondContact O-N 3.09Å; N19-S22 PolarHBondContact O-N 2.68Å; I20-S22 VanDerWaalsContact C-N 3.29Å; I20-S22 PolarHBondContact O-N 3.41Å; S22-Q25 PolarHBondContact O-N 3Å; S22-R26 WeakPolarHBondContact O-CG 3.31Å; S22-R26 PolarHBondContact O-N 3.44Å
23N94.9Very high91.1Very high22 Ų2243.6 Ų43.612%0.11823%0.228CC..Hα-helixtrans-66.2-43.8176.5-73.3-5000111.8N19 I20 Q25 R26 I27 L64 T68N19-N23 PolarHBondContact O-N 2.7Å; I20-N23 PolarHBondContact O-N 3Å; N23-Q25 VanDerWaalsContact C-N 3.3Å; N23-Q25 PolarHBondContact O-N 3.27Å; N23-R26 WeakPolarHBondContact O-CB 3.37Å; N23-R26 PolarHBondContact O-N 3.44Å; N23-R26 VanDerWaalsContact O-N 3.1Å; N23-I27 WeakPolarHBondContact O-CG1 3.41Å; N23-I27 PolarHBondContact O-N 3.15Å; N23-L64 HydrophobicContact CB-CD2 4.26Å; N23-T68 WeakPolarHBondContact CB-OG1 3.47Å; N23-T68 PolarHBondContact ND2-OG1 3.11Å
24I94.7Very high91.3Very high12 Ų1241.6 Ų41.66%0.06222%0.215CC..Hα-helixtrans-55.6-47.8175.4-67.3166.8000110.1I20 S21 R26 I27 T28 T68 L94 D97 F98 A101I20-I24 HydrophobicContact CG2-CD1 3.75Å; I20-I24 HydrophobicContact CG2-CG1 4.39Å; I20-I24 VanDerWaalsContact O-CG1 3.29Å; I20-I24 WeakPolarHBondContact O-CG1 3.48Å; I20-I24 PolarHBondContact O-N 3.34Å; S21-I24 PolarHBondContact O-N 3.28Å; I24-R26 VanDerWaalsContact C-N 3.33Å; I24-R26 PolarHBondContact O-N 2.97Å; I24-I27 WeakPolarHBondContact O-CB 3.26Å; I24-I27 PolarHBondContact O-N 3.44Å; I24-T28 PolarHBondContact O-N 2.97Å; I24-T28 PolarHBondContact O-OG1 3.39Å; I24-T28 VanDerWaalsContact O-OG1 3.14Å; I24-T68 HydrophobicContact CG1-CG2 4.12Å; I24-L94 HydrophobicContact CD1-CD2 4.29Å; I24-D97 HydrophobicContact CD1-CB 4.15Å; I24-D97 HydrophobicContact CG2-CB 4.2Å; I24-F98 HydrophobicContact CD1-CB 3.76Å; I24-F98 HydrophobicContact CG1-CB 3.99Å; I24-F98 HydrophobicContact CG1-CD2 4.06Å; I24-F98 HydrophobicContact CG1-CG 4.33Å; I24-A101 HydrophobicContact CG2-CB 3.99Å
25Q92.6Very high91.5Very high64 Ų6440.8 Ų40.830%0.29921%0.208SC..Hα-helixtrans-60.1-42.2177.1-71.9174.3-5.100112.3S21 S22 N23 T28 L29 L225S21-Q25 VanDerWaalsContact O-CG 3.31Å; S21-Q25 WeakPolarHBondContact O-CG 3.29Å; S21-Q25 PolarHBondContact O-N 3.17Å; S22-Q25 PolarHBondContact O-N 3Å; N23-Q25 VanDerWaalsContact C-N 3.3Å; N23-Q25 PolarHBondContact O-N 3.27Å; Q25-T28 PolarHBondContact O-N 3.38Å; Q25-L29 VanDerWaalsContact O-CG 3.31Å; Q25-L29 WeakPolarHBondContact O-CG 3.43Å; Q25-L29 PolarHBondContact O-N 3.38Å; Q25-L225 HydrophobicContact CB-CD1 4.2Å
26R92.6Very high91.3Very high138 Ų13846.6 Ų46.652%0.52122%0.224SC..Hα-helixtrans-64-40.6176.3-74.1172.8170-174.1-2112.2S22 N23 I24 T28 L29 L30 L64S22-R26 WeakPolarHBondContact O-CG 3.31Å; S22-R26 PolarHBondContact O-N 3.44Å; N23-R26 WeakPolarHBondContact O-CB 3.37Å; N23-R26 PolarHBondContact O-N 3.44Å; N23-R26 VanDerWaalsContact O-N 3.1Å; I24-R26 VanDerWaalsContact C-N 3.33Å; I24-R26 PolarHBondContact O-N 2.97Å; R26-T28 VanDerWaalsContact C-N 3.34Å; R26-L29 PolarHBondContact O-N 2.94Å; R26-L30 WeakPolarHBondContact O-CB 3.38Å; R26-L30 WeakPolarHBondContact O-CG 3.45Å; R26-L30 PolarHBondContact O-N 3.29Å; R26-L64 HydrophobicContact CB-CD1 3.79Å
27I94.8Very high91.1Very high1 Ų147 Ų471%0.00523%0.227CC..Hα-helixtrans-59.6-47.3174.4-68.6165.6000109.8N23 I24 L29 L30 T31 L64 A65 F98 A101 L105N23-I27 WeakPolarHBondContact O-CG1 3.41Å; N23-I27 PolarHBondContact O-N 3.15Å; I24-I27 WeakPolarHBondContact O-CB 3.26Å; I24-I27 PolarHBondContact O-N 3.44Å; I27-L29 PolarHBondContact O-N 3.27Å; I27-L30 PolarHBondContact O-N 2.89Å; I27-T31 WeakPolarHBondContact O-CB 3.48Å; I27-T31 PolarHBondContact O-N 3.26Å; I27-T31 PolarHBondContact O-OG1 3.48Å; I27-L64 HydrophobicContact CD1-CB 4.04Å; I27-L64 HydrophobicContact CG1-CB 3.65Å; I27-L64 HydrophobicContact CG1-CD1 4.29Å; I27-A65 HydrophobicContact CD1-CB 4.46Å; I27-F98 HydrophobicContact CD1-CD2 4.44Å; I27-F98 HydrophobicContact CD1-CE2 3.95Å; I27-A101 HydrophobicContact CB-CB 4.47Å; I27-A101 HydrophobicContact CG2-CB 3.99Å; I27-L105 HydrophobicContact CG2-CB 4.35Å; I27-L105 HydrophobicContact CG2-CD2 4.16Å
28T91.8Very high91Very high41 Ų4146.2 Ų46.225%0.25222%0.223SC..Hα-helixtrans-59.4-46.7178.1-590000111.7I24 Q25 R26 T31 S32 V218I24-T28 PolarHBondContact O-N 2.97Å; I24-T28 PolarHBondContact O-OG1 3.39Å; I24-T28 VanDerWaalsContact O-OG1 3.14Å; Q25-T28 PolarHBondContact O-N 3.38Å; R26-T28 VanDerWaalsContact C-N 3.34Å; T28-T31 WeakPolarHBondContact O-CB 3.37Å; T28-T31 PolarHBondContact O-N 2.88Å; T28-S32 PolarHBondContact O-N 2.79Å; T28-S32 VanDerWaalsContact O-N 3.08Å; T28-S32 PolarHBondContact O-OG 2.86Å; T28-V218 HydrophobicContact CG2-CG2 3.61Å
29L90.9Very high90.8Very high39 Ų3947.2 Ų47.220%0.20423%0.225CC..Hα-helixtrans-61.7-48.6177.5-69.5172.3000112.3Q25 R26 I27 T31 S32 E33 Q222 L225Q25-L29 VanDerWaalsContact O-CG 3.31Å; Q25-L29 WeakPolarHBondContact O-CG 3.43Å; Q25-L29 PolarHBondContact O-N 3.38Å; R26-L29 PolarHBondContact O-N 2.94Å; I27-L29 PolarHBondContact O-N 3.27Å; L29-T31 PolarHBondContact O-N 3.11Å; L29-S32 PolarHBondContact O-N 3.41Å; L29-E33 WeakPolarHBondContact O-CG 3.43Å; L29-E33 PolarHBondContact O-N 3.32Å; L29-E33 VanDerWaalsContact O-N 3.09Å; L29-Q222 HydrophobicContact CD2-CG 3.46Å; L29-Q222 VanDerWaalsContact CD2-CG 3.46Å; L29-L225 HydrophobicContact CD1-CD1 3.71Å
30L92.1Very high90.5Very high11 Ų1147.4 Ų47.46%0.05823%0.226CC..Hα-helixtrans-60.2-37.8177.2-77.6166.6000111.5R26 I27 E33 L34 K57 Q60 L64R26-L30 WeakPolarHBondContact O-CB 3.38Å; R26-L30 WeakPolarHBondContact O-CG 3.45Å; R26-L30 PolarHBondContact O-N 3.29Å; I27-L30 PolarHBondContact O-N 2.89Å; L30-E33 PolarHBondContact O-N 3.46Å; L30-L34 WeakPolarHBondContact O-CB 3.42Å; L30-L34 WeakPolarHBondContact O-CG 3.18Å; L30-L34 PolarHBondContact O-N 3.03Å; L30-K57 HydrophobicContact CD2-CB 4.47Å; L30-K57 HydrophobicContact CD2-CG 4.2Å; L30-Q60 HydrophobicContact CD1-CB 4.32Å; L30-Q60 HydrophobicContact CD1-CG 3.79Å; L30-L64 HydrophobicContact CD1-CD1 3.46Å; L30-L64 VanDerWaalsContact CD1-CD1 3.46Å
31T91.2Very high89.9Confident1 Ų147.6 Ų47.61%0.00623%0.227CC..Hα-helixtrans-63.8-45.4177.9-58.50000111I27 T28 L29 E33 L34 Q35 S104 T108I27-T31 WeakPolarHBondContact O-CB 3.48Å; I27-T31 PolarHBondContact O-N 3.26Å; I27-T31 PolarHBondContact O-OG1 3.48Å; T28-T31 WeakPolarHBondContact O-CB 3.37Å; T28-T31 PolarHBondContact O-N 2.88Å; L29-T31 PolarHBondContact O-N 3.11Å; T31-E33 VanDerWaalsContact C-N 3.29Å; T31-E33 PolarHBondContact O-N 2.71Å; T31-L34 WeakPolarHBondContact O-CB 3.38Å; T31-L34 PolarHBondContact O-N 3.12Å; T31-Q35 VanDerWaalsContact O-CG 3.32Å; T31-Q35 WeakPolarHBondContact O-CG 3.16Å; T31-Q35 PolarHBondContact O-N 3Å; T31-S104 WeakPolarHBondContact CG2-OG 3.05Å; T31-T108 WeakPolarHBondContact CG2-OG1 3.49Å
32S88.9Confident89Confident25 Ų2547.8 Ų47.818%0.17524%0.235CC..Hα-helixtrans-62-37.3175.5-58.80000112.5T28 L29 R36T28-S32 PolarHBondContact O-N 2.79Å; T28-S32 VanDerWaalsContact O-N 3.08Å; T28-S32 PolarHBondContact O-OG 2.86Å; L29-S32 PolarHBondContact O-N 3.41Å; S32-R36 WeakPolarHBondContact O-CG 3.31Å; S32-R36 PolarHBondContact O-N 3.05Å
33E87.4Confident88.4Confident76 Ų7648.9 Ų48.936%0.35524%0.24SC..Hα-helixtrans-68.7-41174.8-68.5177.6176.500112.2L29 L30 T31 R36 A37 K57L29-E33 WeakPolarHBondContact O-CG 3.43Å; L29-E33 PolarHBondContact O-N 3.32Å; L29-E33 VanDerWaalsContact O-N 3.09Å; L30-E33 PolarHBondContact O-N 3.46Å; T31-E33 VanDerWaalsContact C-N 3.29Å; T31-E33 PolarHBondContact O-N 2.71Å; E33-R36 PolarHBondContact O-N 3.06Å; E33-A37 PolarHBondContact O-N 3.37Å; E33-A37 VanDerWaalsContact O-N 3.09Å; E33-K57 HydrophobicContact CB-CD 4.28Å; E33-K57 IonicContact OE2-NZ 2.68Å; E33-K57 PolarHBondContact OE2-NZ 2.88Å
34L88.9Confident87.6Confident2 Ų255.9 Ų55.91%0.0128%0.278CS..Hα-helixtrans-61.3-43174.4-80.2171.9000111.3L30 T31 R36 A37 V38 L54 K57 Q58 L105 T108L30-L34 WeakPolarHBondContact O-CB 3.42Å; L30-L34 WeakPolarHBondContact O-CG 3.18Å; L30-L34 PolarHBondContact O-N 3.03Å; T31-L34 WeakPolarHBondContact O-CB 3.38Å; T31-L34 PolarHBondContact O-N 3.12Å; L34-R36 VanDerWaalsContact C-N 3.28Å; L34-R36 PolarHBondContact O-N 3.41Å; L34-A37 PolarHBondContact O-N 3.32Å; L34-A37 VanDerWaalsContact O-N 3.11Å; L34-V38 WeakPolarHBondContact O-CB 3.31Å; L34-V38 VanDerWaalsContact O-CG2 3.23Å; L34-V38 WeakPolarHBondContact O-CG2 3.39Å; L34-V38 PolarHBondContact O-N 2.88Å; L34-L54 HydrophobicContact CD2-CG 4.29Å; L34-K57 HydrophobicContact CD1-CB 4.47Å; L34-K57 HydrophobicContact CD2-CB 3.53Å; L34-K57 HydrophobicContact CG-CB 3.92Å; L34-Q58 HydrophobicContact CD1-CG 4.29Å; L34-Q58 HydrophobicContact CD2-CG 3.84Å; L34-L105 HydrophobicContact CD1-CD1 3.9Å; L34-T108 HydrophobicContact CB-CG2 3.82Å
35Q88.1Confident86.8Confident74 Ų7461.6 Ų61.635%0.34630%0.304SS..Hα-helixtrans-57.2-42.3177.1-75.5172.5-13.600112T31 V38 F39 T108T31-Q35 VanDerWaalsContact O-CG 3.32Å; T31-Q35 WeakPolarHBondContact O-CG 3.16Å; T31-Q35 PolarHBondContact O-N 3Å; Q35-V38 PolarHBondContact O-N 3.37Å; Q35-F39 WeakPolarHBondContact O-CB 3.42Å; Q35-F39 PolarHBondContact O-N 3.37Å; Q35-T108 HydrophobicContact CB-CG2 4.41Å; Q35-T108 HydrophobicContact CG-CG2 3.6Å; Q35-T108 VanDerWaalsContact CG-OG1 3.29Å; Q35-T108 WeakPolarHBondContact CG-OG1 3.23Å; Q35-T108 PolarHBondContact NE2-OG1 2.89Å
36R86.1Confident86.4Confident180 Ų18059.9 Ų59.968%0.67930%0.297SS*.Hα-helixtrans-63.5-45.6175.3-66.2174.2-174.1169.42.1111.4S32 E33 L34 F39 L40S32-R36 WeakPolarHBondContact O-CG 3.31Å; S32-R36 PolarHBondContact O-N 3.05Å; E33-R36 PolarHBondContact O-N 3.06Å; L34-R36 VanDerWaalsContact C-N 3.28Å; L34-R36 PolarHBondContact O-N 3.41Å; R36-F39 WeakPolarHBondContact O-CB 3.34Å; R36-F39 PolarHBondContact O-N 3.26Å; R36-L40 WeakPolarHBondContact O-CG 3.5Å; R36-L40 PolarHBondContact O-N 3.42Å
37A85.5Confident86.1Confident9 Ų955.8 Ų55.87%0.07429%0.289CS..Hα-helixtrans-63.4-42.9178.100000112.1E33 L34 F39 L40 L41 L50 L54E33-A37 PolarHBondContact O-N 3.37Å; E33-A37 VanDerWaalsContact O-N 3.09Å; L34-A37 PolarHBondContact O-N 3.32Å; L34-A37 VanDerWaalsContact O-N 3.11Å; A37-F39 VanDerWaalsContact C-N 3.31Å; A37-F39 PolarHBondContact O-N 2.88Å; A37-L40 PolarHBondContact O-N 3.44Å; A37-L40 VanDerWaalsContact O-N 3.15Å; A37-L41 PolarHBondContact O-N 3.21Å; A37-L50 HydrophobicContact CB-CD1 3.92Å; A37-L54 HydrophobicContact CB-CB 4.46Å; A37-L54 HydrophobicContact CB-CD1 4.02Å
38V87.8Confident85.7Confident7 Ų760.1 Ų60.14%0.04231%0.312CS..Hα-helixtrans-62.5-38175.7171.40000111.1L34 Q35 L40 L41 L54 T108 Q111 A112 K115L34-V38 WeakPolarHBondContact O-CB 3.31Å; L34-V38 VanDerWaalsContact O-CG2 3.23Å; L34-V38 WeakPolarHBondContact O-CG2 3.39Å; L34-V38 PolarHBondContact O-N 2.88Å; Q35-V38 PolarHBondContact O-N 3.37Å; V38-L40 PolarHBondContact O-N 3.11Å; V38-L41 WeakPolarHBondContact O-CB 3.46Å; V38-L41 PolarHBondContact O-N 2.95Å; V38-L54 HydrophobicContact CG2-CD1 3.76Å; V38-T108 HydrophobicContact CG2-CG2 4.29Å; V38-Q111 HydrophobicContact CG1-CB 4.2Å; V38-A112 HydrophobicContact CG1-CB 4.4Å; V38-A112 HydrophobicContact CG2-CB 3.61Å; V38-K115 HydrophobicContact CG1-CD 4.13Å; V38-K115 WeakPolarHBondContact O-CD 3.36Å; V38-K115 WeakPolarHBondContact O-CE 3.33Å; V38-K115 PolarHBondContact O-NZ 3.43Å
39F85.6Confident85.5Confident154 Ų15465.4 Ų65.468%0.67533%0.334SS*.Hα-helixtrans-60.5-36.9175.9-174.3-97.7000112Q35 R36 A37 K115Q35-F39 WeakPolarHBondContact O-CB 3.42Å; Q35-F39 PolarHBondContact O-N 3.37Å; R36-F39 WeakPolarHBondContact O-CB 3.34Å; R36-F39 PolarHBondContact O-N 3.26Å; A37-F39 VanDerWaalsContact C-N 3.31Å; A37-F39 PolarHBondContact O-N 2.88Å; F39-K115 PolarHBondContact O-NZ 2.83Å
40L84.4Confident85.3Confident65 Ų6564.9 Ų64.934%0.3433%0.331SS..Hα-helixtrans-77-19.4178.3-60.8174.7000113.8R36 A37 V38 G42 T43 Q45 L50R36-L40 WeakPolarHBondContact O-CG 3.5Å; R36-L40 PolarHBondContact O-N 3.42Å; A37-L40 PolarHBondContact O-N 3.44Å; A37-L40 VanDerWaalsContact O-N 3.15Å; V38-L40 PolarHBondContact O-N 3.11Å; L40-G42 PolarHBondContact O-N 2.9Å; L40-T43 WeakPolarHBondContact O-CB 3.41Å; L40-T43 PolarHBondContact O-N 3.14Å; L40-T43 PolarHBondContact O-OG1 2.93Å; L40-Q45 HydrophobicContact CD2-CB 4.38Å; L40-L50 HydrophobicContact CB-CD2 3.66Å; L40-L50 HydrophobicContact CD1-CD1 4.33Å
41L82.6Confident85Confident5 Ų565.2 Ų65.23%0.02633%0.332CS..THydrogen-bonded Turntrans-60.4133.8174.2-70.4-177.2000111.2A37 V38 T43 L50 R51 L54 K115A37-L41 PolarHBondContact O-N 3.21Å; V38-L41 WeakPolarHBondContact O-CB 3.46Å; V38-L41 PolarHBondContact O-N 2.95Å; L41-T43 VanDerWaalsContact C-N 3.3Å; L41-L50 HydrophobicContact CD2-CD2 4.3Å; L41-R51 HydrophobicContact CD2-CG 4.28Å; L41-L54 HydrophobicContact CD1-CD1 3.61Å; L41-L54 HydrophobicContact CD2-CD1 4.38Å; L41-L54 HydrophobicContact CG-CD1 4.01Å; L41-K115 HydrophobicContact CB-CD 4.03Å; L41-K115 PolarHBondContact O-NZ 3.31Å
42G73.1Confident84.9Confident42 Ų4270.9 Ų70.943%0.43336%0.358SS..THydrogen-bonded Turntrans78.16.8-177.900000115.3L40 D46L40-G42 PolarHBondContact O-N 2.9Å; G42-D46 PolarHBondContact N-OD2 3.01Å
43T81.7Confident84.8Confident58 Ų5872.5 Ų72.536%0.35637%0.367SS..SBendtrans-101.3175.9173.473.40000111L40 L41 Q45 D46L40-T43 WeakPolarHBondContact O-CB 3.41Å; L40-T43 PolarHBondContact O-N 3.14Å; L40-T43 PolarHBondContact O-OG1 2.93Å; L41-T43 VanDerWaalsContact C-N 3.3Å; T43-Q45 PolarHBondContact O-N 3.03Å; T43-Q45 PolarHBondContact OG1-N 3.44Å; T43-D46 WeakPolarHBondContact O-CB 3.49Å; T43-D46 PolarHBondContact O-N 3.3Å
44D77.8Confident84.9Confident170 Ų17068.9 Ų68.991%0.90935%0.35SS*.THydrogen-bonded Turntrans-60.6-14.7174.8-53.6-34.9000113.7D46D44-D46 VanDerWaalsContact C-N 3.34Å
45Q78.4Confident85Confident132 Ų13271.7 Ų71.762%0.61736%0.363SS*.THydrogen-bonded Turntrans-89.71.3176.7-59.7-63-56.600113.1L40 T43 S47L40-Q45 HydrophobicContact CD2-CB 4.38Å; T43-Q45 PolarHBondContact O-N 3.03Å; T43-Q45 PolarHBondContact OG1-N 3.44Å; Q45-S47 PolarHBondContact O-N 3.09Å
46D83.9Confident85.2Confident28 Ų2874.4 Ų74.415%0.1538%0.376CS..  trans-71.399.8179.7-168.3-32.2000110.8G42 T43 D44 R51 R172G42-D46 PolarHBondContact N-OD2 3.01Å; T43-D46 WeakPolarHBondContact O-CB 3.49Å; T43-D46 PolarHBondContact O-N 3.3Å; D44-D46 VanDerWaalsContact C-N 3.34Å; D46-R51 IonicContact OD1-CZ 3.66Å; D46-R51 IonicContact OD1-NE 3.82Å; D46-R51 PolarHBondContact OD1-NE 3.17Å; D46-R51 IonicContact OD1-NH2 2.66Å; D46-R51 PolarHBondContact OD1-NH2 2.88Å; D46-R172 IonicContact OD1-CZ 3.71Å; D46-R172 IonicContact OD1-NH1 2.7Å; D46-R172 IonicContact OD1-NH2 3.13Å; D46-R172 PolarHBondContact OD1-NH2 3.38Å; D46-R172 VanDerWaalsContact OD1-NH2 3.08Å; D46-R172 IonicContact OD2-CZ 2.71Å; D46-R172 IonicContact OD2-NH1 2.68Å; D46-R172 IonicContact OD2-NH2 3.26Å; D46-R172 PolarHBondContact OD2-NH2 2.85Å
47S86.7Confident85.4Confident51 Ų5168 Ų6836%0.35735%0.353SS..  trans-116.5158.3-179.365.70000112.1Q45 Q49 L50 R51Q45-S47 PolarHBondContact O-N 3.09Å; S47-Q49 PolarHBondContact O-N 3.02Å; S47-L50 WeakPolarHBondContact O-CB 3.04Å; S47-L50 PolarHBondContact O-N 3.05Å; S47-L50 VanDerWaalsContact O-N 3.09Å; S47-L50 PolarHBondContact OG-N 3.5Å; S47-R51 WeakPolarHBondContact O-CG 3.44Å; S47-R51 PolarHBondContact O-N 2.66Å; S47-R51 VanDerWaalsContact O-N 3.11Å
48N86Confident85.7Confident93 Ų9367.8 Ų67.850%0.49735%0.351SS..Hα-helixtrans-57.6-34.9174.1-67.2-22.9000112.2R51 Q52N48-R51 PolarHBondContact O-N 2.94Å; N48-R51 PolarHBondContact OD1-NH1 2.8Å; N48-Q52 WeakPolarHBondContact O-CG 3.49Å; N48-Q52 PolarHBondContact O-N 3.35Å
