A0A2K5MYL0_CERAT Loading...

Cerebellar deration related protein 2

AlphaFold DB , UniProt , Accession A0A2K5MYL0, Species CERAT (Cercocebus atys, Sooty mangabey), Gene CDR2, Length 454 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
1M38.9Very low44.7Very low237 Ų237155.2 Ų155.2100%1.16780%0.796SS**  0820-63.1-154.9-83.400105.8
2L44.5Very low45Very low170 Ų170157 Ų15789%0.8980%0.802SS**  57.591.390.6-74175.7000112.5
3A45Very low45.3Very low95 Ų95157.2 Ų157.279%0.78579%0.794SS**  trans-158.779.7145.800000104
4E43.8Very low46Very low174 Ų174159.2 Ų159.281%0.81380%0.799SS**  70.398.295-75-176171.700112.2L6E4-L6 PolarHBondContact O-N 3.44Å
5N49.1Very low46.7Very low149 Ų149158.1 Ų158.180%0.79780%0.796SS**  trans8.6101.6144.6-68.5-21.7000115.8
6L45.4Very low47.5Very low150 Ų150157.3 Ų157.379%0.78579%0.789SS**  trans-109.369.4140.6-155.375000107.2E4 E8E4-L6 PolarHBondContact O-N 3.44Å; L6-E8 HydrophobicContact CD2-CG 4.32Å; L6-E8 HydrophobicContact CG-CG 4.3Å; L6-E8 PolarHBondContact O-N 3.48Å
7V44.9Very low48.3Very low106 Ų106155 Ų15564%0.64279%0.788SS**  trans-64.993.7149.9173.50000103E9V7-E9 HydrophobicContact CG1-CG 4.36Å; V7-E9 PolarHBondContact O-N 3.49Å
8E46Very low49.1Very low133 Ų133157.9 Ų157.962%0.62179%0.788SS**  trans-57.897.5156.6-85.9177.9159.300104.6L6 F10L6-E8 HydrophobicContact CD2-CG 4.32Å; L6-E8 HydrophobicContact CG-CG 4.3Å; L6-E8 PolarHBondContact O-N 3.48Å; E8-F10 HydrophobicContact CB-CD2 4.34Å; E8-F10 HydrophobicContact CB-CE2 4.29Å; E8-F10 PolarHBondContact O-N 3.44Å
9E45.7Very low49.8Very low170 Ų170157.8 Ų157.879%0.79478%0.779SS**  trans-54.589.9155.9-71.8175.4167.200105V7 E11V7-E9 HydrophobicContact CG1-CG 4.36Å; V7-E9 PolarHBondContact O-N 3.49Å; E9-E11 PolarHBondContact O-N 3.28Å
10F40.6Very low51.4Low175 Ų175156 Ų15677%0.76877%0.772SS**  trans-59.786151.3-79.4-91.5000104E8 M12E8-F10 HydrophobicContact CB-CD2 4.34Å; E8-F10 HydrophobicContact CB-CE2 4.29Å; E8-F10 PolarHBondContact O-N 3.44Å; F10-M12 PolarHBondContact O-N 3.28Å
11E47.4Very low52.7Low148 Ų148156 Ų15669%0.69277%0.77SS**  trans-43.5105.5148.8-79.5-178158.400103.8E9 K13E9-E11 PolarHBondContact O-N 3.28Å; E11-K13 PolarHBondContact O-N 3.33Å
12M48.1Very low54.8Low177 Ų177151.3 Ų151.387%0.87275%0.745SS**  trans-61.382.2153.4-65-160.8-56.700103.4F10 E14F10-M12 PolarHBondContact O-N 3.28Å; M12-E14 PolarHBondContact O-N 3.22Å
13K49.1Very low56.8Low160 Ų160146.7 Ų146.770%0.69672%0.721SS**  trans-52.8102.8154.6-83179.9176.3177.20102E11 D15E11-K13 PolarHBondContact O-N 3.33Å; K13-D15 VanDerWaalsContact C-N 3.29Å; K13-D15 PolarHBondContact O-N 3.05Å
14E55.9Low58.8Low185 Ų185146.8 Ų146.886%0.86471%0.708SS**  trans-44.2109.2165-72.3177.9152.900104.3M12 E16M12-E14 PolarHBondContact O-N 3.22Å; E14-E16 PolarHBondContact O-N 3.01Å