49Q87.6Confident86Confident151 Ų15172.5 Ų72.571%0.70637%0.372SS*.Hα-helixtrans-65.3-41176-70.1-177.4-19.800112.4S47 R51 T53S47-Q49 PolarHBondContact O-N 3.02Å; Q49-R51 VanDerWaalsContact C-N 3.35Å; Q49-T53 WeakPolarHBondContact O-CB 3.29Å; Q49-T53 PolarHBondContact O-N 2.87Å; Q49-T53 PolarHBondContact O-OG1 2.83Å
50L87.6Confident86.4Confident28 Ų2869.8 Ų69.815%0.14736%0.361CS..Hα-helixtrans-61.5-45175.5179.569.4000110.8A37 L40 L41 S47 T53 L54A37-L50 HydrophobicContact CB-CD1 3.92Å; L40-L50 HydrophobicContact CB-CD2 3.66Å; L40-L50 HydrophobicContact CD1-CD1 4.33Å; L41-L50 HydrophobicContact CD2-CD2 4.3Å; S47-L50 WeakPolarHBondContact O-CB 3.04Å; S47-L50 PolarHBondContact O-N 3.05Å; S47-L50 VanDerWaalsContact O-N 3.09Å; S47-L50 PolarHBondContact OG-N 3.5Å; L50-T53 PolarHBondContact O-N 3.41Å; L50-L54 VanDerWaalsContact O-CB 3.31Å; L50-L54 WeakPolarHBondContact O-CB 3.15Å; L50-L54 PolarHBondContact O-N 3.21Å
51R86.3Confident86.8Confident18 Ų1866.7 Ų66.77%0.06835%0.345CS..Hα-helixtrans-63.7-45179.2-63.7171.2-158.8169.3-4112.5L41 D46 S47 N48 Q49 T53 L54 Q55 R172L41-R51 HydrophobicContact CD2-CG 4.28Å; D46-R51 IonicContact OD1-CZ 3.66Å; D46-R51 IonicContact OD1-NE 3.82Å; D46-R51 PolarHBondContact OD1-NE 3.17Å; D46-R51 IonicContact OD1-NH2 2.66Å; D46-R51 PolarHBondContact OD1-NH2 2.88Å; S47-R51 WeakPolarHBondContact O-CG 3.44Å; S47-R51 PolarHBondContact O-N 2.66Å; S47-R51 VanDerWaalsContact O-N 3.11Å; N48-R51 PolarHBondContact O-N 2.94Å; N48-R51 PolarHBondContact OD1-NH1 2.8Å; Q49-R51 VanDerWaalsContact C-N 3.35Å; R51-T53 VanDerWaalsContact C-N 3.33Å; R51-T53 PolarHBondContact O-N 2.7Å; R51-L54 WeakPolarHBondContact O-CB 3.41Å; R51-L54 PolarHBondContact O-N 2.84Å; R51-Q55 WeakPolarHBondContact O-CG 3.33Å; R51-Q55 PolarHBondContact O-N 2.92Å; R51-R172 VanDerWaalsContact CD-CZ 3.48Å; R51-R172 VanDerWaalsContact CD-NH1 3.33Å
52Q88.5Confident87.5Confident121 Ų12166.9 Ų66.957%0.56535%0.346SS*.Hα-helixtrans-60.9-43.8175.3-73.6176.43.600111.5N48 L54 Q55 Q56N48-Q52 WeakPolarHBondContact O-CG 3.49Å; N48-Q52 PolarHBondContact O-N 3.35Å; Q52-L54 VanDerWaalsContact C-N 3.31Å; Q52-L54 PolarHBondContact O-N 3.44Å; Q52-Q55 PolarHBondContact O-N 2.91Å; Q52-Q56 WeakPolarHBondContact O-CB 3.46Å; Q52-Q56 PolarHBondContact O-N 3.34Å
53T87.6Confident88.6Confident58 Ų5869.3 Ų69.336%0.35635%0.347SS..Hα-helixtrans-61.9-41.4176.4-580000111.2Q49 L50 R51 Q56 K57Q49-T53 WeakPolarHBondContact O-CB 3.29Å; Q49-T53 PolarHBondContact O-N 2.87Å; Q49-T53 PolarHBondContact O-OG1 2.83Å; L50-T53 PolarHBondContact O-N 3.41Å; R51-T53 VanDerWaalsContact C-N 3.33Å; R51-T53 PolarHBondContact O-N 2.7Å; T53-Q56 PolarHBondContact O-N 3.32Å; T53-K57 HydrophobicContact CG2-CD 4.13Å; T53-K57 WeakPolarHBondContact O-CB 3.41Å; T53-K57 VanDerWaalsContact O-CG 3.31Å; T53-K57 WeakPolarHBondContact O-CG 3.39Å; T53-K57 PolarHBondContact O-N 3.48Å
54L89.6Confident89.2Confident1 Ų167.4 Ų67.41%0.00533%0.334CS..Hα-helixtrans-64.4-47177.7176.8142000111.5L34 A37 V38 L41 L50 R51 Q52 Q56 K57 Q58L34-L54 HydrophobicContact CD2-CG 4.29Å; A37-L54 HydrophobicContact CB-CB 4.46Å; A37-L54 HydrophobicContact CB-CD1 4.02Å; V38-L54 HydrophobicContact CG2-CD1 3.76Å; L41-L54 HydrophobicContact CD1-CD1 3.61Å; L41-L54 HydrophobicContact CD2-CD1 4.38Å; L41-L54 HydrophobicContact CG-CD1 4.01Å; L50-L54 VanDerWaalsContact O-CB 3.31Å; L50-L54 WeakPolarHBondContact O-CB 3.15Å; L50-L54 PolarHBondContact O-N 3.21Å; R51-L54 WeakPolarHBondContact O-CB 3.41Å; R51-L54 PolarHBondContact O-N 2.84Å; Q52-L54 VanDerWaalsContact C-N 3.31Å; Q52-L54 PolarHBondContact O-N 3.44Å; L54-Q56 PolarHBondContact O-N 3.01Å; L54-K57 PolarHBondContact O-N 3.37Å; L54-Q58 WeakPolarHBondContact O-CB 3.4Å; L54-Q58 VanDerWaalsContact O-CG 3.24Å; L54-Q58 WeakPolarHBondContact O-CG 3.47Å; L54-Q58 PolarHBondContact O-N 3.41Å
55Q90.9Very high90.2Very high60 Ų6059.3 Ų59.328%0.2829%0.291SS..Hα-helixtrans-59.8-45.6174.9-73.8179.1-6.100112R51 Q52 K57 Q58 Q59R51-Q55 WeakPolarHBondContact O-CG 3.33Å; R51-Q55 PolarHBondContact O-N 2.92Å; Q52-Q55 PolarHBondContact O-N 2.91Å; Q55-K57 PolarHBondContact O-N 3.2Å; Q55-Q58 PolarHBondContact O-N 2.96Å; Q55-Q59 WeakPolarHBondContact O-CG 3.39Å; Q55-Q59 PolarHBondContact O-N 2.9Å
56Q91.6Very high91.1Very high131 Ų13156.2 Ų56.261%0.61228%0.275SS*.Hα-helixtrans-60.6-45.2178-174.1-17622.200111.6Q52 T53 L54 Q59 Q60Q52-Q56 WeakPolarHBondContact O-CB 3.46Å; Q52-Q56 PolarHBondContact O-N 3.34Å; T53-Q56 PolarHBondContact O-N 3.32Å; L54-Q56 PolarHBondContact O-N 3.01Å; Q56-Q59 PolarHBondContact O-N 3.33Å; Q56-Q60 WeakPolarHBondContact O-CB 3.4Å; Q56-Q60 PolarHBondContact O-N 2.87Å
57K90.2Very high91.6Very high46 Ų4657.5 Ų57.520%0.228%0.282CS..Hα-helixtrans-67.6-35.9178.9-74.4-179.2-175.4-63.50112.3L30 E33 L34 T53 L54 Q55 Q60 G61L30-K57 HydrophobicContact CD2-CB 4.47Å; L30-K57 HydrophobicContact CD2-CG 4.2Å; E33-K57 HydrophobicContact CB-CD 4.28Å; E33-K57 IonicContact OE2-NZ 2.68Å; E33-K57 PolarHBondContact OE2-NZ 2.88Å; L34-K57 HydrophobicContact CD1-CB 4.47Å; L34-K57 HydrophobicContact CD2-CB 3.53Å; L34-K57 HydrophobicContact CG-CB 3.92Å; T53-K57 HydrophobicContact CG2-CD 4.13Å; T53-K57 WeakPolarHBondContact O-CB 3.41Å; T53-K57 VanDerWaalsContact O-CG 3.31Å; T53-K57 WeakPolarHBondContact O-CG 3.39Å; T53-K57 PolarHBondContact O-N 3.48Å; L54-K57 PolarHBondContact O-N 3.37Å; Q55-K57 PolarHBondContact O-N 3.2Å; K57-Q60 PolarHBondContact O-N 3.32Å; K57-G61 PolarHBondContact O-N 3.02Å
58Q92Very high92.1Very high4 Ų455 Ų552%0.01927%0.265CS..Hα-helixtrans-61.7-50.2173.9-76.7168-12.500111.2L34 L54 Q55 Q60 G61 N62 L179L34-Q58 HydrophobicContact CD1-CG 4.29Å; L34-Q58 HydrophobicContact CD2-CG 3.84Å; L54-Q58 WeakPolarHBondContact O-CB 3.4Å; L54-Q58 VanDerWaalsContact O-CG 3.24Å; L54-Q58 WeakPolarHBondContact O-CG 3.47Å; L54-Q58 PolarHBondContact O-N 3.41Å; Q55-Q58 PolarHBondContact O-N 2.96Å; Q58-Q60 VanDerWaalsContact C-N 3.32Å; Q58-Q60 PolarHBondContact O-N 3.38Å; Q58-G61 PolarHBondContact O-N 3.26Å; Q58-G61 VanDerWaalsContact O-N 3.17Å; Q58-N62 PolarHBondContact O-N 2.98Å; Q58-L179 VanDerWaalsContact CD-CD2 3.41Å; Q58-L179 HydrophobicContact CG-CD2 4.19Å
59Q92.8Very high92.6Very high107 Ų10751.1 Ų51.150%0.524%0.244SC..Hα-helixtrans-59.6-43.1177-71.6179.5-13.200111.8Q55 Q56 N62 Q63Q55-Q59 WeakPolarHBondContact O-CG 3.39Å; Q55-Q59 PolarHBondContact O-N 2.9Å; Q56-Q59 PolarHBondContact O-N 3.33Å; Q59-N62 PolarHBondContact O-N 2.68Å; Q59-Q63 WeakPolarHBondContact O-CB 3.42Å; Q59-Q63 PolarHBondContact O-N 3.44Å
60Q94.6Very high92.9Very high96 Ų9649.6 Ų49.645%0.44924%0.235SC..Hα-helixtrans-62.6-42.7176.3-171.6-179.610.700112.1L30 Q56 K57 Q58 Q63 L64L30-Q60 HydrophobicContact CD1-CB 4.32Å; L30-Q60 HydrophobicContact CD1-CG 3.79Å; Q56-Q60 WeakPolarHBondContact O-CB 3.4Å; Q56-Q60 PolarHBondContact O-N 2.87Å; K57-Q60 PolarHBondContact O-N 3.32Å; Q58-Q60 VanDerWaalsContact C-N 3.32Å; Q58-Q60 PolarHBondContact O-N 3.38Å; Q60-Q63 PolarHBondContact O-N 3.3Å; Q60-L64 HydrophobicContact CG-CD1 4.33Å; Q60-L64 WeakPolarHBondContact O-CB 3.37Å; Q60-L64 WeakPolarHBondContact O-CG 3.4Å; Q60-L64 PolarHBondContact O-N 2.93Å
61G93.8Very high93.2Very high0 Ų049.7 Ų49.70%024%0.236CC..Hα-helixtrans-61.4-45.617600000112.3K57 Q58 L64 A65K57-G61 PolarHBondContact O-N 3.02Å; Q58-G61 PolarHBondContact O-N 3.26Å; Q58-G61 VanDerWaalsContact O-N 3.17Å; G61-L64 PolarHBondContact O-N 3.39Å; G61-A65 PolarHBondContact O-N 2.88Å
62N95.8Very high93.6Very high9 Ų948.9 Ų48.95%0.04823%0.232CC..Hα-helixtrans-65-42.3177.9-168.510.2000111.7Q58 Q59 L64 A65 K66 D182 D185Q58-N62 PolarHBondContact O-N 2.98Å; Q59-N62 PolarHBondContact O-N 2.68Å; N62-L64 PolarHBondContact O-N 3.45Å; N62-A65 WeakPolarHBondContact O-CB 3.42Å; N62-A65 PolarHBondContact O-N 3Å; N62-K66 WeakPolarHBondContact O-CG 3.38Å; N62-K66 PolarHBondContact O-N 2.71Å; N62-K66 WeakPolarHBondContact OD1-CE 3.47Å; N62-D182 HydrophobicContact CB-CB 4.43Å; N62-D182 PolarHBondContact ND2-OD1 3.44Å; N62-D185 PolarHBondContact ND2-OD2 2.92Å
63Q96.4Very high93.7Very high94 Ų9446.9 Ų46.944%0.43922%0.222SC..Hα-helixtrans-62.4-44.8176.5-174.758.245.500112.1Q59 Q60 A65 K66 D67Q59-Q63 WeakPolarHBondContact O-CB 3.42Å; Q59-Q63 PolarHBondContact O-N 3.44Å; Q60-Q63 PolarHBondContact O-N 3.3Å; Q63-A65 VanDerWaalsContact C-N 3.3Å; Q63-A65 PolarHBondContact O-N 3.48Å; Q63-K66 PolarHBondContact O-N 3.08Å; Q63-D67 PolarHBondContact NE2-OD1 3.32Å; Q63-D67 PolarHBondContact NE2-OD2 2.98Å; Q63-D67 PolarHBondContact O-N 3.47Å
64L96Very high93.9Very high18 Ų1847 Ų479%0.09422%0.222CC..Hα-helixtrans-61.1-39.4175.2-77.3168.3000111.8N23 R26 I27 L30 Q60 G61 N62 D67 T68N23-L64 HydrophobicContact CB-CD2 4.26Å; R26-L64 HydrophobicContact CB-CD1 3.79Å; I27-L64 HydrophobicContact CD1-CB 4.04Å; I27-L64 HydrophobicContact CG1-CB 3.65Å; I27-L64 HydrophobicContact CG1-CD1 4.29Å; L30-L64 HydrophobicContact CD1-CD1 3.46Å; L30-L64 VanDerWaalsContact CD1-CD1 3.46Å; Q60-L64 HydrophobicContact CG-CD1 4.33Å; Q60-L64 WeakPolarHBondContact O-CB 3.37Å; Q60-L64 WeakPolarHBondContact O-CG 3.4Å; Q60-L64 PolarHBondContact O-N 2.93Å; G61-L64 PolarHBondContact O-N 3.39Å; N62-L64 PolarHBondContact O-N 3.45Å; L64-D67 PolarHBondContact O-N 2.84Å; L64-T68 VanDerWaalsContact O-CB 3.28Å; L64-T68 WeakPolarHBondContact O-CB 3.45Å; L64-T68 PolarHBondContact O-N 2.98Å; L64-T68 PolarHBondContact O-OG1 3.26Å
65A97Very high93.9Very high0 Ų047.3 Ų47.30%022%0.224CC..Hα-helixtrans-59.7-50175.100000111.2I27 G61 N62 Q63 D67 T68 D69 F98 L102 I189I27-A65 HydrophobicContact CD1-CB 4.46Å; G61-A65 PolarHBondContact O-N 2.88Å; N62-A65 WeakPolarHBondContact O-CB 3.42Å; N62-A65 PolarHBondContact O-N 3Å; Q63-A65 VanDerWaalsContact C-N 3.3Å; Q63-A65 PolarHBondContact O-N 3.48Å; A65-D67 PolarHBondContact O-N 3.22Å; A65-T68 PolarHBondContact O-N 3.47Å; A65-D69 PolarHBondContact O-N 3.09Å; A65-F98 WeakPolarHBondContact O-CZ 3.42Å; A65-L102 HydrophobicContact CB-CD2 3.62Å; A65-I189 HydrophobicContact CB-CD1 3.8Å
66K97.3Very high93.7Very high67 Ų6746.7 Ų46.729%0.29122%0.224SC..Hα-helixtrans-61.3-41.6178.4-70.3178.9-178-178.20113.1N62 Q63 D69 K70 D185 I189N62-K66 WeakPolarHBondContact O-CG 3.38Å; N62-K66 PolarHBondContact O-N 2.71Å; N62-K66 WeakPolarHBondContact OD1-CE 3.47Å; Q63-K66 PolarHBondContact O-N 3.08Å; K66-D69 PolarHBondContact O-N 2.83Å; K66-K70 WeakPolarHBondContact O-CG 3.41Å; K66-K70 PolarHBondContact O-N 2.7Å; K66-K70 VanDerWaalsContact O-N 3.13Å; K66-D185 WeakPolarHBondContact CE-OD2 3.43Å; K66-D185 IonicContact NZ-OD1 2.74Å; K66-D185 PolarHBondContact NZ-OD1 2.89Å; K66-D185 VanDerWaalsContact NZ-OD1 3.17Å; K66-D185 IonicContact NZ-OD2 2.7Å; K66-D185 PolarHBondContact NZ-OD2 2.9Å; K66-I189 HydrophobicContact CG-CD1 4.24Å
67D95.8Very high93.4Very high54 Ų5444.8 Ų44.829%0.28923%0.225SC..Hα-helixtrans-71.8-35.9179.2-67.8-25.2000111.7Q63 L64 A65 K70 L71Q63-D67 PolarHBondContact NE2-OD1 3.32Å; Q63-D67 PolarHBondContact NE2-OD2 2.98Å; Q63-D67 PolarHBondContact O-N 3.47Å; L64-D67 PolarHBondContact O-N 2.84Å; A65-D67 PolarHBondContact O-N 3.22Å; D67-K70 PolarHBondContact O-N 3.24Å; D67-K70 IonicContact OD1-NZ 3.73Å; D67-K70 PolarHBondContact OD1-NZ 2.74Å; D67-L71 VanDerWaalsContact O-CG 3.3Å; D67-L71 WeakPolarHBondContact O-CG 3.24Å; D67-L71 PolarHBondContact O-N 3.1Å
68T96.3Very high93.1Very high0 Ų044.2 Ų44.20%022%0.224CC..Hα-helixtrans-65-41.4173.9-53.30000111.4I20 N23 I24 L64 A65 L71 M72 F98I20-T68 HydrophobicContact CG2-CG2 3.91Å; N23-T68 WeakPolarHBondContact CB-OG1 3.47Å; N23-T68 PolarHBondContact ND2-OG1 3.11Å; I24-T68 HydrophobicContact CG1-CG2 4.12Å; L64-T68 VanDerWaalsContact O-CB 3.28Å; L64-T68 WeakPolarHBondContact O-CB 3.45Å; L64-T68 PolarHBondContact O-N 2.98Å; L64-T68 PolarHBondContact O-OG1 3.26Å; A65-T68 PolarHBondContact O-N 3.47Å; T68-L71 PolarHBondContact O-N 3.38Å; T68-M72 WeakPolarHBondContact O-CB 3.47Å; T68-M72 WeakPolarHBondContact O-CG 3.44Å; T68-M72 PolarHBondContact O-N 3.37Å; T68-F98 HydrophobicContact CG2-CD1 4.09Å; T68-F98 HydrophobicContact CG2-CD2 3.78Å; T68-F98 HydrophobicContact CG2-CE1 4.01Å; T68-F98 HydrophobicContact CG2-CE2 3.68Å; T68-F98 HydrophobicContact CG2-CG 4.01Å; T68-F98 HydrophobicContact CG2-CZ 3.8Å
69D96.3Very high92.3Very high11 Ų1149.2 Ų49.26%0.05926%0.257CS..Hα-helixtrans-58-47.4173.6174.165.5000112.1A65 K66 L71 M72 K73 F98 I189A65-D69 PolarHBondContact O-N 3.09Å; K66-D69 PolarHBondContact O-N 2.83Å; D69-L71 PolarHBondContact O-N 3.09Å; D69-M72 WeakPolarHBondContact O-CB 3.43Å; D69-M72 PolarHBondContact O-N 2.8Å; D69-K73 WeakPolarHBondContact O-CG 3.22Å; D69-K73 PolarHBondContact O-N 3.31Å; D69-K73 WeakPolarHBondContact OD1-CE 3.41Å; D69-K73 IonicContact OD1-NZ 3.17Å; D69-K73 VanDerWaalsContact OD2-CE 3.26Å; D69-K73 WeakPolarHBondContact OD2-CE 3.43Å; D69-K73 IonicContact OD2-NZ 2.7Å; D69-K73 PolarHBondContact OD2-NZ 2.67Å; D69-F98 HydrophobicContact CB-CE1 4.4Å; D69-I189 HydrophobicContact CB-CD1 4.37Å; D69-I189 HydrophobicContact CB-CG1 4.05Å; D69-I189 HydrophobicContact CB-CG2 3.85Å
70K95.3Very high91.2Very high119 Ų11950.2 Ų50.252%0.51727%0.265SS..Hα-helixtrans-58.3-46.8175.2-68.9169.7-167.3161.70111.9K66 D67 M72 K73 V74K66-K70 WeakPolarHBondContact O-CG 3.41Å; K66-K70 PolarHBondContact O-N 2.7Å; K66-K70 VanDerWaalsContact O-N 3.13Å; D67-K70 PolarHBondContact O-N 3.24Å; D67-K70 IonicContact OD1-NZ 3.73Å; D67-K70 PolarHBondContact OD1-NZ 2.74Å; K70-M72 VanDerWaalsContact C-N 3.32Å; K70-M72 PolarHBondContact O-N 3.04Å; K70-K73 PolarHBondContact O-N 2.78Å; K70-V74 WeakPolarHBondContact O-CG2 3.41Å; K70-V74 PolarHBondContact O-N 2.7Å
71L93.9Very high90.1Very high30 Ų3047 Ų4716%0.15726%0.257CS..Hα-helixtrans-63.8-38.5178.5-68173.5000111.8L16 N19 I20 D67 T68 D69 V74 F75L16-L71 HydrophobicContact CD2-CD2 3.74Å; N19-L71 HydrophobicContact CB-CD1 3.93Å; I20-L71 HydrophobicContact CD1-CB 4.05Å; I20-L71 HydrophobicContact CG1-CB 3.53Å; I20-L71 HydrophobicContact CG1-CD1 4.22Å; D67-L71 VanDerWaalsContact O-CG 3.3Å; D67-L71 WeakPolarHBondContact O-CG 3.24Å; D67-L71 PolarHBondContact O-N 3.1Å; T68-L71 PolarHBondContact O-N 3.38Å; D69-L71 PolarHBondContact O-N 3.09Å; L71-V74 PolarHBondContact O-N 3.08Å; L71-F75 WeakPolarHBondContact O-CB 3.31Å; L71-F75 PolarHBondContact O-N 3.26Å
72M93Very high89Confident0 Ų053.3 Ų53.30%030%0.298CS..Hα-helixtrans-63.1-42.4174.7-80.6-59.4-52.700112I20 T68 D69 K70 F75 T76 L94 L95 F98 M196I20-M72 HydrophobicContact CD1-CG 4.36Å; I20-M72 HydrophobicContact CD1-SD 3.77Å; I20-M72 HydrophobicContact CG1-SD 4.38Å; I20-M72 HydrophobicContact CG2-CG 4.16Å; I20-M72 HydrophobicContact CG2-SD 3.7Å; T68-M72 WeakPolarHBondContact O-CB 3.47Å; T68-M72 WeakPolarHBondContact O-CG 3.44Å; T68-M72 PolarHBondContact O-N 3.37Å; D69-M72 WeakPolarHBondContact O-CB 3.43Å; D69-M72 PolarHBondContact O-N 2.8Å; K70-M72 VanDerWaalsContact C-N 3.32Å; K70-M72 PolarHBondContact O-N 3.04Å; M72-F75 PolarHBondContact O-N 3.15Å; M72-T76 HydrophobicContact CE-CG2 4.34Å; M72-T76 WeakPolarHBondContact O-CB 3.47Å; M72-T76 WeakPolarHBondContact O-CG2 3.31Å; M72-T76 PolarHBondContact O-N 3.2Å; M72-T76 PolarHBondContact O-OG1 3.45Å; M72-L94 HydrophobicContact CE-CB 4.31Å; M72-L94 HydrophobicContact SD-CB 3.82Å; M72-L94 HydrophobicContact SD-CD1 4.33Å; M72-L95 HydrophobicContact CE-CD2 3.63Å; M72-L95 HydrophobicContact CE-CG 3.77Å; M72-F98 HydrophobicContact CG-CD1 4.27Å; M72-M196 HydrophobicContact CB-CE 4.16Å; M72-M196 HydrophobicContact CB-SD 4.06Å; M72-M196 HydrophobicContact CE-SD 4.28Å
73K92.3Very high88.1Confident79 Ų7957.3 Ų57.334%0.34332%0.319SS..Hα-helixtrans-62.3-43.8174.3-73.3169.8177.8162.90111.8D69 K70 T76 S77 D192 M196D69-K73 WeakPolarHBondContact O-CG 3.22Å; D69-K73 PolarHBondContact O-N 3.31Å; D69-K73 WeakPolarHBondContact OD1-CE 3.41Å; D69-K73 IonicContact OD1-NZ 3.17Å; D69-K73 VanDerWaalsContact OD2-CE 3.26Å; D69-K73 WeakPolarHBondContact OD2-CE 3.43Å; D69-K73 IonicContact OD2-NZ 2.7Å; D69-K73 PolarHBondContact OD2-NZ 2.67Å; K70-K73 PolarHBondContact O-N 2.78Å; K73-T76 WeakPolarHBondContact CA-OG1 3.44Å; K73-T76 PolarHBondContact O-N 3.42Å; K73-T76 PolarHBondContact O-OG1 3.08Å; K73-T76 VanDerWaalsContact O-OG1 3.06Å; K73-S77 WeakPolarHBondContact O-CB 3.47Å; K73-S77 PolarHBondContact O-N 3.1Å; K73-S77 PolarHBondContact O-OG 3.38Å; K73-D192 VanDerWaalsContact CE-CG 3.42Å; K73-D192 WeakPolarHBondContact CE-OD2 3.29Å; K73-D192 IonicContact NZ-OD1 3.59Å; K73-D192 IonicContact NZ-OD2 2.72Å; K73-D192 PolarHBondContact NZ-OD2 3.11Å; K73-M196 HydrophobicContact CG-CE 4.33Å
74V90.9Very high87.3Confident60 Ų6057.8 Ų57.836%0.36432%0.322SS..Hα-helixtrans-60.5-50.8174.5175.10000110.2L16 K70 L71 T76 S77 L78L16-V74 HydrophobicContact CD1-CG1 3.9Å; L16-V74 HydrophobicContact CD2-CG1 4.2Å; K70-V74 WeakPolarHBondContact O-CG2 3.41Å; K70-V74 PolarHBondContact O-N 2.7Å; L71-V74 PolarHBondContact O-N 3.08Å; V74-T76 VanDerWaalsContact C-N 3.32Å; V74-T76 PolarHBondContact O-N 3.04Å; V74-S77 PolarHBondContact O-N 3Å; V74-S77 VanDerWaalsContact O-N 3.14Å; V74-S77 PolarHBondContact O-OG 3.43Å; V74-L78 PolarHBondContact O-N 3.05Å
75F89.3Confident86.5Confident9 Ų966.9 Ų66.94%0.03936%0.355CS..Hα-helixtrans-58.9-40.6-179.1-178.7-106.1000113P13 L16 V17 I20 L71 M72 L78 Q90 K91 L94P13-F75 HydrophobicContact CB-CE2 4.35Å; L16-F75 HydrophobicContact CB-CD2 4.09Å; L16-F75 HydrophobicContact CD1-CB 4.3Å; L16-F75 HydrophobicContact CD1-CD2 4.31Å; V17-F75 HydrophobicContact CG2-CD2 4.12Å; V17-F75 HydrophobicContact CG2-CE2 3.42Å; V17-F75 VanDerWaalsContact CG2-CE2 3.42Å; V17-F75 HydrophobicContact CG2-CZ 3.7Å; I20-F75 HydrophobicContact CD1-CB 4.02Å; I20-F75 HydrophobicContact CD1-CG 4.38Å; L71-F75 WeakPolarHBondContact O-CB 3.31Å; L71-F75 PolarHBondContact O-N 3.26Å; M72-F75 PolarHBondContact O-N 3.15Å; F75-L78 HydrophobicContact CD2-CD1 4.2Å; F75-L78 PolarHBondContact O-N 3.35Å; F75-Q90 HydrophobicContact CZ-CB 4.02Å; F75-K91 HydrophobicContact CE1-CB 3.93Å; F75-L94 HydrophobicContact CE1-CD1 4.32Å
76T86.4Confident85.9Confident47 Ų4771.8 Ų71.829%0.28838%0.378SS..Hα-helixtrans-74.5-26.3178.651.20000113.4M72 K73 V74 L78 K91 M196M72-T76 HydrophobicContact CE-CG2 4.34Å; M72-T76 WeakPolarHBondContact O-CB 3.47Å; M72-T76 WeakPolarHBondContact O-CG2 3.31Å; M72-T76 PolarHBondContact O-N 3.2Å; M72-T76 PolarHBondContact O-OG1 3.45Å; K73-T76 WeakPolarHBondContact CA-OG1 3.44Å; K73-T76 PolarHBondContact O-N 3.42Å; K73-T76 PolarHBondContact O-OG1 3.08Å; K73-T76 VanDerWaalsContact O-OG1 3.06Å; V74-T76 VanDerWaalsContact C-N 3.32Å; V74-T76 PolarHBondContact O-N 3.04Å; T76-L78 VanDerWaalsContact C-N 3.31Å; T76-K91 HydrophobicContact CG2-CD 3.88Å; T76-K91 HydrophobicContact CG2-CG 4.07Å; T76-M196 HydrophobicContact CG2-CG 4.23Å; T76-M196 HydrophobicContact CG2-SD 3.8Å
77S86.8Confident85.2Confident91 Ų9170.6 Ų70.664%0.63637%0.371SS*.Hα-helixtrans-79-8.8175.973.60000114.6K73 V74K73-S77 WeakPolarHBondContact O-CB 3.47Å; K73-S77 PolarHBondContact O-N 3.1Å; K73-S77 PolarHBondContact O-OG 3.38Å; V74-S77 PolarHBondContact O-N 3Å; V74-S77 VanDerWaalsContact O-N 3.14Å; V74-S77 PolarHBondContact O-OG 3.43Å
78L83.6Confident84.6Confident34 Ų3473.3 Ų73.318%0.17838%0.38CS..SBendtrans-64.4141.1-176.6-72.3177.1000112.2P13 L16 V74 F75 T76P13-L78 HydrophobicContact CB-CD1 4Å; P13-L78 HydrophobicContact CG-CD1 3.91Å; L16-L78 HydrophobicContact CD1-CD1 3.75Å; L16-L78 HydrophobicContact CD1-CG 4.46Å; V74-L78 PolarHBondContact O-N 3.05Å; F75-L78 HydrophobicContact CD2-CD1 4.2Å; F75-L78 PolarHBondContact O-N 3.35Å; T76-L78 VanDerWaalsContact C-N 3.31Å
79P74.9Confident84Confident109 Ų10978.7 Ų78.771%0.70841%0.409SS*.  trans-63148.8-17723.4-31.5000112.5G81P79-G81 PolarHBondContact O-N 2.97Å
80I69.1Low83.6Confident128 Ų12880.1 Ų80.166%0.65642%0.415SS*.  trans-73.594.3179.9-59.3168.3000109.3Q84I80-Q84 HydrophobicContact CG2-CB 3.95Å; I80-Q84 HydrophobicContact CG2-CG 3.72Å
81G72.1Confident83.2Confident28 Ų2875.5 Ų75.529%0.28940%0.395SS..  trans-88.6-177.5166.600000114.4P79 D83 Q84 R87P79-G81 PolarHBondContact O-N 2.97Å; G81-D83 PolarHBondContact O-N 3.45Å; G81-D83 VanDerWaalsContact O-N 3.11Å; G81-Q84 PolarHBondContact O-N 3.13Å; G81-R87 PolarHBondContact O-NH2 3.29Å
82P70.8Confident82.8Confident132 Ų13275.6 Ų75.686%0.85740%0.395SS*.THydrogen-bonded Turntrans-57.2-31.3-173.521.9-33000114Q84P82-Q84 PolarHBondContact O-N 2.98Å; P82-Q84 VanDerWaalsContact O-N 3.08Å
83D77.8Confident82.5Confident94 Ų9483.8 Ų83.850%0.50343%0.426SS..THydrogen-bonded Turntrans-83.431.6179.7-52.7-49.8000114.6G81 R85 Q86 R87G81-D83 PolarHBondContact O-N 3.45Å; G81-D83 VanDerWaalsContact O-N 3.11Å; D83-R85 VanDerWaalsContact C-N 3.28Å; D83-R85 PolarHBondContact O-N 3.1Å; D83-Q86 HydrophobicContact CB-CB 4.45Å; D83-Q86 PolarHBondContact O-N 3.49Å; D83-Q86 VanDerWaalsContact O-N 3.14Å; D83-R87 PolarHBondContact O-N 3.12Å
84Q78.9Confident82.4Confident104 Ų10480.2 Ų80.249%0.48641%0.411SS..Hα-helixtrans-56.3-40.4-174.5-173.8179.116.200113I80 G81 P82 R87 K88I80-Q84 HydrophobicContact CG2-CB 3.95Å; I80-Q84 HydrophobicContact CG2-CG 3.72Å; G81-Q84 PolarHBondContact O-N 3.13Å; P82-Q84 PolarHBondContact O-N 2.98Å; P82-Q84 VanDerWaalsContact O-N 3.08Å; Q84-R87 VanDerWaalsContact CA-NH2 3.34Å; Q84-R87 PolarHBondContact O-N 2.94Å; Q84-K88 WeakPolarHBondContact O-CB 3.45Å; Q84-K88 PolarHBondContact O-N 2.95Å
85R79.7Confident82.4Confident209 Ų20977.5 Ų77.579%0.78940%0.395SS*.Hα-helixtrans-63.8-42.5179.5-171178.4-177178.31.6111.9D83 K88 L89D83-R85 VanDerWaalsContact C-N 3.28Å; D83-R85 PolarHBondContact O-N 3.1Å; R85-K88 PolarHBondContact O-N 2.9Å; R85-L89 WeakPolarHBondContact O-CG 3.12Å; R85-L89 PolarHBondContact O-N 3.31Å; R85-L89 VanDerWaalsContact O-N 3.16Å
86Q83.6Confident82.3Confident103 Ų10379.3 Ų79.348%0.48141%0.405SS..Hα-helixtrans-67.4-43.7177.7-179.2176-24.500111.1D83 K88 L89 Q90D83-Q86 HydrophobicContact CB-CB 4.45Å; D83-Q86 PolarHBondContact O-N 3.49Å; D83-Q86 VanDerWaalsContact O-N 3.14Å; Q86-K88 VanDerWaalsContact C-N 3.31Å; Q86-K88 PolarHBondContact O-N 3.38Å; Q86-L89 PolarHBondContact O-N 3.49Å; Q86-Q90 WeakPolarHBondContact O-CG 3.44Å; Q86-Q90 PolarHBondContact O-N 3.27Å
87R82.5Confident82.4Confident41 Ų4180 Ų8016%0.15541%0.406CS..Hα-helixtrans-62.3-37.7176.8-71.6-164.7-58.7-74.8-12.7112.4G81 D83 Q84 Q90 K91G81-R87 PolarHBondContact O-NH2 3.29Å; D83-R87 PolarHBondContact O-N 3.12Å; Q84-R87 VanDerWaalsContact CA-NH2 3.34Å; Q84-R87 PolarHBondContact O-N 2.94Å; R87-Q90 PolarHBondContact O-N 3.36Å; R87-K91 WeakPolarHBondContact O-CB 3.44Å; R87-K91 PolarHBondContact O-N 2.72Å
88K82.6Confident82.8Confident111 Ų11175.6 Ų75.648%0.48338%0.376SS..Hα-helixtrans-60.6-51.1174.7-172.1-179.3-178.3-177.10111.5Q84 R85 Q86 Q90 K91 D92Q84-K88 WeakPolarHBondContact O-CB 3.45Å; Q84-K88 PolarHBondContact O-N 2.95Å; R85-K88 PolarHBondContact O-N 2.9Å; Q86-K88 VanDerWaalsContact C-N 3.31Å; Q86-K88 PolarHBondContact O-N 3.38Å; K88-Q90 VanDerWaalsContact C-N 3.3Å; K88-Q90 PolarHBondContact O-N 2.92Å; K88-K91 WeakPolarHBondContact O-CB 3.45Å; K88-K91 PolarHBondContact O-N 3.47Å; K88-K91 VanDerWaalsContact O-N 3.13Å; K88-D92 VanDerWaalsContact O-CG 3.24Å; K88-D92 PolarHBondContact O-N 3.08Å
89L84.9Confident83.1Confident113 Ų11375.1 Ų75.159%0.59238%0.376SS*.Hα-helixtrans-60.4-39.2177.3-68.4170.9000112.4R85 Q86 R93R85-L89 WeakPolarHBondContact O-CG 3.12Å; R85-L89 PolarHBondContact O-N 3.31Å; R85-L89 VanDerWaalsContact O-N 3.16Å; Q86-L89 PolarHBondContact O-N 3.49Å; L89-R93 WeakPolarHBondContact O-CB 3.26Å; L89-R93 PolarHBondContact O-N 3.41Å; L89-R93 VanDerWaalsContact O-N 3.12Å
90Q87.4Confident83.8Confident41 Ų4171.1 Ų71.119%0.19235%0.351CS..Hα-helixtrans-65.4-44.1174.4-73.1174-26.700111.5V17 F75 Q86 R87 K88 R93 L94V17-Q90 HydrophobicContact CG2-CB 4.33Å; F75-Q90 HydrophobicContact CZ-CB 4.02Å; Q86-Q90 WeakPolarHBondContact O-CG 3.44Å; Q86-Q90 PolarHBondContact O-N 3.27Å; R87-Q90 PolarHBondContact O-N 3.36Å; K88-Q90 VanDerWaalsContact C-N 3.3Å; K88-Q90 PolarHBondContact O-N 2.92Å; Q90-R93 PolarHBondContact O-N 2.94Å; Q90-L94 WeakPolarHBondContact O-CB 3.44Å; Q90-L94 WeakPolarHBondContact O-CG 3.4Å; Q90-L94 PolarHBondContact O-N 2.91Å
91K86.7Confident84.8Confident23 Ų2365.1 Ų65.110%0.132%0.321CS..Hα-helixtrans-55.7-52.7175.3178.6-175.8171.2177.70110.6F75 T76 R87 K88 R93 L94 L95 M196 E199F75-K91 HydrophobicContact CE1-CB 3.93Å; T76-K91 HydrophobicContact CG2-CD 3.88Å; T76-K91 HydrophobicContact CG2-CG 4.07Å; R87-K91 WeakPolarHBondContact O-CB 3.44Å; R87-K91 PolarHBondContact O-N 2.72Å; K88-K91 WeakPolarHBondContact O-CB 3.45Å; K88-K91 PolarHBondContact O-N 3.47Å; K88-K91 VanDerWaalsContact O-N 3.13Å; K91-R93 VanDerWaalsContact C-N 3.33Å; K91-R93 PolarHBondContact O-N 3.23Å; K91-L94 PolarHBondContact O-N 2.88Å; K91-L95 HydrophobicContact CD-CD1 4.38Å; K91-L95 HydrophobicContact CG-CD1 3.75Å; K91-L95 HydrophobicContact CG-CG 4.36Å; K91-L95 WeakPolarHBondContact O-CB 3.31Å; K91-L95 WeakPolarHBondContact O-CG 3.3Å; K91-L95 PolarHBondContact O-N 3.22Å; K91-M196 WeakPolarHBondContact CE-O 3.42Å; K91-M196 PolarHBondContact NZ-O 3.13Å; K91-E199 IonicContact NZ-OE2 3.45Å
92D85.1Confident85.8Confident31 Ų3163.8 Ų63.817%0.16631%0.307CS..Hα-helixtrans-62.3-43.7-175.5-61.3-20000111.3K88 N96 Q200 M203K88-D92 VanDerWaalsContact O-CG 3.24Å; K88-D92 PolarHBondContact O-N 3.08Å; D92-N96 VanDerWaalsContact O-CG 3.3Å; D92-N96 PolarHBondContact O-N 3.39Å; D92-N96 VanDerWaalsContact O-N 3.08Å; D92-N96 PolarHBondContact O-ND2 3.02Å; D92-Q200 PolarHBondContact OD1-NE2 2.95Å; D92-Q200 PolarHBondContact OD1-OE1 3.38Å; D92-Q200 PolarHBondContact OD2-OE1 3.45Å; D92-M203 HydrophobicContact CB-CE 4.02Å
93R87.4Confident86.7Confident172 Ų17260.2 Ų60.265%0.64928%0.281SS*.Hα-helixtrans-61-50.5175.1-178.9-179.1174.4157.12.7111.9L89 Q90 K91 L95 N96 D97L89-R93 WeakPolarHBondContact O-CB 3.26Å; L89-R93 PolarHBondContact O-N 3.41Å; L89-R93 VanDerWaalsContact O-N 3.12Å; Q90-R93 PolarHBondContact O-N 2.94Å; K91-R93 VanDerWaalsContact C-N 3.33Å; K91-R93 PolarHBondContact O-N 3.23Å; R93-L95 VanDerWaalsContact C-N 3.32Å; R93-L95 PolarHBondContact O-N 3.48Å; R93-N96 PolarHBondContact O-N 2.91Å; R93-D97 IonicContact NE-OD2 3.2Å; R93-D97 PolarHBondContact NE-OD2 3.41Å; R93-D97 WeakPolarHBondContact O-CB 3.48Å; R93-D97 VanDerWaalsContact O-CG 3.29Å; R93-D97 PolarHBondContact O-N 2.9Å
94L90.8Very high87.4Confident4 Ų457.4 Ų57.42%0.02127%0.269CS..Hα-helixtrans-64.2-37.9-177.7-69173.2000111.9V17 I20 S21 I24 M72 F75 Q90 K91 F98V17-L94 HydrophobicContact CB-CD1 4.37Å; V17-L94 HydrophobicContact CG1-CD1 4.27Å; V17-L94 HydrophobicContact CG2-CD1 4.03Å; I20-L94 HydrophobicContact CB-CD1 4.39Å; I20-L94 HydrophobicContact CB-CD2 4.36Å; I20-L94 HydrophobicContact CD1-CD1 4.15Å; I20-L94 HydrophobicContact CG2-CB 4.28Å; I20-L94 HydrophobicContact CG2-CD1 4.13Å; I20-L94 HydrophobicContact CG2-CD2 3.83Å; I20-L94 HydrophobicContact CG2-CG 4.3Å; S21-L94 WeakPolarHBondContact OG-CD2 3.38Å; I24-L94 HydrophobicContact CD1-CD2 4.29Å; M72-L94 HydrophobicContact CE-CB 4.31Å; M72-L94 HydrophobicContact SD-CB 3.82Å; M72-L94 HydrophobicContact SD-CD1 4.33Å; F75-L94 HydrophobicContact CE1-CD1 4.32Å; Q90-L94 WeakPolarHBondContact O-CB 3.44Å; Q90-L94 WeakPolarHBondContact O-CG 3.4Å; Q90-L94 PolarHBondContact O-N 2.91Å; K91-L94 PolarHBondContact O-N 2.88Å; L94-F98 WeakPolarHBondContact O-CB 3.37Å; L94-F98 PolarHBondContact O-N 3.46Å
95L90.7Very high88Confident4 Ų452.5 Ų52.52%0.02125%0.246CC..Hα-helixtrans-61.6-46.1174.6-76170.4000111.5M72 K91 R93 S99 L193 M196 V197M72-L95 HydrophobicContact CE-CD2 3.63Å; M72-L95 HydrophobicContact CE-CG 3.77Å; K91-L95 HydrophobicContact CD-CD1 4.38Å; K91-L95 HydrophobicContact CG-CD1 3.75Å; K91-L95 HydrophobicContact CG-CG 4.36Å; K91-L95 WeakPolarHBondContact O-CB 3.31Å; K91-L95 WeakPolarHBondContact O-CG 3.3Å; K91-L95 PolarHBondContact O-N 3.22Å; R93-L95 VanDerWaalsContact C-N 3.32Å; R93-L95 PolarHBondContact O-N 3.48Å; L95-S99 WeakPolarHBondContact O-CB 3.42Å; L95-S99 PolarHBondContact O-N 3.45Å; L95-L193 HydrophobicContact CD2-CD2 3.49Å; L95-L193 VanDerWaalsContact CD2-CD2 3.49Å; L95-M196 HydrophobicContact CD1-CB 4.26Å; L95-M196 HydrophobicContact CD2-CB 3.89Å; L95-M196 HydrophobicContact CD2-SD 4.09Å; L95-V197 HydrophobicContact CD1-CG2 3.94Å
96N87.4Confident88.7Confident46 Ų4643.1 Ų43.125%0.24621%0.211CC..Hα-helixtrans-63.9-49177.4-73.3-27000112.2D92 R93 F98 S99 A100 M203D92-N96 VanDerWaalsContact O-CG 3.3Å; D92-N96 PolarHBondContact O-N 3.39Å; D92-N96 VanDerWaalsContact O-N 3.08Å; D92-N96 PolarHBondContact O-ND2 3.02Å; R93-N96 PolarHBondContact O-N 2.91Å; N96-F98 VanDerWaalsContact C-N 3.31Å; N96-F98 PolarHBondContact O-N 3.17Å; N96-S99 PolarHBondContact O-N 2.97Å; N96-A100 WeakPolarHBondContact O-CB 3.39Å; N96-A100 PolarHBondContact O-N 3.4Å; N96-M203 WeakPolarHBondContact ND2-CE 3.49Å; N96-M203 PolarHBondContact ND2-SD 3.23Å; N96-M203 WeakPolarHBondContact OD1-CE 3.38Å; N96-M203 PolarHBondContact OD1-SD 3.42Å
97D88Confident89.1Confident61 Ų6143.8 Ų43.833%0.32621%0.212SC..Hα-helixtrans-62.4-41.6-178.9-71-12.7000110.5I24 R93 A101I24-D97 HydrophobicContact CD1-CB 4.15Å; I24-D97 HydrophobicContact CG2-CB 4.2Å; R93-D97 IonicContact NE-OD2 3.2Å; R93-D97 PolarHBondContact NE-OD2 3.41Å; R93-D97 WeakPolarHBondContact O-CB 3.48Å; R93-D97 VanDerWaalsContact O-CG 3.29Å; R93-D97 PolarHBondContact O-N 2.9Å; D97-A101 WeakPolarHBondContact O-CB 3.45Å; D97-A101 PolarHBondContact O-N 3.18Å; D97-A101 VanDerWaalsContact O-N 3.07Å
98F94.4Very high89.5Confident0 Ų042 Ų420%021%0.206CC..Hα-helixtrans-70.1-43.7178.4-173.3-147.3000112.3I24 I27 A65 T68 D69 M72 L94 N96 A100 A101 L102 I189 L193I24-F98 HydrophobicContact CD1-CB 3.76Å; I24-F98 HydrophobicContact CG1-CB 3.99Å; I24-F98 HydrophobicContact CG1-CD2 4.06Å; I24-F98 HydrophobicContact CG1-CG 4.33Å; I27-F98 HydrophobicContact CD1-CD2 4.44Å; I27-F98 HydrophobicContact CD1-CE2 3.95Å; A65-F98 WeakPolarHBondContact O-CZ 3.42Å; T68-F98 HydrophobicContact CG2-CD1 4.09Å; T68-F98 HydrophobicContact CG2-CD2 3.78Å; T68-F98 HydrophobicContact CG2-CE1 4.01Å; T68-F98 HydrophobicContact CG2-CE2 3.68Å; T68-F98 HydrophobicContact CG2-CG 4.01Å; T68-F98 HydrophobicContact CG2-CZ 3.8Å; D69-F98 HydrophobicContact CB-CE1 4.4Å; M72-F98 HydrophobicContact CG-CD1 4.27Å; L94-F98 WeakPolarHBondContact O-CB 3.37Å; L94-F98 PolarHBondContact O-N 3.46Å; N96-F98 VanDerWaalsContact C-N 3.31Å; N96-F98 PolarHBondContact O-N 3.17Å; F98-A100 VanDerWaalsContact C-N 3.31Å; F98-A100 PolarHBondContact O-N 3.44Å; F98-A101 PolarHBondContact O-N 3.45Å; F98-L102 HydrophobicContact CD1-CD1 4.32Å; F98-L102 HydrophobicContact CD2-CD1 4.18Å; F98-L102 HydrophobicContact CD2-CD2 4.37Å; F98-L102 HydrophobicContact CD2-CG 3.87Å; F98-L102 HydrophobicContact CE1-CD1 3.94Å; F98-L102 HydrophobicContact CE2-CD1 3.79Å; F98-L102 HydrophobicContact CE2-CD2 3.63Å; F98-L102 HydrophobicContact CE2-CG 3.56Å; F98-L102 HydrophobicContact CG-CD1 4.43Å; F98-L102 HydrophobicContact CZ-CD1 3.65Å; F98-L102 HydrophobicContact CZ-CD2 4.01Å; F98-L102 HydrophobicContact CZ-CG 3.96Å; F98-L102 WeakPolarHBondContact O-CG 3.41Å; F98-L102 PolarHBondContact O-N 2.98Å; F98-I189 HydrophobicContact CE1-CG2 3.75Å; F98-I189 HydrophobicContact CZ-CG2 3.85Å; F98-L193 HydrophobicContact CD1-CD1 3.87Å; F98-L193 HydrophobicContact CD1-CD2 3.58Å; F98-L193 HydrophobicContact CD1-CG 4.28Å; F98-L193 HydrophobicContact CE1-CD1 4.16Å; F98-L193 HydrophobicContact CE1-CD2 3.97Å; F98-L193 HydrophobicContact CE1-CG 4.42Å
99S91.6Very high90Very high24 Ų2436.7 Ų36.717%0.16818%0.183CC..Hα-helixtrans-57.7-43.91751790000111.6L95 N96 L102 N103L95-S99 WeakPolarHBondContact O-CB 3.42Å; L95-S99 PolarHBondContact O-N 3.45Å; N96-S99 PolarHBondContact O-N 2.97Å; S99-L102 PolarHBondContact O-N 3.32Å; S99-N103 WeakPolarHBondContact O-CB 3.48Å; S99-N103 PolarHBondContact O-N 2.9Å; S99-N103 PolarHBondContact O-ND2 2.87Å
100A87.7Confident90.5Very high24 Ų2437.2 Ų37.220%0.19818%0.177CC..Hα-helixtrans-62.7-44.6176.400000112N96 F98 N103 S104 N210N96-A100 WeakPolarHBondContact O-CB 3.39Å; N96-A100 PolarHBondContact O-N 3.4Å; F98-A100 VanDerWaalsContact C-N 3.31Å; F98-A100 PolarHBondContact O-N 3.44Å; A100-N103 PolarHBondContact O-N 3.02Å; A100-S104 PolarHBondContact O-N 2.87Å; A100-S104 VanDerWaalsContact O-N 3.14Å; A100-N210 HydrophobicContact CB-CB 4.49Å
101A91.9Very high90.7Very high3 Ų339.4 Ų39.43%0.02519%0.187CC..Hα-helixtrans-63.1-44.1177.700000112.3I24 I27 D97 F98 S104 L105I24-A101 HydrophobicContact CG2-CB 3.99Å; I27-A101 HydrophobicContact CB-CB 4.47Å; I27-A101 HydrophobicContact CG2-CB 3.99Å; D97-A101 WeakPolarHBondContact O-CB 3.45Å; D97-A101 PolarHBondContact O-N 3.18Å; D97-A101 VanDerWaalsContact O-N 3.07Å; F98-A101 PolarHBondContact O-N 3.45Å; A101-S104 PolarHBondContact O-N 3.2Å; A101-L105 PolarHBondContact O-N 3.43Å
102L92.6Very high90.9Very high0 Ų038.3 Ų38.30%018%0.182CC..Hα-helixtrans-64.4-41.1176.8-72.1-179.3000112.5A65 F98 S99 S104 L105 Q106 I186 I189 F190 L193A65-L102 HydrophobicContact CB-CD2 3.62Å; F98-L102 HydrophobicContact CD1-CD1 4.32Å; F98-L102 HydrophobicContact CD2-CD1 4.18Å; F98-L102 HydrophobicContact CD2-CD2 4.37Å; F98-L102 HydrophobicContact CD2-CG 3.87Å; F98-L102 HydrophobicContact CE1-CD1 3.94Å; F98-L102 HydrophobicContact CE2-CD1 3.79Å; F98-L102 HydrophobicContact CE2-CD2 3.63Å; F98-L102 HydrophobicContact CE2-CG 3.56Å; F98-L102 HydrophobicContact CG-CD1 4.43Å; F98-L102 HydrophobicContact CZ-CD1 3.65Å; F98-L102 HydrophobicContact CZ-CD2 4.01Å; F98-L102 HydrophobicContact CZ-CG 3.96Å; F98-L102 WeakPolarHBondContact O-CG 3.41Å; F98-L102 PolarHBondContact O-N 2.98Å; S99-L102 PolarHBondContact O-N 3.32Å; L102-S104 VanDerWaalsContact C-N 3.31Å; L102-S104 PolarHBondContact O-N 2.69Å; L102-L105 PolarHBondContact O-N 2.95Å; L102-Q106 VanDerWaalsContact O-CB 3.3Å; L102-Q106 WeakPolarHBondContact O-CB 3.07Å; L102-Q106 PolarHBondContact O-N 3.27Å; L102-I186 HydrophobicContact CB-CG2 4.27Å; L102-I186 HydrophobicContact CD2-CG2 4.3Å; L102-I189 HydrophobicContact CD1-CB 4.29Å; L102-I189 HydrophobicContact CD1-CG2 3.55Å; L102-F190 HydrophobicContact CB-CE1 4.12Å; L102-F190 HydrophobicContact CB-CE2 3.93Å; L102-F190 HydrophobicContact CB-CZ 3.52Å; L102-F190 HydrophobicContact CD1-CE1 4.48Å; L102-F190 HydrophobicContact CD1-CZ 4.49Å; L102-L193 HydrophobicContact CD1-CD1 3.68Å
103N90Very high91.3Very high56 Ų5636.9 Ų36.930%0.29918%0.175SC..Hα-helixtrans-60-44.1177.3-87.4-58.1000111S99 A100 K107 F190S99-N103 WeakPolarHBondContact O-CB 3.48Å; S99-N103 PolarHBondContact O-N 2.9Å; S99-N103 PolarHBondContact O-ND2 2.87Å; A100-N103 PolarHBondContact O-N 3.02Å; N103-K107 VanDerWaalsContact O-CB 3.29Å; N103-K107 WeakPolarHBondContact O-CB 3.28Å; N103-K107 PolarHBondContact O-N 3.05Å; N103-F190 HydrophobicContact CB-CZ 4.32Å; N103-F190 WeakPolarHBondContact OD1-CZ 3.4Å
104S90.9Very high91.6Very high36 Ų3633 Ų3325%0.25217%0.167SC..Hα-helixtrans-65-43.7177.1-167.70000112.2T31 A100 A101 L102 K107 T108T31-S104 WeakPolarHBondContact CG2-OG 3.05Å; A100-S104 PolarHBondContact O-N 2.87Å; A100-S104 VanDerWaalsContact O-N 3.14Å; A101-S104 PolarHBondContact O-N 3.2Å; L102-S104 VanDerWaalsContact C-N 3.31Å; L102-S104 PolarHBondContact O-N 2.69Å; S104-K107 PolarHBondContact O-N 3.29Å; S104-T108 WeakPolarHBondContact O-CB 3.37Å; S104-T108 PolarHBondContact O-N 2.99Å; S104-T108 PolarHBondContact O-OG1 3.41Å
105L92.3Very high91.5Very high0 Ų035.8 Ų35.80%018%0.179CC..Hα-helixtrans-61.8-49.7177.1179.461000111.2I27 L34 A101 L102 K107 T108 Q109 I186I27-L105 HydrophobicContact CG2-CB 4.35Å; I27-L105 HydrophobicContact CG2-CD2 4.16Å; L34-L105 HydrophobicContact CD1-CD1 3.9Å; A101-L105 PolarHBondContact O-N 3.43Å; L102-L105 PolarHBondContact O-N 2.95Å; L105-K107 PolarHBondContact O-N 3.13Å; L105-T108 WeakPolarHBondContact O-CB 3.3Å; L105-T108 PolarHBondContact O-N 3.21Å; L105-T108 VanDerWaalsContact O-N 3.16Å; L105-Q109 HydrophobicContact CD1-CG 4.42Å; L105-Q109 WeakPolarHBondContact O-CG 3.37Å; L105-Q109 PolarHBondContact O-N 3.31Å; L105-I186 HydrophobicContact CB-CD1 4.44Å; L105-I186 HydrophobicContact CD2-CD1 3.72Å; L105-I186 HydrophobicContact CG-CD1 3.86Å
106Q93.9Very high91.5Very high12 Ų1235.8 Ų35.86%0.05618%0.179CC..Hα-helixtrans-61.7-43.6-179.9-167.3-175.226.600111.7L102 T108 Q109 R110 I183 I186 N187L102-Q106 VanDerWaalsContact O-CB 3.3Å; L102-Q106 WeakPolarHBondContact O-CB 3.07Å; L102-Q106 PolarHBondContact O-N 3.27Å; Q106-T108 VanDerWaalsContact C-N 3.29Å; Q106-T108 PolarHBondContact O-N 3.38Å; Q106-Q109 PolarHBondContact O-N 2.74Å; Q106-R110 WeakPolarHBondContact O-CG 3.42Å; Q106-R110 PolarHBondContact O-N 3.29Å; Q106-I183 HydrophobicContact CG-CG2 4.29Å; Q106-I186 HydrophobicContact CB-CD1 4.37Å; Q106-I186 HydrophobicContact CB-CG2 4.11Å; Q106-I186 HydrophobicContact CG-CG2 4.32Å; Q106-N187 PolarHBondContact NE2-OD1 3Å
107K92.4Very high91.8Very high118 Ų11838.1 Ų38.151%0.51318%0.184SC..Hα-helixtrans-57.5-45.2174.8179.3177177.8-179.60111N103 S104 L105 R110 Q111N103-K107 VanDerWaalsContact O-CB 3.29Å; N103-K107 WeakPolarHBondContact O-CB 3.28Å; N103-K107 PolarHBondContact O-N 3.05Å; S104-K107 PolarHBondContact O-N 3.29Å; L105-K107 PolarHBondContact O-N 3.13Å; K107-R110 PolarHBondContact O-N 2.92Å; K107-Q111 WeakPolarHBondContact O-CG 3.32Å; K107-Q111 PolarHBondContact O-N 3.35Å
108T91.6Very high91.9Very high2 Ų240.4 Ų40.41%0.01219%0.193CC..Hα-helixtrans-66.4-40.7179.6-55.20000111.8T31 L34 Q35 V38 S104 L105 Q106 Q111 A112T31-T108 WeakPolarHBondContact CG2-OG1 3.49Å; L34-T108 HydrophobicContact CB-CG2 3.82Å; Q35-T108 HydrophobicContact CB-CG2 4.41Å; Q35-T108 HydrophobicContact CG-CG2 3.6Å; Q35-T108 VanDerWaalsContact CG-OG1 3.29Å; Q35-T108 WeakPolarHBondContact CG-OG1 3.23Å; Q35-T108 PolarHBondContact NE2-OG1 2.89Å; V38-T108 HydrophobicContact CG2-CG2 4.29Å; S104-T108 WeakPolarHBondContact O-CB 3.37Å; S104-T108 PolarHBondContact O-N 2.99Å; S104-T108 PolarHBondContact O-OG1 3.41Å; L105-T108 WeakPolarHBondContact O-CB 3.3Å; L105-T108 PolarHBondContact O-N 3.21Å; L105-T108 VanDerWaalsContact O-N 3.16Å; Q106-T108 VanDerWaalsContact C-N 3.29Å; Q106-T108 PolarHBondContact O-N 3.38Å; T108-Q111 PolarHBondContact O-N 2.98Å; T108-A112 PolarHBondContact O-N 3.42Å
109Q93.1Very high91.6Very high1 Ų142.1 Ų42.11%0.00520%0.2CC..Hα-helixtrans-63.7-40.9174.8-76.5176.6-30.400112.5L105 Q106 A112 A113 L179 I183L105-Q109 HydrophobicContact CD1-CG 4.42Å; L105-Q109 WeakPolarHBondContact O-CG 3.37Å; L105-Q109 PolarHBondContact O-N 3.31Å; Q106-Q109 PolarHBondContact O-N 2.74Å; Q109-A112 WeakPolarHBondContact O-CB 3.4Å; Q109-A112 PolarHBondContact O-N 3.02Å; Q109-A113 PolarHBondContact O-N 3.47Å; Q109-L179 HydrophobicContact CB-CD2 3.85Å; Q109-L179 HydrophobicContact CG-CD2 3.89Å; Q109-I183 HydrophobicContact CB-CD1 4.14Å; Q109-I183 HydrophobicContact CB-CG1 3.88Å
110R93.8Very high91.5Very high123 Ų12341.2 Ų41.246%0.46419%0.194SC..Hα-helixtrans-61.4-46.8174.2-74.4179.8-175.11706111.4Q106 K107 A112 A113 D114 I183Q106-R110 WeakPolarHBondContact O-CG 3.42Å; Q106-R110 PolarHBondContact O-N 3.29Å; K107-R110 PolarHBondContact O-N 2.92Å; R110-A112 VanDerWaalsContact C-N 3.29Å; R110-A112 PolarHBondContact O-N 3.28Å; R110-A113 PolarHBondContact O-N 3.38Å; R110-A113 VanDerWaalsContact O-N 3.12Å; R110-D114 VanDerWaalsContact O-CG 3.26Å; R110-D114 PolarHBondContact O-N 2.91Å; R110-I183 HydrophobicContact CG-CD1 3.75Å; R110-I183 HydrophobicContact CG-CG1 4.48Å
111Q92.3Very high91.5Very high87 Ų8742.8 Ų42.841%0.40721%0.207SC..Hα-helixtrans-59.1-40.2175.5-72.7177.2-26.400112.5V38 K107 T108 K115V38-Q111 HydrophobicContact CG1-CB 4.2Å; K107-Q111 WeakPolarHBondContact O-CG 3.32Å; K107-Q111 PolarHBondContact O-N 3.35Å; T108-Q111 PolarHBondContact O-N 2.98Å; Q111-K115 PolarHBondContact O-N 3.28Å; Q111-K115 VanDerWaalsContact O-N 3.08Å
112A91.4Very high91.2Very high0 Ų048 Ų480%023%0.226CC..Hα-helixtrans-61-48.217400000111.1V38 T108 Q109 R110 D114 K115 E116 L179V38-A112 HydrophobicContact CG1-CB 4.4Å; V38-A112 HydrophobicContact CG2-CB 3.61Å; T108-A112 PolarHBondContact O-N 3.42Å; Q109-A112 WeakPolarHBondContact O-CB 3.4Å; Q109-A112 PolarHBondContact O-N 3.02Å; R110-A112 VanDerWaalsContact C-N 3.29Å; R110-A112 PolarHBondContact O-N 3.28Å; A112-D114 VanDerWaalsContact C-N 3.33Å; A112-D114 PolarHBondContact O-N 2.91Å; A112-K115 PolarHBondContact O-N 3.44Å; A112-E116 VanDerWaalsContact O-CG 3.29Å; A112-E116 WeakPolarHBondContact O-CG 3.48Å; A112-E116 PolarHBondContact O-N 2.88Å; A112-L179 HydrophobicContact CB-CD1 3.76Å; A112-L179 HydrophobicContact CB-CD2 4.32Å
113A93.8Very high90.8Very high1 Ų149.7 Ų49.71%0.00824%0.236CC..Hα-helixtrans-62.5-41.1-179.100000111.6Q109 R110 E116 R117 L179Q109-A113 PolarHBondContact O-N 3.47Å; R110-A113 PolarHBondContact O-N 3.38Å; R110-A113 VanDerWaalsContact O-N 3.12Å; A113-E116 PolarHBondContact O-N 3.21Å; A113-R117 WeakPolarHBondContact O-CB 3.44Å; A113-R117 VanDerWaalsContact O-CG 3.31Å; A113-R117 WeakPolarHBondContact O-CG 3.44Å; A113-R117 PolarHBondContact O-N 3.38Å; A113-L179 HydrophobicContact CB-CB 4.15Å; A113-L179 HydrophobicContact CB-CD1 3.99Å
114D92.4Very high90.5Very high90 Ų9051.8 Ų51.848%0.48124%0.24SC..Hα-helixtrans-65.3-42.7178.7-66.6-22000111.7R110 A112 E116 R117 E118R110-D114 VanDerWaalsContact O-CG 3.26Å; R110-D114 PolarHBondContact O-N 2.91Å; A112-D114 VanDerWaalsContact C-N 3.33Å; A112-D114 PolarHBondContact O-N 2.91Å; D114-E116 PolarHBondContact O-N 2.85Å; D114-R117 PolarHBondContact O-N 3.03Å; D114-R117 IonicContact OD1-NH1 3.51Å; D114-R117 PolarHBondContact OD1-NH1 2.62Å; D114-E118 WeakPolarHBondContact O-CB 3.32Å; D114-E118 PolarHBondContact O-N 3.37Å
115K90Very high90Very high64 Ų6452.4 Ų52.428%0.27825%0.248SC..Hα-helixtrans-62.1-42.3174.5-82.1-163.2166.5-158.90112.9V38 F39 L41 Q111 A112 E118 F119V38-K115 HydrophobicContact CG1-CD 4.13Å; V38-K115 WeakPolarHBondContact O-CD 3.36Å; V38-K115 WeakPolarHBondContact O-CE 3.33Å; V38-K115 PolarHBondContact O-NZ 3.43Å; F39-K115 PolarHBondContact O-NZ 2.83Å; L41-K115 HydrophobicContact CB-CD 4.03Å; L41-K115 PolarHBondContact O-NZ 3.31Å; Q111-K115 PolarHBondContact O-N 3.28Å; Q111-K115 VanDerWaalsContact O-N 3.08Å; A112-K115 PolarHBondContact O-N 3.44Å; K115-E118 PolarHBondContact O-N 2.91Å; K115-F119 PolarHBondContact O-N 3.29Å
116E90.9Very high88.9Confident4 Ų454.6 Ų54.62%0.01927%0.27CS..Hα-helixtrans-65.1-42.7176.9-67-70.6-170.800111.4A112 A113 D114 E118 F119 V120 R172 I176A112-E116 VanDerWaalsContact O-CG 3.29Å; A112-E116 WeakPolarHBondContact O-CG 3.48Å; A112-E116 PolarHBondContact O-N 2.88Å; A113-E116 PolarHBondContact O-N 3.21Å; D114-E116 PolarHBondContact O-N 2.85Å; E116-E118 VanDerWaalsContact C-N 3.34Å; E116-E118 PolarHBondContact O-N 3.42Å; E116-F119 PolarHBondContact O-N 3.16Å; E116-V120 WeakPolarHBondContact O-CG2 3.38Å; E116-V120 PolarHBondContact O-N 3.04Å; E116-R172 IonicContact OE1-CZ 2.67Å; E116-R172 IonicContact OE1-NH1 2.7Å; E116-R172 PolarHBondContact OE1-NH1 3.45Å; E116-R172 WeakPolarHBondContact OE2-CD 3.49Å; E116-R172 WeakPolarHBondContact OE2-CG 3.33Å; E116-R172 IonicContact OE2-CZ 3.62Å; E116-R172 IonicContact OE2-NE 3.94Å; E116-R172 PolarHBondContact OE2-NE 3.49Å; E116-R172 IonicContact OE2-NH1 3.61Å; E116-R172 PolarHBondContact OE2-NH1 2.96Å; E116-I176 HydrophobicContact CB-CD1 3.84Å; E116-I176 HydrophobicContact CB-CG1 3.48Å; E116-I176 VanDerWaalsContact CB-CG1 3.48Å; E116-I176 HydrophobicContact CG-CG1 4.47Å
117R92.5Very high87.5Confident94 Ų9455.7 Ų55.736%0.35528%0.279SS..Hα-helixtrans-61.4-43.6175.1-75.9-177.6-165.1111.90.5111.6A113 D114 F119 V120 A121 I176 E180A113-R117 WeakPolarHBondContact O-CB 3.44Å; A113-R117 VanDerWaalsContact O-CG 3.31Å; A113-R117 WeakPolarHBondContact O-CG 3.44Å; A113-R117 PolarHBondContact O-N 3.38Å; D114-R117 PolarHBondContact O-N 3.03Å; D114-R117 IonicContact OD1-NH1 3.51Å; D114-R117 PolarHBondContact OD1-NH1 2.62Å; R117-F119 VanDerWaalsContact C-N 3.35Å; R117-V120 PolarHBondContact O-N 3.03Å; R117-A121 VanDerWaalsContact O-CB 3.31Å; R117-A121 WeakPolarHBondContact O-CB 3.32Å; R117-A121 PolarHBondContact O-N 2.99Å; R117-I176 HydrophobicContact CB-CD1 4.42Å; R117-I176 HydrophobicContact CG-CD1 3.75Å; R117-I176 HydrophobicContact CG-CG1 4.24Å; R117-I176 HydrophobicContact CG-CG2 4.19Å; R117-E180 IonicContact CZ-OE1 3.98Å; R117-E180 IonicContact NE-OE1 2.83Å; R117-E180 IonicContact NH2-OE1 3.19Å; R117-E180 PolarHBondContact NH2-OE1 2.98Å
118E90.2Very high85.8Confident109 Ų10960.2 Ų60.251%0.50929%0.293SS..Hα-helixtrans-62.4-43.7178.1-161.2-164.9152.400111D114 K115 E116 A121 R122D114-E118 WeakPolarHBondContact O-CB 3.32Å; D114-E118 PolarHBondContact O-N 3.37Å; K115-E118 PolarHBondContact O-N 2.91Å; E116-E118 VanDerWaalsContact C-N 3.34Å; E116-E118 PolarHBondContact O-N 3.42Å; E118-A121 PolarHBondContact O-N 2.79Å; E118-R122 WeakPolarHBondContact O-CG 3.35Å; E118-R122 PolarHBondContact O-N 2.9Å; E118-R122 IonicContact OE1-CZ 3.56Å; E118-R122 IonicContact OE1-NH1 2.64Å; E118-R122 PolarHBondContact OE1-NH1 3.48Å; E118-R122 IonicContact OE2-NH1 3.23Å
119F87.3Confident83.9Confident36 Ų3668 Ų6816%0.15833%0.333CS..Hα-helixtrans-57.3-52.4175179.7-87.8000111.5K115 E116 R117 A121 R122 V123 L168 R172K115-F119 PolarHBondContact O-N 3.29Å; E116-F119 PolarHBondContact O-N 3.16Å; R117-F119 VanDerWaalsContact C-N 3.35Å; F119-A121 VanDerWaalsContact C-N 3.3Å; F119-A121 PolarHBondContact O-N 2.89Å; F119-R122 PolarHBondContact O-N 3.33Å; F119-V123 HydrophobicContact CD1-CG2 4.25Å; F119-V123 HydrophobicContact CE1-CG2 3.75Å; F119-V123 HydrophobicContact CE2-CG2 4.39Å; F119-V123 HydrophobicContact CZ-CG2 3.81Å; F119-V123 WeakPolarHBondContact O-CG2 3.45Å; F119-V123 PolarHBondContact O-N 2.98Å; F119-V123 VanDerWaalsContact O-N 3.09Å; F119-L168 HydrophobicContact CE1-CD2 3.9Å; F119-L168 HydrophobicContact CE1-CG 3.93Å; F119-L168 HydrophobicContact CZ-CD2 3.65Å; F119-L168 HydrophobicContact CZ-CG 4.19Å; F119-R172 HydrophobicContact CD1-CG 3.85Å; F119-R172 HydrophobicContact CE1-CG 4.15Å
120V89.8Confident81.9Confident5 Ų570.5 Ų70.53%0.0335%0.351CS..Hα-helixtrans-60.2-41.2179.5170.30000111.5E116 R117 R124 I169 R172 E173 I176E116-V120 WeakPolarHBondContact O-CG2 3.38Å; E116-V120 PolarHBondContact O-N 3.04Å; R117-V120 PolarHBondContact O-N 3.03Å; V120-R124 WeakPolarHBondContact O-CB 3.49Å; V120-R124 WeakPolarHBondContact O-CG 3.4Å; V120-R124 PolarHBondContact O-N 3.41Å; V120-R124 VanDerWaalsContact O-N 3.11Å; V120-I169 HydrophobicContact CG1-CG2 3.99Å; V120-R172 HydrophobicContact CG2-CB 3.51Å; V120-R172 HydrophobicContact CG2-CG 4.23Å; V120-E173 HydrophobicContact CG1-CG 4.33Å; V120-E173 HydrophobicContact CG2-CG 4.4Å; V120-I176 HydrophobicContact CG2-CD1 4.37Å
121A88.7Confident79.6Confident57 Ų5767.3 Ų67.347%0.47136%0.357SS..Hα-helixtrans-63.5-42.7177.500000111.9R117 E118 F119 R124 A125R117-A121 VanDerWaalsContact O-CB 3.31Å; R117-A121 WeakPolarHBondContact O-CB 3.32Å; R117-A121 PolarHBondContact O-N 2.99Å; E118-A121 PolarHBondContact O-N 2.79Å; F119-A121 VanDerWaalsContact C-N 3.3Å; F119-A121 PolarHBondContact O-N 2.89Å; A121-R124 PolarHBondContact O-N 3.17Å; A121-A125 VanDerWaalsContact O-CB 3.26Å; A121-A125 WeakPolarHBondContact O-CB 3.33Å; A121-A125 PolarHBondContact O-N 2.78Å
122R85.7Confident77.3Confident112 Ų11266.6 Ų66.642%0.42337%0.372SS..Hα-helixtrans-62.9-47.6178.1-72.6-169.2-51.1-105.6-0.1112.2E118 F119 R124 A125 G126E118-R122 WeakPolarHBondContact O-CG 3.35Å; E118-R122 PolarHBondContact O-N 2.9Å; E118-R122 IonicContact OE1-CZ 3.56Å; E118-R122 IonicContact OE1-NH1 2.64Å; E118-R122 PolarHBondContact OE1-NH1 3.48Å; E118-R122 IonicContact OE2-NH1 3.23Å; F119-R122 PolarHBondContact O-N 3.33Å; R122-R124 VanDerWaalsContact C-N 3.32Å; R122-R124 PolarHBondContact O-N 2.81Å; R122-A125 PolarHBondContact O-N 3.11Å; R122-G126 PolarHBondContact O-N 3.09Å
123V84.1Confident74.8Confident37 Ų3774.7 Ų74.722%0.22441%0.41CS..Hα-helixtrans-62-41.4179.1-179.70000110.9F119 S127 D165 I169F119-V123 HydrophobicContact CD1-CG2 4.25Å; F119-V123 HydrophobicContact CE1-CG2 3.75Å; F119-V123 HydrophobicContact CE2-CG2 4.39Å; F119-V123 HydrophobicContact CZ-CG2 3.81Å; F119-V123 WeakPolarHBondContact O-CG2 3.45Å; F119-V123 PolarHBondContact O-N 2.98Å; F119-V123 VanDerWaalsContact O-N 3.09Å; V123-S127 PolarHBondContact O-N 2.91Å; V123-D165 HydrophobicContact CG1-CB 4.39Å; V123-I169 HydrophobicContact CB-CD1 4.15Å; V123-I169 HydrophobicContact CB-CG1 4.32Å; V123-I169 HydrophobicContact CG1-CD1 3.56Å; V123-I169 HydrophobicContact CG1-CG1 4.05Å
124R84Confident72.5Confident99 Ų9979.9 Ų79.937%0.37444%0.444SS..Hα-helixtrans-68.5-38176.2-74.1179.9173.1144.4-0.2113.6V120 A121 R122 S127 R128 I169 E173V120-R124 WeakPolarHBondContact O-CB 3.49Å; V120-R124 WeakPolarHBondContact O-CG 3.4Å; V120-R124 PolarHBondContact O-N 3.41Å; V120-R124 VanDerWaalsContact O-N 3.11Å; A121-R124 PolarHBondContact O-N 3.17Å; R122-R124 VanDerWaalsContact C-N 3.32Å; R122-R124 PolarHBondContact O-N 2.81Å; R124-S127 WeakPolarHBondContact O-CB 3.35Å; R124-S127 PolarHBondContact O-N 3.29Å; R124-R128 WeakPolarHBondContact O-CG 3.49Å; R124-R128 PolarHBondContact O-N 3.46Å; R124-R128 VanDerWaalsContact O-N 3.14Å; R124-I169 HydrophobicContact CG-CD1 4.24Å; R124-I169 VanDerWaalsContact NH2-CG2 3.34Å; R124-E173 IonicContact CZ-OE1 2.71Å; R124-E173 IonicContact NH1-OE1 3.84Å; R124-E173 PolarHBondContact NH1-OE1 2.7Å; R124-E173 IonicContact NH2-OE1 3.08Å; R124-E173 PolarHBondContact NH2-OE1 3.33Å; R124-E173 IonicContact NH2-OE2 3.88Å; R124-E173 PolarHBondContact NH2-OE2 3.38Å
125A79.3Confident70Confident50 Ų5081.4 Ų81.441%0.41345%0.452SS..Hα-helixtrans-70.7-39.6179.600000112.3A121 R122 S127 R128 L129A121-A125 VanDerWaalsContact O-CB 3.26Å; A121-A125 WeakPolarHBondContact O-CB 3.33Å; A121-A125 PolarHBondContact O-N 2.78Å; R122-A125 PolarHBondContact O-N 3.11Å; A125-S127 PolarHBondContact O-N 3.33Å; A125-R128 PolarHBondContact O-N 3.31Å; A125-R128 VanDerWaalsContact O-N 3.17Å; A125-L129 PolarHBondContact O-N 3.15Å
126G69.6Low67.8Low46 Ų4684.8 Ų84.847%0.47447%0.473SS..Hα-helixtrans-55.6-37.3173.400000112.2R122R122-G126 PolarHBondContact O-N 3.09Å
127S64.3Low65.4Low34 Ų3489 Ų8924%0.23850%0.502CS..Hα-helixtrans-72.6-41174.9179.50000115V123 R124 A125 L129 S130 G131 I161V123-S127 PolarHBondContact O-N 2.91Å; R124-S127 WeakPolarHBondContact O-CB 3.35Å; R124-S127 PolarHBondContact O-N 3.29Å; A125-S127 PolarHBondContact O-N 3.33Å; S127-L129 VanDerWaalsContact C-N 3.27Å; S127-L129 PolarHBondContact O-N 3.3Å; S127-S130 PolarHBondContact O-N 3.44Å; S127-G131 PolarHBondContact O-N 2.64Å; S127-I161 WeakPolarHBondContact OG-CD1 3.14Å; S127-I161 VanDerWaalsContact OG-CG1 3.25Å; S127-I161 WeakPolarHBondContact OG-CG1 3.42Å
128R58Low63.1Low214 Ų21494 Ų9481%0.80853%0.527SS*.Hα-helixtrans-65.8-28.4-177.5-79.3-176.7166.2-167.4-4113.4R124 A125 S130R124-R128 WeakPolarHBondContact O-CG 3.49Å; R124-R128 PolarHBondContact O-N 3.46Å; R124-R128 VanDerWaalsContact O-N 3.14Å; A125-R128 PolarHBondContact O-N 3.31Å; A125-R128 VanDerWaalsContact O-N 3.17Å; R128-S130 PolarHBondContact O-N 3.28Å
129L51.9Low60.7Low164 Ų16491.7 Ų91.786%0.85953%0.533SS*.THydrogen-bonded Turntrans-73.4-12.3173.7-69.2168.6000112.9A125 S127A125-L129 PolarHBondContact O-N 3.15Å; S127-L129 VanDerWaalsContact C-N 3.27Å; S127-L129 PolarHBondContact O-N 3.3Å
130S49Very low58.7Low55 Ų5598.3 Ų98.339%0.38557%0.57SS.*THydrogen-bonded Turntrans-106.2-27.3178.9-162.80000113.3S127 R128 G132 A158S127-S130 PolarHBondContact O-N 3.44Å; R128-S130 PolarHBondContact O-N 3.28Å; S130-G132 PolarHBondContact O-N 3.42Å; S130-G132 VanDerWaalsContact O-N 3.12Å; S130-A158 WeakPolarHBondContact OG-CB 3.36Å
131G46.5Very low56.3Low56 Ų56102.4 Ų102.458%0.57761%0.605SS**SBendtrans-84.173.8174.700000112.5S127 Q133S127-G131 PolarHBondContact O-N 2.64Å; G131-Q133 PolarHBondContact O-N 2.96Å; G131-Q133 VanDerWaalsContact O-N 3.16Å
132G43.3Very low54.1Low71 Ų71105.4 Ų105.473%0.73262%0.619SS**  trans-48.2122.3167.200000110.4S130 P134S130-G132 PolarHBondContact O-N 3.42Å; S130-G132 VanDerWaalsContact O-N 3.12Å; G132-P134 WeakPolarHBondContact O-CD 3.29Å
133Q38.7Very low52.3Low171 Ų171105.8 Ų105.880%0.79964%0.636SS**  trans-62.5119.1173.9-167.2164.210.100108.8G131 D135G131-Q133 PolarHBondContact O-N 2.96Å; G131-Q133 VanDerWaalsContact O-N 3.16Å; Q133-D135 VanDerWaalsContact C-N 3.29Å; Q133-D135 HydrophobicContact CG-CB 4.46Å; Q133-D135 PolarHBondContact O-N 3.29Å
134P45.9Very low50.4Low109 Ų109115.4 Ų115.471%0.70867%0.669SS**  trans-79.492.1155.229.9-20.6000105.1G132 D136G132-P134 WeakPolarHBondContact O-CD 3.29Å; P134-D136 PolarHBondContact O-N 3.49Å
135D40.7Very low48.3Very low123 Ų123118.3 Ų118.366%0.65869%0.69SS**  trans-72.888161.7-163.926.8000106.4Q133 S137Q133-D135 VanDerWaalsContact C-N 3.29Å; Q133-D135 HydrophobicContact CG-CB 4.46Å; Q133-D135 PolarHBondContact O-N 3.29Å; D135-S137 PolarHBondContact O-N 2.97Å
136D44.3Very low46.7Very low135 Ų135124.2 Ų124.272%0.72271%0.713SS**  trans-65.272.6163.4-89-28.1000108.2P134P134-D136 PolarHBondContact O-N 3.49Å
137S39.1Very low45.5Very low91 Ų91130.4 Ų130.464%0.63673%0.73SS**  trans-97.885.9164.8-140.20000108.1D135 G139D135-S137 PolarHBondContact O-N 2.97Å; S137-G139 VanDerWaalsContact C-N 3.34Å; S137-G139 PolarHBondContact O-N 3.1Å
138F44.3Very low44.6Very low199 Ų199134.4 Ų134.487%0.87376%0.755SS**  trans-60.296162.1-88.2-97.2000108.7
139G41.1Very low43.9Very low61 Ų61135 Ų13563%0.62976%0.757SS**  trans-16365.1-176.200000114S137S137-G139 VanDerWaalsContact C-N 3.34Å; S137-G139 PolarHBondContact O-N 3.1Å
140N44.8Very low43.5Very low175 Ų175132.7 Ų132.794%0.93676%0.755SS**  trans21.795.5152-149.744.8000118.4
141A39.2Very low43.1Very low92 Ų92141 Ų14176%0.7678%0.78SS**  trans-146.9146.6160.600000112.3
142P42.7Very low43Very low120 Ų120143.2 Ų143.278%0.77979%0.786SS**  trans-85.2166-160.930.1-25000114.8
143P47.1Very low43Very low120 Ų120148.8 Ų148.878%0.77979%0.794SS**  trans-79.8132.3-157.430.7-33.3000113.2
144R43.8Very low43.4Very low239 Ų239146.5 Ų146.590%0.90279%0.791SS**  trans-115100.8163.7-73.9-153.8171.6-152.9-0.6111.4
145L40.3Very low43.3Very low159 Ų159149.6 Ų149.683%0.83280%0.796SS**  trans40.5107.2135.7-73.838.9000117.1
146I47Very low43.7Very low174 Ų174148.8 Ų148.889%0.89280%0.8SS**  trans-62.1126174.2-61.1160.2000110.5
147Q44.7Very low43.8Very low176 Ų176151 Ų15182%0.82281%0.806SS**  trans-120.6123.4163.1-167.5157.873.800108.6R149Q147-R149 PolarHBondContact O-N 3.39Å; Q147-R149 VanDerWaalsContact O-N 3.14Å
148P45.4Very low44.2Very low119 Ų119149.6 Ų149.677%0.77380%0.8SS**  trans-81.199.8-176.830.4-29.3000109.1
149R43.1Very low44.7Very low225 Ų225148 Ų14885%0.84980%0.795SS**  trans-88.8117.3163.6-107.4-172.9177.6-174.10.1108.8Q147 Y151Q147-R149 PolarHBondContact O-N 3.39Å; Q147-R149 VanDerWaalsContact O-N 3.14Å; R149-Y151 PolarHBondContact O-N 3.49Å
150S42.5Very low45.7Very low117 Ų117151.5 Ų151.582%0.81880%0.798SS**  trans-45.8118.6176.2-44.30000112S152S150-S152 PolarHBondContact O-N 3.35Å; S150-S152 VanDerWaalsContact O-N 3.15Å
151Y40.7Very low46.7Very low228 Ų228145.2 Ų145.289%0.89476%0.764SS**  trans-7696.2170.5-76.5-90.3000109.3R149 Q153R149-Y151 PolarHBondContact O-N 3.49Å; Y151-Q153 PolarHBondContact O-N 3.02Å
152S44.3Very low48.6Very low103 Ų103143.9 Ų143.972%0.7275%0.747SS**  trans-68.4103.8150.2500000107.4S150 V154S150-S152 PolarHBondContact O-N 3.35Å; S150-S152 VanDerWaalsContact O-N 3.15Å; S152-V154 PolarHBondContact O-N 3.14Å
153Q44Very low50.4Low189 Ų189144.5 Ų144.588%0.88374%0.739SS**  trans-6287167.6-79.8174.1-19.200109.1Y151 Q155Y151-Q153 PolarHBondContact O-N 3.02Å; Q153-Q155 PolarHBondContact O-N 3.47Å
154V47.4Very low51.9Low122 Ų122146.1 Ų146.174%0.73974%0.736SS**  trans-83.1104150.9178.50000104.4S152 S156S152-V154 PolarHBondContact O-N 3.14Å; V154-S156 PolarHBondContact O-N 3.34Å
155Q43.8Very low53.6Low175 Ų175137.1 Ų137.182%0.81871%0.706SS**  trans-6384.5175-170.4169.35.200108.5Q153 Q157Q153-Q155 PolarHBondContact O-N 3.47Å; Q155-Q157 VanDerWaalsContact C-N 3.34Å; Q155-Q157 PolarHBondContact O-N 3.06Å
156S47.5Very low55.7Low105 Ų105133.8 Ų133.873%0.73469%0.688SS**  trans-65.697.1166.250.10000106.9V154 A158V154-S156 PolarHBondContact O-N 3.34Å; S156-A158 VanDerWaalsContact C-N 3.35Å; S156-A158 PolarHBondContact O-N 2.9Å
157Q46.3Very low57.6Low181 Ų181132.9 Ų132.985%0.84667%0.674SS**  trans-54.4105.5162.2-92170.868.100106.7Q155 E159Q155-Q157 VanDerWaalsContact C-N 3.34Å; Q155-Q157 PolarHBondContact O-N 3.06Å; Q157-E159 PolarHBondContact O-N 2.84Å; Q157-E159 VanDerWaalsContact O-N 3.12Å
158A48.2Very low59.5Low62 Ų62126.3 Ų126.351%0.51264%0.644SS.*  trans-66.5105.9173.200000107.4S130 S156 I160S130-A158 WeakPolarHBondContact OG-CB 3.36Å; S156-A158 VanDerWaalsContact C-N 3.35Å; S156-A158 PolarHBondContact O-N 2.9Å; A158-I160 VanDerWaalsContact C-N 3.35Å; A158-I160 PolarHBondContact O-N 3.35Å; A158-I160 VanDerWaalsContact O-N 3.09Å
159E54.6Low61.5Low166 Ų166120.9 Ų120.978%0.77661%0.609SS**  trans-78.689.9172.8-150.7171.9-151.100107.3Q157 I161Q157-E159 PolarHBondContact O-N 2.84Å; Q157-E159 VanDerWaalsContact O-N 3.12Å; E159-I161 PolarHBondContact O-N 3.39Å
160I62.6Low63.7Low135 Ų135116.4 Ų116.469%0.69260%0.597SS**PPolyproline II helixtrans-65.6128.7171.6-60.1171.5000106.7A158 T162A158-I160 VanDerWaalsContact C-N 3.35Å; A158-I160 PolarHBondContact O-N 3.35Å; A158-I160 VanDerWaalsContact O-N 3.09Å; I160-T162 PolarHBondContact O-N 2.9Å
161I66.4Low66Low42 Ų42113.9 Ų113.922%0.21557%0.573CS.*PPolyproline II helixtrans-52.1118.6170.4-66.7179.8000107.6S127 E159 D165 L166S127-I161 WeakPolarHBondContact OG-CD1 3.14Å; S127-I161 VanDerWaalsContact OG-CG1 3.25Å; S127-I161 WeakPolarHBondContact OG-CG1 3.42Å; E159-I161 PolarHBondContact O-N 3.39Å; I161-D165 HydrophobicContact CG2-CB 3.61Å; I161-L166 HydrophobicContact CG2-CD2 3.75Å; I161-L166 HydrophobicContact CG2-CG 3.64Å
162T78.1Confident68.3Low65 Ų65103.2 Ų103.240%0.39953%0.531SS..PPolyproline II helixtrans-76.1161.2178.265.90000110.5I160 E164 D165 L166I160-T162 PolarHBondContact O-N 2.9Å; T162-E164 PolarHBondContact O-N 3.42Å; T162-D165 WeakPolarHBondContact CB-OD2 3.45Å; T162-D165 PolarHBondContact N-OD2 2.91Å; T162-D165 PolarHBondContact O-N 2.95Å; T162-D165 VanDerWaalsContact O-N 3.11Å; T162-D165 PolarHBondContact OG1-N 2.99Å; T162-D165 VanDerWaalsContact OG1-N 3.11Å; T162-D165 PolarHBondContact OG1-OD2 3.38Å; T162-L166 PolarHBondContact O-N 3.44Å; T162-L166 VanDerWaalsContact O-N 3.14Å
163E80.1Confident70.6Confident133 Ų133100.8 Ų100.862%0.62151%0.508SS*.Hα-helixtrans-58.3-29.9172.1-164.6-174.4155.100111.5L166 R167E163-L166 PolarHBondContact O-N 2.85Å; E163-R167 WeakPolarHBondContact O-CG 3.17Å; E163-R167 PolarHBondContact O-N 2.88Å; E163-R167 VanDerWaalsContact O-N 3.14Å; E163-R167 IonicContact OE1-CZ 2.87Å; E163-R167 IonicContact OE1-NE 3.73Å; E163-R167 IonicContact OE1-NH2 3.32Å; E163-R167 PolarHBondContact OE1-NH2 3.2Å
164E79.1Confident72.9Confident153 Ų15395.5 Ų95.572%0.71549%0.492SS*.Hα-helixtrans-66.9-42.2174.9-61.6-174.7167.800111.9T162 L166 R167 L168T162-E164 PolarHBondContact O-N 3.42Å; E164-L166 VanDerWaalsContact C-N 3.34Å; E164-L166 PolarHBondContact O-N 3.07Å; E164-R167 PolarHBondContact O-N 3.14Å; E164-L168 WeakPolarHBondContact O-CB 3.42Å; E164-L168 PolarHBondContact O-N 2.8Å
165D79.6Confident74.9Confident50 Ų5089.9 Ų89.927%0.26746%0.458SS..Hα-helixtrans-63.7-38.9175.7-64.3-44.9000112.2V123 I161 T162 L168 I169V123-D165 HydrophobicContact CG1-CB 4.39Å; I161-D165 HydrophobicContact CG2-CB 3.61Å; T162-D165 WeakPolarHBondContact CB-OD2 3.45Å; T162-D165 PolarHBondContact N-OD2 2.91Å; T162-D165 PolarHBondContact O-N 2.95Å; T162-D165 VanDerWaalsContact O-N 3.11Å; T162-D165 PolarHBondContact OG1-N 2.99Å; T162-D165 VanDerWaalsContact OG1-N 3.11Å; T162-D165 PolarHBondContact OG1-OD2 3.38Å; D165-L168 PolarHBondContact O-N 3.21Å; D165-I169 WeakPolarHBondContact O-CB 3.29Å; D165-I169 VanDerWaalsContact O-CG1 3.29Å; D165-I169 WeakPolarHBondContact O-CG1 3.35Å; D165-I169 PolarHBondContact O-N 2.87Å
166L84.8Confident77.4Confident89 Ų8982.3 Ų82.347%0.46642%0.423SS..Hα-helixtrans-63.6-43.5175.4-72.5176.8000111.8I161 T162 E163 E164 L168 I169 Q170I161-L166 HydrophobicContact CG2-CD2 3.75Å; I161-L166 HydrophobicContact CG2-CG 3.64Å; T162-L166 PolarHBondContact O-N 3.44Å; T162-L166 VanDerWaalsContact O-N 3.14Å; E163-L166 PolarHBondContact O-N 2.85Å; E164-L166 VanDerWaalsContact C-N 3.34Å; E164-L166 PolarHBondContact O-N 3.07Å; L166-L168 VanDerWaalsContact C-N 3.33Å; L166-I169 PolarHBondContact O-N 3.31Å; L166-Q170 WeakPolarHBondContact O-CG 3.5Å; L166-Q170 PolarHBondContact O-N 3.18Å
167R86.1Confident79.7Confident156 Ų15685.4 Ų85.459%0.58942%0.419SS*.Hα-helixtrans-62.5-43176-73.6177.4-177.6178.87.8111.2E163 E164 Q170 E171E163-R167 WeakPolarHBondContact O-CG 3.17Å; E163-R167 PolarHBondContact O-N 2.88Å; E163-R167 VanDerWaalsContact O-N 3.14Å; E163-R167 IonicContact OE1-CZ 2.87Å; E163-R167 IonicContact OE1-NE 3.73Å; E163-R167 IonicContact OE1-NH2 3.32Å; E163-R167 PolarHBondContact OE1-NH2 3.2Å; E164-R167 PolarHBondContact O-N 3.14Å; R167-Q170 PolarHBondContact O-N 2.92Å; R167-E171 PolarHBondContact O-N 3.39Å
168L84.3Confident82Confident38 Ų3880.5 Ų80.520%0.19940%0.396CS..Hα-helixtrans-61.6-45.5176.8176.455.3000111.8F119 E164 D165 L166 Q170 E171 R172F119-L168 HydrophobicContact CE1-CD2 3.9Å; F119-L168 HydrophobicContact CE1-CG 3.93Å; F119-L168 HydrophobicContact CZ-CD2 3.65Å; F119-L168 HydrophobicContact CZ-CG 4.19Å; E164-L168 WeakPolarHBondContact O-CB 3.42Å; E164-L168 PolarHBondContact O-N 2.8Å; D165-L168 PolarHBondContact O-N 3.21Å; L166-L168 VanDerWaalsContact C-N 3.33Å; L168-Q170 VanDerWaalsContact C-N 3.33Å; L168-Q170 PolarHBondContact O-N 3.29Å; L168-E171 PolarHBondContact O-N 3.14Å; L168-R172 HydrophobicContact CD1-CG 4.39Å; L168-R172 WeakPolarHBondContact O-CG 3.42Å; L168-R172 PolarHBondContact O-N 3.45Å
169I88.1Confident84.2Confident5 Ų577.6 Ų77.63%0.02637%0.372CS..Hα-helixtrans-58.3-46.2175-74.2161.9000110.8V120 V123 R124 D165 L166 E171 R172 E173V120-I169 HydrophobicContact CG1-CG2 3.99Å; V123-I169 HydrophobicContact CB-CD1 4.15Å; V123-I169 HydrophobicContact CB-CG1 4.32Å; V123-I169 HydrophobicContact CG1-CD1 3.56Å; V123-I169 HydrophobicContact CG1-CG1 4.05Å; R124-I169 HydrophobicContact CG-CD1 4.24Å; R124-I169 VanDerWaalsContact NH2-CG2 3.34Å; D165-I169 WeakPolarHBondContact O-CB 3.29Å; D165-I169 VanDerWaalsContact O-CG1 3.29Å; D165-I169 WeakPolarHBondContact O-CG1 3.35Å; D165-I169 PolarHBondContact O-N 2.87Å; L166-I169 PolarHBondContact O-N 3.31Å; I169-E171 VanDerWaalsContact C-N 3.33Å; I169-E171 PolarHBondContact O-N 2.97Å; I169-R172 PolarHBondContact O-N 3.19Å; I169-E173 HydrophobicContact CG2-CG 4.37Å; I169-E173 WeakPolarHBondContact O-CG 3.29Å; I169-E173 PolarHBondContact O-N 3.32Å
170Q90Very high86.1Confident131 Ų13173.7 Ų73.761%0.61235%0.353SS*.Hα-helixtrans-60.8-41.9178.6-74175.7-1100112.1L166 R167 L168 E173 S174L166-Q170 WeakPolarHBondContact O-CG 3.5Å; L166-Q170 PolarHBondContact O-N 3.18Å; R167-Q170 PolarHBondContact O-N 2.92Å; L168-Q170 VanDerWaalsContact C-N 3.33Å; L168-Q170 PolarHBondContact O-N 3.29Å; Q170-E173 PolarHBondContact O-N 2.93Å; Q170-S174 PolarHBondContact O-N 3.21Å
171E89.3Confident87.7Confident64 Ų6470 Ų7030%0.29934%0.34SS..Hα-helixtrans-60.1-47175.6-172.6-173.517100111.2R167 L168 I169 S174 A175R167-E171 PolarHBondContact O-N 3.39Å; L168-E171 PolarHBondContact O-N 3.14Å; I169-E171 VanDerWaalsContact C-N 3.33Å; I169-E171 PolarHBondContact O-N 2.97Å; E171-S174 WeakPolarHBondContact O-CB 3.49Å; E171-S174 PolarHBondContact O-N 3.46Å; E171-A175 PolarHBondContact O-N 3.2Å
172R89.1Confident89Confident3 Ų368.1 Ų68.11%0.01133%0.33CS..Hα-helixtrans-64.3-41.3177.8-62.1-36.9-159.2131.512.5112.4D46 R51 E116 F119 V120 L168 I169 S174 A175 I176D46-R172 IonicContact OD1-CZ 3.71Å; D46-R172 IonicContact OD1-NH1 2.7Å; D46-R172 IonicContact OD1-NH2 3.13Å; D46-R172 PolarHBondContact OD1-NH2 3.38Å; D46-R172 VanDerWaalsContact OD1-NH2 3.08Å; D46-R172 IonicContact OD2-CZ 2.71Å; D46-R172 IonicContact OD2-NH1 2.68Å; D46-R172 IonicContact OD2-NH2 3.26Å; D46-R172 PolarHBondContact OD2-NH2 2.85Å; R51-R172 VanDerWaalsContact CD-CZ 3.48Å; R51-R172 VanDerWaalsContact CD-NH1 3.33Å; E116-R172 IonicContact OE1-CZ 2.67Å; E116-R172 IonicContact OE1-NH1 2.7Å; E116-R172 PolarHBondContact OE1-NH1 3.45Å; E116-R172 WeakPolarHBondContact OE2-CD 3.49Å; E116-R172 WeakPolarHBondContact OE2-CG 3.33Å; E116-R172 IonicContact OE2-CZ 3.62Å; E116-R172 IonicContact OE2-NE 3.94Å; E116-R172 PolarHBondContact OE2-NE 3.49Å; E116-R172 IonicContact OE2-NH1 3.61Å; E116-R172 PolarHBondContact OE2-NH1 2.96Å; F119-R172 HydrophobicContact CD1-CG 3.85Å; F119-R172 HydrophobicContact CE1-CG 4.15Å; V120-R172 HydrophobicContact CG2-CB 3.51Å; V120-R172 HydrophobicContact CG2-CG 4.23Å; L168-R172 HydrophobicContact CD1-CG 4.39Å; L168-R172 WeakPolarHBondContact O-CG 3.42Å; L168-R172 PolarHBondContact O-N 3.45Å; I169-R172 PolarHBondContact O-N 3.19Å; R172-S174 VanDerWaalsContact C-N 3.31Å; R172-S174 PolarHBondContact O-N 2.85Å; R172-A175 WeakPolarHBondContact O-CB 3.46Å; R172-A175 PolarHBondContact O-N 3.38Å; R172-A175 VanDerWaalsContact O-N 3.14Å; R172-I176 VanDerWaalsContact O-CG1 3.31Å; R172-I176 WeakPolarHBondContact O-CG1 3.32Å; R172-I176 PolarHBondContact O-N 3.22Å
173E92.4Very high89.8Confident53 Ų5366 Ų6625%0.24832%0.316CS..Hα-helixtrans-63.5-37.7176.4-74.7-166.8145.700112.6V120 R124 I169 Q170 A175 I176 R177V120-E173 HydrophobicContact CG1-CG 4.33Å; V120-E173 HydrophobicContact CG2-CG 4.4Å; R124-E173 IonicContact CZ-OE1 2.71Å; R124-E173 IonicContact NH1-OE1 3.84Å; R124-E173 PolarHBondContact NH1-OE1 2.7Å; R124-E173 IonicContact NH2-OE1 3.08Å; R124-E173 PolarHBondContact NH2-OE1 3.33Å; R124-E173 IonicContact NH2-OE2 3.88Å; R124-E173 PolarHBondContact NH2-OE2 3.38Å; I169-E173 HydrophobicContact CG2-CG 4.37Å; I169-E173 WeakPolarHBondContact O-CG 3.29Å; I169-E173 PolarHBondContact O-N 3.32Å; Q170-E173 PolarHBondContact O-N 2.93Å; E173-A175 VanDerWaalsContact C-N 3.33Å; E173-I176 PolarHBondContact O-N 3.1Å; E173-R177 WeakPolarHBondContact O-CG 3.49Å; E173-R177 PolarHBondContact O-N 2.87Å
174S93Very high90.5Very high77 Ų7763.3 Ų63.354%0.53831%0.309SS..Hα-helixtrans-62.3-42.1172.1-170.30000111.4Q170 E171 R172 R177 Q178Q170-S174 PolarHBondContact O-N 3.21Å; E171-S174 WeakPolarHBondContact O-CB 3.49Å; E171-S174 PolarHBondContact O-N 3.46Å; R172-S174 VanDerWaalsContact C-N 3.31Å; R172-S174 PolarHBondContact O-N 2.85Å; S174-R177 PolarHBondContact O-N 3.43Å; S174-Q178 PolarHBondContact O-N 3.37Å
175A90Very high91.2Very high5 Ų557.9 Ų57.94%0.04129%0.285CS..Hα-helixtrans-63.4-41176.600000112.1E171 R172 E173 Q178 L179E171-A175 PolarHBondContact O-N 3.2Å; R172-A175 WeakPolarHBondContact O-CB 3.46Å; R172-A175 PolarHBondContact O-N 3.38Å; R172-A175 VanDerWaalsContact O-N 3.14Å; E173-A175 VanDerWaalsContact C-N 3.33Å; A175-Q178 PolarHBondContact O-N 2.98Å; A175-L179 WeakPolarHBondContact O-CB 3.41Å; A175-L179 WeakPolarHBondContact O-CG 3.31Å; A175-L179 PolarHBondContact O-N 3.08Å
176I94.9Very high91.9Very high15 Ų1555.5 Ų55.58%0.07727%0.272CS..Hα-helixtrans-60.1-47.1175.4-67.6160.1000110.8E116 R117 V120 R172 E173 Q178 L179 E180E116-I176 HydrophobicContact CB-CD1 3.84Å; E116-I176 HydrophobicContact CB-CG1 3.48Å; E116-I176 VanDerWaalsContact CB-CG1 3.48Å; E116-I176 HydrophobicContact CG-CG1 4.47Å; R117-I176 HydrophobicContact CB-CD1 4.42Å; R117-I176 HydrophobicContact CG-CD1 3.75Å; R117-I176 HydrophobicContact CG-CG1 4.24Å; R117-I176 HydrophobicContact CG-CG2 4.19Å; V120-I176 HydrophobicContact CG2-CD1 4.37Å; R172-I176 VanDerWaalsContact O-CG1 3.31Å; R172-I176 WeakPolarHBondContact O-CG1 3.32Å; R172-I176 PolarHBondContact O-N 3.22Å; E173-I176 PolarHBondContact O-N 3.1Å; I176-Q178 VanDerWaalsContact C-N 3.31Å; I176-Q178 PolarHBondContact O-N 3.31Å; I176-L179 WeakPolarHBondContact O-CB 3.35Å; I176-L179 PolarHBondContact O-N 3.28Å; I176-E180 HydrophobicContact CG2-CG 4.44Å; I176-E180 WeakPolarHBondContact O-CG 3.48Å; I176-E180 PolarHBondContact O-N 3.25Å
177R96.3Very high92.2Very high171 Ų17154 Ų5465%0.64526%0.264SS*.Hα-helixtrans-61.7-40.1178.6-69.6175.1-168.6-178.35.6112E173 S174 E180 S181E173-R177 WeakPolarHBondContact O-CG 3.49Å; E173-R177 PolarHBondContact O-N 2.87Å; S174-R177 PolarHBondContact O-N 3.43Å; R177-E180 PolarHBondContact O-N 3.02Å; R177-S181 PolarHBondContact O-N 2.9Å
178Q94.6Very high92.6Very high78 Ų7849.8 Ų49.836%0.36425%0.253SS..Hα-helixtrans-63-45.1175.5-174.961.147.400111.2S174 A175 I176 E180 S181 D182S174-Q178 PolarHBondContact O-N 3.37Å; A175-Q178 PolarHBondContact O-N 2.98Å; I176-Q178 VanDerWaalsContact C-N 3.31Å; I176-Q178 PolarHBondContact O-N 3.31Å; Q178-E180 VanDerWaalsContact C-N 3.34Å; Q178-E180 PolarHBondContact O-N 3.36Å; Q178-S181 WeakPolarHBondContact O-CB 3.48Å; Q178-S181 PolarHBondContact O-N 2.79Å; Q178-D182 PolarHBondContact NE2-OD1 3.42Å; Q178-D182 VanDerWaalsContact O-CG 3.27Å; Q178-D182 PolarHBondContact O-N 2.96Å
179L94.4Very high93Very high1 Ų148.2 Ų48.21%0.00525%0.245CC..Hα-helixtrans-59.8-42.2176.3-83.3169000112.6Q58 Q109 A112 A113 A175 I176 S181 D182 I183Q58-L179 VanDerWaalsContact CD-CD2 3.41Å; Q58-L179 HydrophobicContact CG-CD2 4.19Å; Q109-L179 HydrophobicContact CB-CD2 3.85Å; Q109-L179 HydrophobicContact CG-CD2 3.89Å; A112-L179 HydrophobicContact CB-CD1 3.76Å; A112-L179 HydrophobicContact CB-CD2 4.32Å; A113-L179 HydrophobicContact CB-CB 4.15Å; A113-L179 HydrophobicContact CB-CD1 3.99Å; A175-L179 WeakPolarHBondContact O-CB 3.41Å; A175-L179 WeakPolarHBondContact O-CG 3.31Å; A175-L179 PolarHBondContact O-N 3.08Å; I176-L179 WeakPolarHBondContact O-CB 3.35Å; I176-L179 PolarHBondContact O-N 3.28Å; L179-S181 VanDerWaalsContact C-N 3.35Å; L179-D182 PolarHBondContact O-N 2.89Å; L179-I183 WeakPolarHBondContact O-CB 3.4Å; L179-I183 WeakPolarHBondContact O-CD1 3.39Å; L179-I183 WeakPolarHBondContact O-CG1 3.35Å; L179-I183 PolarHBondContact O-N 3.09Å
180E95Very high93.2Very high83 Ų8350 Ų5039%0.38825%0.253SS..Hα-helixtrans-63-40.9175.7-72.1172169.300112.1R117 I176 R177 Q178 I183 T184R117-E180 IonicContact CZ-OE1 3.98Å; R117-E180 IonicContact NE-OE1 2.83Å; R117-E180 IonicContact NH2-OE1 3.19Å; R117-E180 PolarHBondContact NH2-OE1 2.98Å; I176-E180 HydrophobicContact CG2-CG 4.44Å; I176-E180 WeakPolarHBondContact O-CG 3.48Å; I176-E180 PolarHBondContact O-N 3.25Å; R177-E180 PolarHBondContact O-N 3.02Å; Q178-E180 VanDerWaalsContact C-N 3.34Å; Q178-E180 PolarHBondContact O-N 3.36Å; E180-I183 PolarHBondContact O-N 3.35Å; E180-T184 PolarHBondContact O-N 2.92Å; E180-T184 PolarHBondContact O-OG1 2.96Å
181S96.1Very high93.2Very high58 Ų5850 Ų5041%0.40625%0.251SS..Hα-helixtrans-62.4-47.9173.4-171.70000111.3R177 Q178 L179 I183 T184 D185R177-S181 PolarHBondContact O-N 2.9Å; Q178-S181 WeakPolarHBondContact O-CB 3.48Å; Q178-S181 PolarHBondContact O-N 2.79Å; L179-S181 VanDerWaalsContact C-N 3.35Å; S181-I183 VanDerWaalsContact C-N 3.32Å; S181-I183 PolarHBondContact O-N 2.9Å; S181-T184 WeakPolarHBondContact O-CB 3.32Å; S181-T184 PolarHBondContact O-N 3.25Å; S181-T184 VanDerWaalsContact O-N 3.1Å; S181-D185 PolarHBondContact O-N 3.08Å
182D93.6Very high93.2Very high2 Ų248.6 Ų48.61%0.01125%0.246CC..Hα-helixtrans-63.1-38.8-179.8-66-17.3000111.6N62 Q178 L179 T184 D185 I186N62-D182 HydrophobicContact CB-CB 4.43Å; N62-D182 PolarHBondContact ND2-OD1 3.44Å; Q178-D182 PolarHBondContact NE2-OD1 3.42Å; Q178-D182 VanDerWaalsContact O-CG 3.27Å; Q178-D182 PolarHBondContact O-N 2.96Å; L179-D182 PolarHBondContact O-N 2.89Å; D182-T184 VanDerWaalsContact C-N 3.29Å; D182-T184 PolarHBondContact O-N 3.44Å; D182-D185 WeakPolarHBondContact O-CB 3.43Å; D182-D185 PolarHBondContact O-N 3.27Å; D182-I186 WeakPolarHBondContact O-CG1 3.21Å; D182-I186 PolarHBondContact O-N 3.16Å
183I94.1Very high93.2Very high20 Ų2048.9 Ų48.910%0.10325%0.247CC..Hα-helixtrans-64.3-36.9175.2-71.8163000110.9Q106 Q109 R110 L179 E180 S181 I186 N187Q106-I183 HydrophobicContact CG-CG2 4.29Å; Q109-I183 HydrophobicContact CB-CD1 4.14Å; Q109-I183 HydrophobicContact CB-CG1 3.88Å; R110-I183 HydrophobicContact CG-CD1 3.75Å; R110-I183 HydrophobicContact CG-CG1 4.48Å; L179-I183 WeakPolarHBondContact O-CB 3.4Å; L179-I183 WeakPolarHBondContact O-CD1 3.39Å; L179-I183 WeakPolarHBondContact O-CG1 3.35Å; L179-I183 PolarHBondContact O-N 3.09Å; E180-I183 PolarHBondContact O-N 3.35Å; S181-I183 VanDerWaalsContact C-N 3.32Å; S181-I183 PolarHBondContact O-N 2.9Å; I183-I186 PolarHBondContact O-N 2.9Å; I183-N187 PolarHBondContact O-N 3.06Å; I183-N187 PolarHBondContact O-ND2 3.02Å; I183-N187 VanDerWaalsContact O-ND2 3.08Å
184T94.9Very high92.8Very high77 Ų7748.3 Ų48.347%0.47226%0.255SS..Hα-helixtrans-65.7-45176.6-57.30000110.7E180 S181 D182 I186 N187 D188E180-T184 PolarHBondContact O-N 2.92Å; E180-T184 PolarHBondContact O-OG1 2.96Å; S181-T184 WeakPolarHBondContact O-CB 3.32Å; S181-T184 PolarHBondContact O-N 3.25Å; S181-T184 VanDerWaalsContact O-N 3.1Å; D182-T184 VanDerWaalsContact C-N 3.29Å; D182-T184 PolarHBondContact O-N 3.44Å; T184-I186 VanDerWaalsContact C-N 3.31Å; T184-I186 PolarHBondContact O-N 3.46Å; T184-N187 WeakPolarHBondContact O-CB 3.19Å; T184-N187 PolarHBondContact O-N 2.86Å; T184-N187 VanDerWaalsContact O-N 3.1Å; T184-D188 PolarHBondContact O-N 3.29Å
185D94.7Very high92.4Very high39 Ų3950.4 Ų50.421%0.20926%0.258CS..Hα-helixtrans-56.5-45.2174.1-70.1-44.2000111.7N62 K66 S181 D182 N187 D188 I189N62-D185 PolarHBondContact ND2-OD2 2.92Å; K66-D185 WeakPolarHBondContact CE-OD2 3.43Å; K66-D185 IonicContact NZ-OD1 2.74Å; K66-D185 PolarHBondContact NZ-OD1 2.89Å; K66-D185 VanDerWaalsContact NZ-OD1 3.17Å; K66-D185 IonicContact NZ-OD2 2.7Å; K66-D185 PolarHBondContact NZ-OD2 2.9Å; S181-D185 PolarHBondContact O-N 3.08Å; D182-D185 WeakPolarHBondContact O-CB 3.43Å; D182-D185 PolarHBondContact O-N 3.27Å; D185-N187 VanDerWaalsContact C-N 3.33Å; D185-N187 PolarHBondContact O-N 3.4Å; D185-D188 PolarHBondContact O-N 2.71Å; D185-I189 WeakPolarHBondContact O-CG1 3.19Å; D185-I189 PolarHBondContact O-N 2.88Å; D185-I189 VanDerWaalsContact O-N 3.08Å
186I93.9Very high92Very high0 Ų051 Ų510%026%0.26CS..Hα-helixtrans-63.8-38.6177.3-67.4178.5000111.5L102 L105 Q106 D182 I183 T184 D188 I189 F190L102-I186 HydrophobicContact CB-CG2 4.27Å; L102-I186 HydrophobicContact CD2-CG2 4.3Å; L105-I186 HydrophobicContact CB-CD1 4.44Å; L105-I186 HydrophobicContact CD2-CD1 3.72Å; L105-I186 HydrophobicContact CG-CD1 3.86Å; Q106-I186 HydrophobicContact CB-CD1 4.37Å; Q106-I186 HydrophobicContact CB-CG2 4.11Å; Q106-I186 HydrophobicContact CG-CG2 4.32Å; D182-I186 WeakPolarHBondContact O-CG1 3.21Å; D182-I186 PolarHBondContact O-N 3.16Å; I183-I186 PolarHBondContact O-N 2.9Å; T184-I186 VanDerWaalsContact C-N 3.31Å; T184-I186 PolarHBondContact O-N 3.46Å; I186-D188 VanDerWaalsContact C-N 3.28Å; I186-D188 PolarHBondContact O-N 2.94Å; I186-I189 PolarHBondContact O-N 2.91Å; I186-F190 HydrophobicContact CG2-CD2 3.71Å; I186-F190 HydrophobicContact CG2-CE2 3.53Å; I186-F190 VanDerWaalsContact O-CD2 3.31Å; I186-F190 WeakPolarHBondContact O-CD2 3.41Å; I186-F190 PolarHBondContact O-N 3.08Å
187N91Very high90.9Very high57 Ų5752 Ų5231%0.30527%0.267SS..Hα-helixtrans-62.4-36.7175.6-74-42.7000112.1Q106 I183 T184 D185 F190 K191Q106-N187 PolarHBondContact NE2-OD1 3Å; I183-N187 PolarHBondContact O-N 3.06Å; I183-N187 PolarHBondContact O-ND2 3.02Å; I183-N187 VanDerWaalsContact O-ND2 3.08Å; T184-N187 WeakPolarHBondContact O-CB 3.19Å; T184-N187 PolarHBondContact O-N 2.86Å; T184-N187 VanDerWaalsContact O-N 3.1Å; D185-N187 VanDerWaalsContact C-N 3.33Å; D185-N187 PolarHBondContact O-N 3.4Å; N187-F190 PolarHBondContact O-N 2.97Å; N187-K191 WeakPolarHBondContact O-CG 3.4Å; N187-K191 PolarHBondContact O-N 3.49Å; N187-K191 VanDerWaalsContact O-N 3.15Å
188D93.9Very high89Confident68 Ų6852 Ų5236%0.36427%0.274SS..Hα-helixtrans-67.6-40.8176-70.6-23.5000111.3T184 D185 I186 F190 K191 D192T184-D188 PolarHBondContact O-N 3.29Å; D185-D188 PolarHBondContact O-N 2.71Å; I186-D188 VanDerWaalsContact C-N 3.28Å; I186-D188 PolarHBondContact O-N 2.94Å; D188-F190 VanDerWaalsContact C-N 3.3Å; D188-F190 PolarHBondContact O-N 3.04Å; D188-K191 WeakPolarHBondContact O-CB 3.38Å; D188-K191 PolarHBondContact O-N 3.47Å; D188-K191 VanDerWaalsContact O-N 3.1Å; D188-K191 IonicContact OD1-NZ 2.94Å; D188-K191 PolarHBondContact OD1-NZ 3.09Å; D188-D192 PolarHBondContact O-N 3.44Å; D188-D192 VanDerWaalsContact O-N 3.09Å
189I94.5Very high86.9Confident6 Ų655.9 Ų55.93%0.03129%0.292CS..Hα-helixtrans-61.2-38.9172.3-61.6166.8000111.1A65 K66 D69 F98 L102 D185 I186 K191 D192 L193A65-I189 HydrophobicContact CB-CD1 3.8Å; K66-I189 HydrophobicContact CG-CD1 4.24Å; D69-I189 HydrophobicContact CB-CD1 4.37Å; D69-I189 HydrophobicContact CB-CG1 4.05Å; D69-I189 HydrophobicContact CB-CG2 3.85Å; F98-I189 HydrophobicContact CE1-CG2 3.75Å; F98-I189 HydrophobicContact CZ-CG2 3.85Å; L102-I189 HydrophobicContact CD1-CB 4.29Å; L102-I189 HydrophobicContact CD1-CG2 3.55Å; D185-I189 WeakPolarHBondContact O-CG1 3.19Å; D185-I189 PolarHBondContact O-N 2.88Å; D185-I189 VanDerWaalsContact O-N 3.08Å; I186-I189 PolarHBondContact O-N 2.91Å; I189-K191 VanDerWaalsContact C-N 3.29Å; I189-K191 PolarHBondContact O-N 3.33Å; I189-D192 WeakPolarHBondContact O-CB 3.22Å; I189-D192 PolarHBondContact O-N 2.82Å; I189-D192 VanDerWaalsContact O-N 3.13Å; I189-L193 HydrophobicContact CG2-CD1 4.38Å; I189-L193 HydrophobicContact CG2-CG 4.37Å; I189-L193 WeakPolarHBondContact O-CG 3.42Å; I189-L193 PolarHBondContact O-N 2.92Å
190F91.8Very high84.3Confident43 Ų4357.9 Ų57.919%0.18930%0.301CS..Hα-helixtrans-61.9-35.9175-87.4-61000113.1L102 N103 I186 N187 D188 D192 L193 G194L102-F190 HydrophobicContact CB-CE1 4.12Å; L102-F190 HydrophobicContact CB-CE2 3.93Å; L102-F190 HydrophobicContact CB-CZ 3.52Å; L102-F190 HydrophobicContact CD1-CE1 4.48Å; L102-F190 HydrophobicContact CD1-CZ 4.49Å; N103-F190 HydrophobicContact CB-CZ 4.32Å; N103-F190 WeakPolarHBondContact OD1-CZ 3.4Å; I186-F190 HydrophobicContact CG2-CD2 3.71Å; I186-F190 HydrophobicContact CG2-CE2 3.53Å; I186-F190 VanDerWaalsContact O-CD2 3.31Å; I186-F190 WeakPolarHBondContact O-CD2 3.41Å; I186-F190 PolarHBondContact O-N 3.08Å; N187-F190 PolarHBondContact O-N 2.97Å; D188-F190 VanDerWaalsContact C-N 3.3Å; D188-F190 PolarHBondContact O-N 3.04Å; F190-D192 VanDerWaalsContact C-N 3.33Å; F190-L193 HydrophobicContact CD1-CD1 4.28Å; F190-L193 PolarHBondContact O-N 3.48Å; F190-G194 PolarHBondContact O-N 3.47Å
191K89.8Confident81.8Confident129 Ų12957.7 Ų57.756%0.56132%0.322SS*.Hα-helixtrans-64.3-42.3173.3-63.9167.8-167.5158.60110.5N187 D188 I189 G194 M195N187-K191 WeakPolarHBondContact O-CG 3.4Å; N187-K191 PolarHBondContact O-N 3.49Å; N187-K191 VanDerWaalsContact O-N 3.15Å; D188-K191 WeakPolarHBondContact O-CB 3.38Å; D188-K191 PolarHBondContact O-N 3.47Å; D188-K191 VanDerWaalsContact O-N 3.1Å; D188-K191 IonicContact OD1-NZ 2.94Å; D188-K191 PolarHBondContact OD1-NZ 3.09Å; I189-K191 VanDerWaalsContact C-N 3.29Å; I189-K191 PolarHBondContact O-N 3.33Å; K191-G194 PolarHBondContact O-N 2.73Å; K191-M195 WeakPolarHBondContact O-CG 3.24Å; K191-M195 PolarHBondContact O-N 3.3Å
192D89.3Confident79.6Confident36 Ų3662.3 Ų62.319%0.19334%0.342CS..Hα-helixtrans-61.5-43.3176-67.9-39.9000112.2K73 D188 I189 F190 M195 M196K73-D192 VanDerWaalsContact CE-CG 3.42Å; K73-D192 WeakPolarHBondContact CE-OD2 3.29Å; K73-D192 IonicContact NZ-OD1 3.59Å; K73-D192 IonicContact NZ-OD2 2.72Å; K73-D192 PolarHBondContact NZ-OD2 3.11Å; D188-D192 PolarHBondContact O-N 3.44Å; D188-D192 VanDerWaalsContact O-N 3.09Å; I189-D192 WeakPolarHBondContact O-CB 3.22Å; I189-D192 PolarHBondContact O-N 2.82Å; I189-D192 VanDerWaalsContact O-N 3.13Å; F190-D192 VanDerWaalsContact C-N 3.33Å; D192-M195 HydrophobicContact CB-CE 4.44Å; D192-M195 PolarHBondContact O-N 3.23Å; D192-M195 WeakPolarHBondContact OD1-CE 3.48Å; D192-M196 HydrophobicContact CB-CE 4.22Å; D192-M196 WeakPolarHBondContact O-CE 3.45Å; D192-M196 WeakPolarHBondContact O-CG 3.4Å; D192-M196 PolarHBondContact O-N 3.08Å
193L89Confident77.2Confident9 Ų965.3 Ų65.35%0.04736%0.357CS..Hα-helixtrans-62.2-42.3173-64.7176.1000112L95 F98 L102 I189 F190 M195 M196 V197L95-L193 HydrophobicContact CD2-CD2 3.49Å; L95-L193 VanDerWaalsContact CD2-CD2 3.49Å; F98-L193 HydrophobicContact CD1-CD1 3.87Å; F98-L193 HydrophobicContact CD1-CD2 3.58Å; F98-L193 HydrophobicContact CD1-CG 4.28Å; F98-L193 HydrophobicContact CE1-CD1 4.16Å; F98-L193 HydrophobicContact CE1-CD2 3.97Å; F98-L193 HydrophobicContact CE1-CG 4.42Å; L102-L193 HydrophobicContact CD1-CD1 3.68Å; I189-L193 HydrophobicContact CG2-CD1 4.38Å; I189-L193 HydrophobicContact CG2-CG 4.37Å; I189-L193 WeakPolarHBondContact O-CG 3.42Å; I189-L193 PolarHBondContact O-N 2.92Å; F190-L193 HydrophobicContact CD1-CD1 4.28Å; F190-L193 PolarHBondContact O-N 3.48Å; L193-M195 VanDerWaalsContact C-N 3.3Å; L193-M195 PolarHBondContact O-N 3Å; L193-M196 HydrophobicContact CD2-CE 3.7Å; L193-M196 HydrophobicContact CG-CE 4.43Å; L193-M196 PolarHBondContact O-N 3.23Å; L193-M196 VanDerWaalsContact O-N 3.1Å; L193-V197 VanDerWaalsContact O-CG2 3.32Å; L193-V197 WeakPolarHBondContact O-CG2 3.31Å; L193-V197 PolarHBondContact O-N 2.83Å
194G83.4Confident74.7Confident40 Ų4071.8 Ų71.841%0.41239%0.39SS..Hα-helixtrans-56.6-4417500000112.3F190 K191 M196 V197 H198F190-G194 PolarHBondContact O-N 3.47Å; K191-G194 PolarHBondContact O-N 2.73Å; G194-M196 PolarHBondContact O-N 3.41Å; G194-V197 PolarHBondContact O-N 3.4Å; G194-H198 WeakPolarHBondContact O-CB 3.45Å; G194-H198 PolarHBondContact O-N 3.12Å
195M84.3Confident72.4Confident122 Ų12275.4 Ų75.460%0.60141%0.407SS*.Hα-helixtrans-63.9-39.4174.9-67.1-172-66.900112.3K191 D192 L193 V197K191-M195 WeakPolarHBondContact O-CG 3.24Å; K191-M195 PolarHBondContact O-N 3.3Å; D192-M195 HydrophobicContact CB-CE 4.44Å; D192-M195 PolarHBondContact O-N 3.23Å; D192-M195 WeakPolarHBondContact OD1-CE 3.48Å; L193-M195 VanDerWaalsContact C-N 3.3Å; L193-M195 PolarHBondContact O-N 3Å; M195-V197 VanDerWaalsContact C-N 3.29Å; M195-V197 PolarHBondContact O-N 3.14Å
196M82.9Confident70.1Confident16 Ų1675.3 Ų75.38%0.07941%0.409CS..Hα-helixtrans-67.6-27.5177.3-71.4-176.2-10200113.5M72 K73 T76 K91 L95 D192 L193 G194M72-M196 HydrophobicContact CB-CE 4.16Å; M72-M196 HydrophobicContact CB-SD 4.06Å; M72-M196 HydrophobicContact CE-SD 4.28Å; K73-M196 HydrophobicContact CG-CE 4.33Å; T76-M196 HydrophobicContact CG2-CG 4.23Å; T76-M196 HydrophobicContact CG2-SD 3.8Å; K91-M196 WeakPolarHBondContact CE-O 3.42Å; K91-M196 PolarHBondContact NZ-O 3.13Å; L95-M196 HydrophobicContact CD1-CB 4.26Å; L95-M196 HydrophobicContact CD2-CB 3.89Å; L95-M196 HydrophobicContact CD2-SD 4.09Å; D192-M196 HydrophobicContact CB-CE 4.22Å; D192-M196 WeakPolarHBondContact O-CE 3.45Å; D192-M196 WeakPolarHBondContact O-CG 3.4Å; D192-M196 PolarHBondContact O-N 3.08Å; L193-M196 HydrophobicContact CD2-CE 3.7Å; L193-M196 HydrophobicContact CG-CE 4.43Å; L193-M196 PolarHBondContact O-N 3.23Å; L193-M196 VanDerWaalsContact O-N 3.1Å; G194-M196 PolarHBondContact O-N 3.41Å
197V71Confident67.9Low37 Ų3780.8 Ų80.822%0.22444%0.437CS..Hα-helixtrans-84.6-35.7178174.30000111.8L95 L193 G194 M195 E199 Q200L95-V197 HydrophobicContact CD1-CG2 3.94Å; L193-V197 VanDerWaalsContact O-CG2 3.32Å; L193-V197 WeakPolarHBondContact O-CG2 3.31Å; L193-V197 PolarHBondContact O-N 2.83Å; G194-V197 PolarHBondContact O-N 3.4Å; M195-V197 VanDerWaalsContact C-N 3.29Å; M195-V197 PolarHBondContact O-N 3.14Å; V197-E199 PolarHBondContact O-N 3.16Å; V197-Q200 PolarHBondContact O-N 3.31Å
198H55.9Low65.4Low172 Ų17287 Ų8780%0.79646%0.464SS*.THydrogen-bonded Turntrans-64.1-9.2-174-156.362.5000114.9G194 Q200G194-H198 WeakPolarHBondContact O-CB 3.45Å; G194-H198 PolarHBondContact O-N 3.12Å; H198-Q200 VanDerWaalsContact C-N 3.28Å
199E51.1Low63Low159 Ų15986.9 Ų86.974%0.74347%0.472SS*.THydrogen-bonded Turntrans-80.6-1.6169.7-67.8-176.6144.500114.2K91 V197K91-E199 IonicContact NZ-OE2 3.45Å; V197-E199 PolarHBondContact O-N 3.16Å
200Q39.9Very low60.9Low42 Ų4289.4 Ų89.420%0.19649%0.486CS..SBendtrans-133.3106.1178.9-63.1-173.166.300109.1D92 V197 H198 D202D92-Q200 PolarHBondContact OD1-NE2 2.95Å; D92-Q200 PolarHBondContact OD1-OE1 3.38Å; D92-Q200 PolarHBondContact OD2-OE1 3.45Å; V197-Q200 PolarHBondContact O-N 3.31Å; H198-Q200 VanDerWaalsContact C-N 3.28Å; Q200-D202 PolarHBondContact O-N 3.34Å
201G43.4Very low58.7Low80 Ų8092.3 Ų92.383%0.82551%0.507SS*.SBendtrans-69.438.2-173.200000117
202D48.2Very low56.3Low154 Ų15494.4 Ų94.482%0.82452%0.519SS*.  trans-166.298.9165.3-89.5-34000110.2Q200Q200-D202 PolarHBondContact O-N 3.34Å
203M43.3Very low54.1Low65 Ų6595 Ų9532%0.3253%0.526SS..  trans-172.862.1149.5-101.4-152.2-55.900108.9D92 N96D92-M203 HydrophobicContact CB-CE 4.02Å; N96-M203 WeakPolarHBondContact ND2-CE 3.49Å; N96-M203 PolarHBondContact ND2-SD 3.23Å; N96-M203 WeakPolarHBondContact OD1-CE 3.38Å; N96-M203 PolarHBondContact OD1-SD 3.42Å
204I43.4Very low51.9Low156 Ų15696.3 Ų96.380%0.854%0.538SS*.  trans-114.668.6164.5-55.7177.1000105.5
205D45.3Very low49.9Very low154 Ų154101 Ų10182%0.82455%0.554SS**SBendtrans-1581.3170.5-111-10.9000114.3
206S46.5Very low47.9Very low36 Ų3699.7 Ų99.725%0.25255%0.553SS.*SBendtrans-106.41-173.945.20000114.8N210S206-N210 WeakPolarHBondContact O-CB 3.41Å; S206-N210 PolarHBondContact O-N 3.43Å
207I47.7Very low46.1Very low116 Ų116104.9 Ų104.960%0.59558%0.577SS**THydrogen-bonded Turntrans-75.5-34176.9-61.3177.5000111.1
208E39.4Very low45.2Very low187 Ų187104.5 Ų104.587%0.87457%0.574SS**THydrogen-bonded Turntrans-82.4-29.2177.9-106169.8168.900113.3
209A43.6Very low44.6Very low65 Ų65103.4 Ų103.454%0.53757%0.57SS.*THydrogen-bonded Turntrans-84.1-23.1-177.200000114.7V211A209-V211 VanDerWaalsContact C-N 3.35Å; A209-V211 PolarHBondContact O-N 2.96Å
210N49.2Very low44.3Very low59 Ų5997.9 Ų97.932%0.31655%0.549SS..THydrogen-bonded Turntrans-82.9-5.4-174.1-109.117.6000115.2A100 S206 E212 S213 A214A100-N210 HydrophobicContact CB-CB 4.49Å; S206-N210 WeakPolarHBondContact O-CB 3.41Å; S206-N210 PolarHBondContact O-N 3.43Å; N210-E212 VanDerWaalsContact C-N 3.26Å; N210-E212 PolarHBondContact O-N 3.45Å; N210-S213 PolarHBondContact O-N 3.38Å; N210-A214 PolarHBondContact O-N 3.42Å
211V46.1Very low44.7Very low104 Ų10496.7 Ų96.763%0.6355%0.547SS*.THydrogen-bonded Turntrans-68-27.9176.8172.20000111.7A209A209-V211 VanDerWaalsContact C-N 3.35Å; A209-V211 PolarHBondContact O-N 2.96Å
212E38.7Very low45.1Very low173 Ų17398.1 Ų98.181%0.80853%0.532SS*.THydrogen-bonded Turntrans-88.8-21-179.6-164.3159.4-167.400113.2N210N210-E212 VanDerWaalsContact C-N 3.26Å; N210-E212 PolarHBondContact O-N 3.45Å
213S42.9Very low45.2Very low48 Ų4896.3 Ų96.334%0.33652%0.519SS..THydrogen-bonded Turntrans-92.1-16.5-179.3-660000114.4N210 D215 T216 H217N210-S213 PolarHBondContact O-N 3.38Å; S213-D215 VanDerWaalsContact C-N 3.3Å; S213-D215 PolarHBondContact O-N 3.32Å; S213-T216 PolarHBondContact O-N 3.24Å; S213-T216 PolarHBondContact O-OG1 3.49Å; S213-T216 VanDerWaalsContact O-OG1 3.07Å; S213-H217 PolarHBondContact O-N 3.39Å; S213-H217 PolarHBondContact O-ND1 3.07Å
214A43.2Very low45.4Very low38 Ų3899 Ų9931%0.31453%0.531SS..Hα-helixtrans-66.6-30.8-178.900000112.9N210 V218N210-A214 PolarHBondContact O-N 3.42Å; A214-V218 VanDerWaalsContact O-CG2 3.24Å; A214-V218 WeakPolarHBondContact O-CG2 3.39Å; A214-V218 PolarHBondContact O-N 2.78Å
215D41.7Very low46Very low137 Ų13794.2 Ų94.273%0.73351%0.507SS*.Hα-helixtrans-73.8-33.1-178.5-154.134.3000112.3S213S213-D215 VanDerWaalsContact C-N 3.3Å; S213-D215 PolarHBondContact O-N 3.32Å
216T42.7Very low46.5Very low95 Ų9589.6 Ų89.658%0.58349%0.49SS*.Hα-helixtrans-79.1-22.8175.8430000113.6S213 S220S213-T216 PolarHBondContact O-N 3.24Å; S213-T216 PolarHBondContact O-OG1 3.49Å; S213-T216 VanDerWaalsContact O-OG1 3.07Å; T216-S220 PolarHBondContact O-OG 3.48Å
217H44.8Very low46.9Very low125 Ų12595.2 Ų95.258%0.57951%0.506SS*.Hα-helixtrans-81.1-19.7177.2-76.979.5000114.1S213 S220 G221S213-H217 PolarHBondContact O-N 3.39Å; S213-H217 PolarHBondContact O-ND1 3.07Å; H217-S220 WeakPolarHBondContact CA-OG 3.37Å; H217-S220 PolarHBondContact O-OG 3.5Å; H217-G221 PolarHBondContact O-N 2.93Å
218V51.7Low47Very low29 Ų2992.3 Ų92.318%0.17650%0.499CS..Hα-helixtrans-69.8-42.2178.3175.20000111.3T28 A214 G221 Q222T28-V218 HydrophobicContact CG2-CG2 3.61Å; A214-V218 VanDerWaalsContact O-CG2 3.24Å; A214-V218 WeakPolarHBondContact O-CG2 3.39Å; A214-V218 PolarHBondContact O-N 2.78Å; V218-G221 PolarHBondContact O-N 3.08Å; V218-Q222 PolarHBondContact O-N 3.47Å; V218-Q222 VanDerWaalsContact O-N 3.08Å
219Q43Very low47.8Very low150 Ų15086 Ų8670%0.70148%0.479SS*.Hα-helixtrans-70.2-36.9-178.3-151.1-179.629.900112Q223Q219-Q223 PolarHBondContact O-N 2.95Å
220S45.6Very low48.6Very low43 Ų4389.6 Ų89.630%0.30148%0.484SS..Hα-helixtrans-76.2-35.6175.252.90000112.5T216 H217 Q223 Q224T216-S220 PolarHBondContact O-OG 3.48Å; H217-S220 WeakPolarHBondContact CA-OG 3.37Å; H217-S220 PolarHBondContact O-OG 3.5Å; S220-Q223 PolarHBondContact O-N 2.89Å; S220-Q224 WeakPolarHBondContact O-CG 3.49Å; S220-Q224 PolarHBondContact O-N 3.32Å
221G48.8Very low48.9Very low16 Ų1694.4 Ų94.417%0.16550%0.499CS..Hα-helixtrans-64.1-41.917500000113.7H217 V218 Q224 L225H217-G221 PolarHBondContact O-N 2.93Å; V218-G221 PolarHBondContact O-N 3.08Å; G221-Q224 PolarHBondContact O-N 3.45Å; G221-L225 WeakPolarHBondContact O-CB 3.28Å; G221-L225 PolarHBondContact O-N 2.91Å
222Q52.1Low48.9Very low110 Ų11095.4 Ų95.451%0.51450%0.497SS..Hα-helixtrans-62.4-41.8172.2-82.4-167.4-1400112.2L29 V218 L225 A226L29-Q222 HydrophobicContact CD2-CG 3.46Å; L29-Q222 VanDerWaalsContact CD2-CG 3.46Å; V218-Q222 PolarHBondContact O-N 3.47Å; V218-Q222 VanDerWaalsContact O-N 3.08Å; Q222-L225 PolarHBondContact O-N 3.43Å; Q222-A226 VanDerWaalsContact O-CB 3.28Å; Q222-A226 WeakPolarHBondContact O-CB 3.39Å; Q222-A226 PolarHBondContact O-N 3.19Å
223Q50.3Low50Low116 Ų11695.6 Ų95.654%0.54249%0.49SS..Hα-helixtrans-64.8-38.5175.9-81.4-173.7400112.3Q219 S220 R227Q219-Q223 PolarHBondContact O-N 2.95Å; S220-Q223 PolarHBondContact O-N 2.89Å; Q223-R227 WeakPolarHBondContact O-CB 3.42Å; Q223-R227 VanDerWaalsContact O-CG 3.26Å; Q223-R227 WeakPolarHBondContact O-CG 3.34Å; Q223-R227 PolarHBondContact O-N 3.47Å
224Q46.2Very low50.9Low122 Ų12295.2 Ų95.257%0.5749%0.488SS*.Hα-helixtrans-69.9-39177.9-72.5-177.327.200112.3S220 G221 R227 A228S220-Q224 WeakPolarHBondContact O-CG 3.49Å; S220-Q224 PolarHBondContact O-N 3.32Å; G221-Q224 PolarHBondContact O-N 3.45Å; Q224-R227 PolarHBondContact O-N 2.8Å; Q224-A228 VanDerWaalsContact O-CB 3.28Å; Q224-A228 WeakPolarHBondContact O-CB 3.34Å; Q224-A228 PolarHBondContact O-N 3.32Å
225L56.3Low51.6Low56 Ų5696 Ų9629%0.29349%0.491SS..Hα-helixtrans-67.7-40.5173.9-78.9167.8000112.4Q25 L29 G221 Q222 A228 A229Q25-L225 HydrophobicContact CB-CD1 4.2Å; L29-L225 HydrophobicContact CD1-CD1 3.71Å; G221-L225 WeakPolarHBondContact O-CB 3.28Å; G221-L225 PolarHBondContact O-N 2.91Å; Q222-L225 PolarHBondContact O-N 3.43Å; L225-A228 PolarHBondContact O-N 2.91Å; L225-A229 WeakPolarHBondContact O-CB 3.28Å; L225-A229 PolarHBondContact O-N 2.75Å
226A56.7Low52.9Low57 Ų5796.7 Ų96.747%0.47148%0.483SS..Hα-helixtrans-61.9-45.6173.400000111.3Q222 A229 E230Q222-A226 VanDerWaalsContact O-CB 3.28Å; Q222-A226 WeakPolarHBondContact O-CB 3.39Å; Q222-A226 PolarHBondContact O-N 3.19Å; A226-A229 PolarHBondContact O-N 3.44Å; A226-E230 PolarHBondContact O-N 3.35Å
227R54.2Low54.2Low154 Ų15498.7 Ų98.758%0.58148%0.484SS*.Hα-helixtrans-63.3-41.9174.3-75.6-178.4-174.3-168.94.9111.9Q223 Q224 A229 E230 Y231Q223-R227 WeakPolarHBondContact O-CB 3.42Å; Q223-R227 VanDerWaalsContact O-CG 3.26Å; Q223-R227 WeakPolarHBondContact O-CG 3.34Å; Q223-R227 PolarHBondContact O-N 3.47Å; Q224-R227 PolarHBondContact O-N 2.8Å; R227-A229 VanDerWaalsContact C-N 3.34Å; R227-A229 PolarHBondContact O-N 2.87Å; R227-E230 PolarHBondContact O-N 2.79Å; R227-Y231 WeakPolarHBondContact O-CB 3.23Å; R227-Y231 VanDerWaalsContact O-CD2 3.23Å; R227-Y231 WeakPolarHBondContact O-CD2 3.26Å; R227-Y231 PolarHBondContact O-N 2.99Å
228A51Low55.5Low54 Ų5499.4 Ų99.445%0.44649%0.485SS..Hα-helixtrans-62.5-40.6177.700000111.8Q224 L225 Y231 Q232Q224-A228 VanDerWaalsContact O-CB 3.28Å; Q224-A228 WeakPolarHBondContact O-CB 3.34Å; Q224-A228 PolarHBondContact O-N 3.32Å; L225-A228 PolarHBondContact O-N 2.91Å; A228-Y231 PolarHBondContact O-N 3.46Å; A228-Q232 WeakPolarHBondContact O-CB 3.3Å; A228-Q232 PolarHBondContact O-N 3.33Å
229A54.4Low56.6Low56 Ų56103 Ų10346%0.46350%0.502SS..Hα-helixtrans-64.2-40.6173.600000112.1L225 A226 R227 Q232 R233L225-A229 WeakPolarHBondContact O-CB 3.28Å; L225-A229 PolarHBondContact O-N 2.75Å; A226-A229 PolarHBondContact O-N 3.44Å; R227-A229 VanDerWaalsContact C-N 3.34Å; R227-A229 PolarHBondContact O-N 2.87Å; A229-Q232 PolarHBondContact O-N 3.24Å; A229-R233 WeakPolarHBondContact O-CB 3.32Å; A229-R233 PolarHBondContact O-N 2.91Å
230E60.2Low58.2Low139 Ų13999.5 Ų99.565%0.6549%0.493SS*.Hα-helixtrans-65.3-40.9172.8-79-173.1150.100112.9A226 R227 R233 S234A226-E230 PolarHBondContact O-N 3.35Å; R227-E230 PolarHBondContact O-N 2.79Å; E230-R233 PolarHBondContact O-N 3.41Å; E230-S234 WeakPolarHBondContact O-CB 3.44Å; E230-S234 PolarHBondContact O-N 3.46Å; E230-S234 PolarHBondContact O-OG 3.22Å; E230-S234 VanDerWaalsContact O-OG 3.04Å
231Y56.2Low60Low161 Ų161102.6 Ų102.663%0.63151%0.506SS*.Hα-helixtrans-62.9-41.8174-91.5-72.4000111.7R227 A228 R233 S234 S235R227-Y231 WeakPolarHBondContact O-CB 3.23Å; R227-Y231 VanDerWaalsContact O-CD2 3.23Å; R227-Y231 WeakPolarHBondContact O-CD2 3.26Å; R227-Y231 PolarHBondContact O-N 2.99Å; A228-Y231 PolarHBondContact O-N 3.46Å; Y231-R233 VanDerWaalsContact C-N 3.32Å; Y231-R233 PolarHBondContact O-N 3.36Å; Y231-S234 WeakPolarHBondContact CA-OG 3.41Å; Y231-S234 PolarHBondContact O-N 2.9Å; Y231-S234 PolarHBondContact O-OG 2.94Å; Y231-S235 VanDerWaalsContact O-CB 3.32Å; Y231-S235 WeakPolarHBondContact O-CB 3.42Å; Y231-S235 PolarHBondContact O-N 3.41Å; Y231-S235 PolarHBondContact O-OG 3.27Å
232Q46.4Very low61.8Low125 Ų125106.8 Ų106.858%0.58452%0.524SS*.Hα-helixtrans-68-32.2176.4-160.3-17527.800112A228 A229 R236A228-Q232 WeakPolarHBondContact O-CB 3.3Å; A228-Q232 PolarHBondContact O-N 3.33Å; A229-Q232 PolarHBondContact O-N 3.24Å; Q232-R236 WeakPolarHBondContact O-CG 3.45Å; Q232-R236 PolarHBondContact O-NE 3.04Å; Q232-R236 VanDerWaalsContact O-NE 3.08Å
233R62.7Low63.4Low176 Ų176106.6 Ų106.666%0.66453%0.526SS*.Hα-helixtrans-73.5-39.2175.3-167174.9-173.9173.41.3112.1A229 E230 Y231A229-R233 WeakPolarHBondContact O-CB 3.32Å; A229-R233 PolarHBondContact O-N 2.91Å; E230-R233 PolarHBondContact O-N 3.41Å; Y231-R233 VanDerWaalsContact C-N 3.32Å; Y231-R233 PolarHBondContact O-N 3.36Å
234S60Low65.3Low40 Ų40106.3 Ų106.328%0.2853%0.527SS..Hα-helixtrans-74.4-33.7178.159.80000112.8E230 Y231 R236 K237 K238E230-S234 WeakPolarHBondContact O-CB 3.44Å; E230-S234 PolarHBondContact O-N 3.46Å; E230-S234 PolarHBondContact O-OG 3.22Å; E230-S234 VanDerWaalsContact O-OG 3.04Å; Y231-S234 WeakPolarHBondContact CA-OG 3.41Å; Y231-S234 PolarHBondContact O-N 2.9Å; Y231-S234 PolarHBondContact O-OG 2.94Å; S234-R236 PolarHBondContact O-N 2.99Å; S234-K237 PolarHBondContact O-N 3.22Å; S234-K238 WeakPolarHBondContact O-CG 3.43Å; S234-K238 PolarHBondContact O-N 3.05Å
235S58.3Low67.5Low54 Ų54104.8 Ų104.838%0.37853%0.526SS..Hα-helixtrans-63.8-38.9176.3-60.70000112.2Y231 K237 K238 I239Y231-S235 VanDerWaalsContact O-CB 3.32Å; Y231-S235 WeakPolarHBondContact O-CB 3.42Å; Y231-S235 PolarHBondContact O-N 3.41Å; Y231-S235 PolarHBondContact O-OG 3.27Å; S235-K237 VanDerWaalsContact C-N 3.33Å; S235-K237 PolarHBondContact O-N 2.87Å; S235-K238 PolarHBondContact O-N 3.02Å; S235-I239 VanDerWaalsContact O-CG1 3.3Å; S235-I239 WeakPolarHBondContact O-CG1 3.33Å; S235-I239 PolarHBondContact O-N 3.46Å
236R69.5Low69.1Low152 Ų152107.1 Ų107.157%0.57454%0.538SS*.Hα-helixtrans-60.4-39.8173.9-75.1-179.5-93.2-167.1-6.2112.7Q232 S234 C240Q232-R236 WeakPolarHBondContact O-CG 3.45Å; Q232-R236 PolarHBondContact O-NE 3.04Å; Q232-R236 VanDerWaalsContact O-NE 3.08Å; S234-R236 PolarHBondContact O-N 2.99Å; R236-C240 PolarHBondContact O-N 3.36Å; R236-C240 VanDerWaalsContact O-N 3.13Å
237K70.3Confident70.7Confident138 Ų138107.1 Ų107.160%0.654%0.538SS*.Hα-helixtrans-66.6-42.6175.6-65.5-178.6179.2-176.50111.8S234 S235 C240 I241S234-K237 PolarHBondContact O-N 3.22Å; S235-K237 VanDerWaalsContact C-N 3.33Å; S235-K237 PolarHBondContact O-N 2.87Å; K237-C240 PolarHBondContact O-N 3.3Å; K237-I241 WeakPolarHBondContact O-CG1 3.43Å; K237-I241 PolarHBondContact O-N 3.45Å
238K71.3Confident72.6Confident139 Ų139103.9 Ų103.960%0.60454%0.535SS*.Hα-helixtrans-64.9-39.3177.8-68.7176.7-177.5-179.50112.1S234 S235 I241 L242S234-K238 WeakPolarHBondContact O-CG 3.43Å; S234-K238 PolarHBondContact O-N 3.05Å; S235-K238 PolarHBondContact O-N 3.02Å; K238-I241 PolarHBondContact O-N 3.04Å; K238-L242 WeakPolarHBondContact O-CB 3.45Å; K238-L242 PolarHBondContact O-N 3.35Å
239I75Confident74.6Confident105 Ų105103.4 Ų103.454%0.53853%0.531SS..Hα-helixtrans-62.6-45.5174.7-70.9167.6000110.9S235 I241 L242 L243S235-I239 VanDerWaalsContact O-CG1 3.3Å; S235-I239 WeakPolarHBondContact O-CG1 3.33Å; S235-I239 PolarHBondContact O-N 3.46Å; I239-I241 PolarHBondContact O-N 3.02Å; I239-L242 PolarHBondContact O-N 3.44Å; I239-L243 HydrophobicContact CG2-CD1 4.37Å; I239-L243 WeakPolarHBondContact O-CG 3.36Å; I239-L243 PolarHBondContact O-N 3.43Å
240C76.9Confident76.4Confident76 Ų76103.7 Ų103.751%0.51453%0.533SS..Hα-helixtrans-60.8-42.5175.1-790000112.7R236 K237 L243 I244R236-C240 PolarHBondContact O-N 3.36Å; R236-C240 VanDerWaalsContact O-N 3.13Å; K237-C240 PolarHBondContact O-N 3.3Å; C240-L243 PolarHBondContact O-N 3.09Å; C240-I244 WeakPolarHBondContact O-CG1 3.4Å; C240-I244 PolarHBondContact O-N 2.99Å; C240-I244 VanDerWaalsContact O-N 3.09Å
241I83.6Confident77.9Confident108 Ų108101.6 Ų101.655%0.55453%0.53SS*.Hα-helixtrans-62.7-44.1177.7-68166.4000110.6K237 K238 I239 L243 I244 V245K237-I241 WeakPolarHBondContact O-CG1 3.43Å; K237-I241 PolarHBondContact O-N 3.45Å; K238-I241 PolarHBondContact O-N 3.04Å; I239-I241 PolarHBondContact O-N 3.02Å; I241-L243 VanDerWaalsContact C-N 3.34Å; I241-L243 PolarHBondContact O-N 3.25Å; I241-I244 PolarHBondContact O-N 2.95Å; I241-V245 WeakPolarHBondContact O-CG2 3.41Å; I241-V245 PolarHBondContact O-N 3.34Å
242L85.8Confident79.7Confident104 Ų10497.4 Ų97.455%0.54552%0.521SS..Hα-helixtrans-61-42.2178-169.2156.2000111.7K238 I239 I244 V245 L246K238-L242 WeakPolarHBondContact O-CB 3.45Å; K238-L242 PolarHBondContact O-N 3.35Å; I239-L242 PolarHBondContact O-N 3.44Å; L242-I244 PolarHBondContact O-N 3.36Å; L242-V245 PolarHBondContact O-N 3.13Å; L242-L246 HydrophobicContact CD2-CD1 3.59Å; L242-L246 HydrophobicContact CD2-CG 4.12Å; L242-L246 PolarHBondContact O-N 2.97Å
243L86.4Confident82Confident106 Ų10696.1 Ų96.156%0.55552%0.517SS*.Hα-helixtrans-63.2-40.2176.3-72.1177.4000112.7I239 C240 I241 L246 A247I239-L243 HydrophobicContact CG2-CD1 4.37Å; I239-L243 WeakPolarHBondContact O-CG 3.36Å; I239-L243 PolarHBondContact O-N 3.43Å; C240-L243 PolarHBondContact O-N 3.09Å; I241-L243 VanDerWaalsContact C-N 3.34Å; I241-L243 PolarHBondContact O-N 3.25Å; L243-L246 PolarHBondContact O-N 3.32Å; L243-A247 WeakPolarHBondContact O-CB 3.49Å; L243-A247 PolarHBondContact O-N 3.49Å
244I89.6Confident83.4Confident111 Ų11189.6 Ų89.657%0.56950%0.504SS*.Hα-helixtrans-64.2-43.8176.3-67.4166.7000110.5C240 I241 L242 L246 A247 V248C240-I244 WeakPolarHBondContact O-CG1 3.4Å; C240-I244 PolarHBondContact O-N 2.99Å; C240-I244 VanDerWaalsContact O-N 3.09Å; I241-I244 PolarHBondContact O-N 2.95Å; L242-I244 PolarHBondContact O-N 3.36Å; I244-L246 PolarHBondContact O-N 3.34Å; I244-A247 PolarHBondContact O-N 3.46Å; I244-V248 WeakPolarHBondContact O-CG2 3.36Å; I244-V248 PolarHBondContact O-N 3.41Å
245V92Very high84.9Confident90 Ų9092.9 Ų92.955%0.54552%0.518SS..Hα-helixtrans-61.7-43.7178172.20000111.2I241 L242 V248 A249I241-V245 WeakPolarHBondContact O-CG2 3.41Å; I241-V245 PolarHBondContact O-N 3.34Å; L242-V245 PolarHBondContact O-N 3.13Å; V245-V248 PolarHBondContact O-N 2.93Å; V245-A249 WeakPolarHBondContact O-CB 3.43Å; V245-A249 PolarHBondContact O-N 2.97Å
246L90.6Very high86.6Confident105 Ų10595.7 Ų95.755%0.5553%0.528SS..Hα-helixtrans-63.8-39.7176-77.2178.8000112.5L242 L243 I244 A249 A250L242-L246 HydrophobicContact CD2-CD1 3.59Å; L242-L246 HydrophobicContact CD2-CG 4.12Å; L242-L246 PolarHBondContact O-N 2.97Å; L243-L246 PolarHBondContact O-N 3.32Å; I244-L246 PolarHBondContact O-N 3.34Å; L246-A249 PolarHBondContact O-N 3.4Å; L246-A250 WeakPolarHBondContact O-CB 3.38Å; L246-A250 PolarHBondContact O-N 3.39Å
247A91.2Very high87.6Confident57 Ų5792.9 Ų92.947%0.47152%0.523SS..Hα-helixtrans-63.2-44.4176.900000111.7L243 I244 A250 V251L243-A247 WeakPolarHBondContact O-CB 3.49Å; L243-A247 PolarHBondContact O-N 3.49Å; I244-A247 PolarHBondContact O-N 3.46Å; A247-A250 PolarHBondContact O-N 2.99Å; A247-V251 WeakPolarHBondContact O-CG2 3.35Å; A247-V251 PolarHBondContact O-N 3.42Å
248V93.8Very high88.6Confident86 Ų8693.8 Ų93.852%0.52152%0.523SS..Hα-helixtrans-63.5-44.6176.5174.20000110.9I244 V245 A250 V251 V252I244-V248 WeakPolarHBondContact O-CG2 3.36Å; I244-V248 PolarHBondContact O-N 3.41Å; V245-V248 PolarHBondContact O-N 2.93Å; V248-A250 VanDerWaalsContact C-N 3.32Å; V248-A250 PolarHBondContact O-N 3.02Å; V248-V251 PolarHBondContact O-N 3.28Å; V248-V252 HydrophobicContact CG1-CG2 4.44Å; V248-V252 WeakPolarHBondContact O-CG2 3.24Å; V248-V252 PolarHBondContact O-N 3.49Å
249A91.8Very high89.4Confident44 Ų4488.4 Ų88.436%0.36451%0.507SS..Hα-helixtrans-59.3-43.3176.700000111.8V245 L246 V251 V252 I253V245-A249 WeakPolarHBondContact O-CB 3.43Å; V245-A249 PolarHBondContact O-N 2.97Å; L246-A249 PolarHBondContact O-N 3.4Å; A249-V251 PolarHBondContact O-N 2.96Å; A249-V252 PolarHBondContact O-N 3.26Å; A249-I253 WeakPolarHBondContact O-CB 3.49Å; A249-I253 WeakPolarHBondContact O-CD1 3.39Å; A249-I253 VanDerWaalsContact O-CG1 3.24Å; A249-I253 WeakPolarHBondContact O-CG1 3.44Å; A249-I253 PolarHBondContact O-N 3.48Å
250A91.9Very high90Very high62 Ų6287.7 Ų87.751%0.51251%0.511SS..Hα-helixtrans-62.2-40.5176.700000112.5L246 A247 V248 G254L246-A250 WeakPolarHBondContact O-CB 3.38Å; L246-A250 PolarHBondContact O-N 3.39Å; A247-A250 PolarHBondContact O-N 2.99Å; V248-A250 VanDerWaalsContact C-N 3.32Å; V248-A250 PolarHBondContact O-N 3.02Å; A250-G254 PolarHBondContact O-N 2.94Å
251V93.3Very high90.2Very high94 Ų9490.8 Ų90.857%0.5752%0.522SS*.Hα-helixtrans-64.3-46176.1171.40000111.2A247 V248 A249 I253 G254 L255A247-V251 WeakPolarHBondContact O-CG2 3.35Å; A247-V251 PolarHBondContact O-N 3.42Å; V248-V251 PolarHBondContact O-N 3.28Å; A249-V251 PolarHBondContact O-N 2.96Å; V251-I253 PolarHBondContact O-N 2.95Å; V251-G254 PolarHBondContact O-N 3.46Å; V251-L255 HydrophobicContact CG1-CD1 4.18Å; V251-L255 HydrophobicContact CG1-CG 4.49Å; V251-L255 WeakPolarHBondContact O-CG 3.49Å; V251-L255 PolarHBondContact O-N 3.48Å
252V94.4Very high90Very high74 Ų7492.7 Ų92.745%0.44853%0.526SS..Hα-helixtrans-61.5-45.4178.8172.80000110.9V248 A249 G254 L255 I256V248-V252 HydrophobicContact CG1-CG2 4.44Å; V248-V252 WeakPolarHBondContact O-CG2 3.24Å; V248-V252 PolarHBondContact O-N 3.49Å; A249-V252 PolarHBondContact O-N 3.26Å; V252-G254 VanDerWaalsContact C-N 3.33Å; V252-G254 PolarHBondContact O-N 3.23Å; V252-L255 PolarHBondContact O-N 3.22Å; V252-I256 HydrophobicContact CG1-CD1 3.93Å; V252-I256 WeakPolarHBondContact O-CG1 3.38Å; V252-I256 PolarHBondContact O-N 3.22Å
253I93.9Very high88.9Confident98 Ų9897.3 Ų97.350%0.50355%0.551SS.*Hα-helixtrans-60.9-44.2176.4-68166.3000110.5A249 V251 L255 I256 I257A249-I253 WeakPolarHBondContact O-CB 3.49Å; A249-I253 WeakPolarHBondContact O-CD1 3.39Å; A249-I253 VanDerWaalsContact O-CG1 3.24Å; A249-I253 WeakPolarHBondContact O-CG1 3.44Å; A249-I253 PolarHBondContact O-N 3.48Å; V251-I253 PolarHBondContact O-N 2.95Å; I253-L255 VanDerWaalsContact C-N 3.34Å; I253-L255 PolarHBondContact O-N 3.04Å; I253-I256 PolarHBondContact O-N 3.34Å; I253-I257 HydrophobicContact CG2-CD1 3.77Å; I253-I257 HydrophobicContact CG2-CG1 4.48Å; I253-I257 WeakPolarHBondContact O-CG1 3.43Å; I253-I257 PolarHBondContact O-N 3.47Å
254G91.7Very high89.1Confident38 Ų3896.9 Ų96.939%0.39255%0.551SS.*Hα-helixtrans-59.8-41.3176.800000113.3A250 V251 V252 I257 W258A250-G254 PolarHBondContact O-N 2.94Å; V251-G254 PolarHBondContact O-N 3.46Å; V252-G254 VanDerWaalsContact C-N 3.33Å; V252-G254 PolarHBondContact O-N 3.23Å; G254-I257 PolarHBondContact O-N 2.93Å; G254-W258 WeakPolarHBondContact O-CB 3.37Å; G254-W258 PolarHBondContact O-N 2.98Å
255L92.4Very high89Confident109 Ų10996.1 Ų96.157%0.57155%0.55SS**Hα-helixtrans-67.1-39.7177.5-70.8174.5000112.5V251 V252 I253 W258 G259V251-L255 HydrophobicContact CG1-CD1 4.18Å; V251-L255 HydrophobicContact CG1-CG 4.49Å; V251-L255 WeakPolarHBondContact O-CG 3.49Å; V251-L255 PolarHBondContact O-N 3.48Å; V252-L255 PolarHBondContact O-N 3.22Å; I253-L255 VanDerWaalsContact C-N 3.34Å; I253-L255 PolarHBondContact O-N 3.04Å; L255-W258 PolarHBondContact O-N 3.03Å; L255-G259 PolarHBondContact O-N 3.38Å
256I92.6Very high88.9Confident113 Ų11396.4 Ų96.458%0.57955%0.55SS**Hα-helixtrans-63.4-46.5176.8-67.9166.3000110.2V252 I253 G259 S260V252-I256 HydrophobicContact CG1-CD1 3.93Å; V252-I256 WeakPolarHBondContact O-CG1 3.38Å; V252-I256 PolarHBondContact O-N 3.22Å; I253-I256 PolarHBondContact O-N 3.34Å; I256-G259 PolarHBondContact O-N 3.48Å; I256-S260 WeakPolarHBondContact O-CB 3.34Å; I256-S260 PolarHBondContact O-N 3.24Å
257I91.8Very high88.8Confident93 Ų9395.9 Ų95.948%0.47755%0.551SS.*Hα-helixtrans-62.7-47178.4-67169.4000110.2I253 G254 G259 S260 L261I253-I257 HydrophobicContact CG2-CD1 3.77Å; I253-I257 HydrophobicContact CG2-CG1 4.48Å; I253-I257 WeakPolarHBondContact O-CG1 3.43Å; I253-I257 PolarHBondContact O-N 3.47Å; G254-I257 PolarHBondContact O-N 2.93Å; I257-G259 PolarHBondContact O-N 3.24Å; I257-S260 PolarHBondContact O-N 3.45Å; I257-L261 HydrophobicContact CG2-CD1 3.67Å; I257-L261 WeakPolarHBondContact O-CD1 3.33Å; I257-L261 PolarHBondContact O-N 3.02Å
258W90.6Very high88.6Confident157 Ų15798.4 Ų98.460%0.59556%0.555SS**Hα-helixtrans-61.5-42.3178.3-179.279000112.8G254 L255 L261 K262G254-W258 WeakPolarHBondContact O-CB 3.37Å; G254-W258 PolarHBondContact O-N 2.98Å; L255-W258 PolarHBondContact O-N 3.03Å; W258-L261 PolarHBondContact O-N 3.3Å; W258-K262 HydrophobicContact CH2-CD 3.89Å; W258-K262 HydrophobicContact CZ2-CD 3.76Å; W258-K262 HydrophobicContact CZ3-CD 4.44Å; W258-K262 WeakPolarHBondContact O-CB 3.38Å; W258-K262 PolarHBondContact O-N 3.05Å
259G88.1Confident88.3Confident27 Ų2799.2 Ų99.228%0.27856%0.558SS.*Hα-helixtrans-64.1-38.8175.300000112.7L255 I256 I257 L261 K262 N263L255-G259 PolarHBondContact O-N 3.38Å; I256-G259 PolarHBondContact O-N 3.48Å; I257-G259 PolarHBondContact O-N 3.24Å; G259-L261 VanDerWaalsContact C-N 3.32Å; G259-L261 PolarHBondContact O-N 3.41Å; G259-K262 PolarHBondContact O-N 2.89Å; G259-N263 PolarHBondContact O-N 2.94Å
260S87.3Confident88Confident89 Ų89103.1 Ų103.162%0.62257%0.572SS**Hα-helixtrans-71.8-22.5177.1-173.30000114.1I256 I257I256-S260 WeakPolarHBondContact O-CB 3.34Å; I256-S260 PolarHBondContact O-N 3.24Å; I257-S260 PolarHBondContact O-N 3.45Å
261L82.3Confident87.7Confident141 Ų141106.3 Ų106.374%0.73858%0.576SS**Hα-helixtrans-86.6-18.3175.9-96.7138000112.9I257 W258 G259I257-L261 HydrophobicContact CG2-CD1 3.67Å; I257-L261 WeakPolarHBondContact O-CD1 3.33Å; I257-L261 PolarHBondContact O-N 3.02Å; W258-L261 PolarHBondContact O-N 3.3Å; G259-L261 VanDerWaalsContact C-N 3.32Å; G259-L261 PolarHBondContact O-N 3.41Å
262K78.4Confident87.3Confident149 Ų149107.3 Ų107.365%0.64858%0.577SS**Hα-helixtrans-98.4-21-176.2-166.5176.3179.2-171.30113.2W258 G259W258-K262 HydrophobicContact CH2-CD 3.89Å; W258-K262 HydrophobicContact CZ2-CD 3.76Å; W258-K262 HydrophobicContact CZ3-CD 4.44Å; W258-K262 WeakPolarHBondContact O-CB 3.38Å; W258-K262 PolarHBondContact O-N 3.05Å; G259-K262 PolarHBondContact O-N 2.89Å
263N63.6Low86.6Confident200 Ų200110.4 Ų110.4100%1.0759%0.588SS**  trans-86.40167.1-78.3-5000110.7G259G259-N263 PolarHBondContact O-N 2.94Å

Retrieved 263 of 263 residues in 330.2 ms (Link to these results)