15D55.6Low61Low142 Ų142143.3 Ų143.376%0.75969%0.692SS**  trans-46.8123.4-176.6-76.5-50.5000106.8K13K13-D15 VanDerWaalsContact C-N 3.29Å; K13-D15 PolarHBondContact O-N 3.05Å
16E59.8Low62.9Low145 Ų145141 Ų14168%0.67868%0.676SS**  trans-41.4129.8175.1-80.4173.5147.100108.2E14 W18E14-E16 PolarHBondContact O-N 3.01Å; E16-W18 VanDerWaalsContact C-N 3.29Å; E16-W18 PolarHBondContact O-N 3.46Å
17P61.7Low65.2Low119 Ų119138.3 Ų138.377%0.77366%0.663SS**  trans-61.996.5178.2-20.731.6000108Y19P17-Y19 PolarHBondContact O-N 3.33Å
18W62.7Low67.6Low208 Ų208139.2 Ų139.279%0.78866%0.663SS**SBendtrans-66.710.5-173.5-82.490.5000113.7E16E16-W18 VanDerWaalsContact C-N 3.29Å; E16-W18 PolarHBondContact O-N 3.46Å
19Y62.4Low69.8Low155 Ų155137.7 Ų137.761%0.60866%0.656SS**SBendtrans-148.1132.2172-80.4-86.2000109.8P17 H21P17-Y19 PolarHBondContact O-N 3.33Å; Y19-H21 PolarHBondContact O-N 3.07Å
20D80.8Confident72.2Confident121 Ų121134.8 Ų134.865%0.64765%0.645SS**  trans-59.7128.2164.4-79.3-33.9000108.2Q22 D23 L24D20-Q22 PolarHBondContact O-N 2.7Å; D20-D23 PolarHBondContact O-N 2.94Å; D20-L24 PolarHBondContact O-N 2.78Å
21H79.2Confident74.9Confident156 Ų156129.2 Ų129.272%0.72263%0.632SS**Hα-helixtrans-53.9-28.6-174.8-174.167.9000112.9Y19 Q25Y19-H21 PolarHBondContact O-N 3.07Å; H21-Q25 WeakPolarHBondContact O-CB 3.17Å; H21-Q25 PolarHBondContact O-N 3.22Å; H21-Q25 VanDerWaalsContact O-N 3.16Å
22Q83Confident77.2Confident139 Ų139125.3 Ų125.365%0.6563%0.625SS**Hα-helixtrans-76.5-28.3179.7-166.9160.40.600113.6D20 Q26D20-Q22 PolarHBondContact O-N 2.7Å; Q22-Q26 WeakPolarHBondContact O-CG 3.5Å; Q22-Q26 PolarHBondContact O-N 3.11Å; Q22-Q26 PolarHBondContact O-NE2 2.64Å
23D86.8Confident79.5Confident74 Ų74122.9 Ų122.940%0.39661%0.611SS.*Hα-helixtrans-79-41.6176.7-70.3-13.9000110.4D20 Q25 Q26 D27D20-D23 PolarHBondContact O-N 2.94Å; D23-Q25 PolarHBondContact O-N 3.31Å; D23-Q26 PolarHBondContact O-N 2.84Å; D23-Q26 VanDerWaalsContact O-N 3.13Å; D23-D27 PolarHBondContact O-N 2.87Å
24L87.5Confident81.8Confident97 Ų97120.3 Ų120.351%0.50861%0.605SS.*Hα-helixtrans-58.8-38.7171.4-179.362.7000111.8D20 L28D20-L24 PolarHBondContact O-N 2.78Å; L24-L28 VanDerWaalsContact O-CB 3.29Å; L24-L28 WeakPolarHBondContact O-CB 3.31Å; L24-L28 PolarHBondContact O-N 2.85Å
25Q88.6Confident83.7Confident100 Ų100113.3 Ų113.347%0.46758%0.582SS.*Hα-helixtrans-66.7-38.3176.6-173.8174.82.900112.3H21 D23 Q29H21-Q25 WeakPolarHBondContact O-CB 3.17Å; H21-Q25 PolarHBondContact O-N 3.22Å; H21-Q25 VanDerWaalsContact O-N 3.16Å; D23-Q25 PolarHBondContact O-N 3.31Å; Q25-Q29 VanDerWaalsContact O-CG 3.26Å; Q25-Q29 WeakPolarHBondContact O-CG 3.4Å; Q25-Q29 PolarHBondContact O-N 3.39Å
26Q90.6Very high85.7Confident100 Ų100113.1 Ų113.147%0.46757%0.574SS.*Hα-helixtrans-68.7-44.9176.2-76.9167.567.300112Q22 D23 L28 Q29 L30Q22-Q26 WeakPolarHBondContact O-CG 3.5Å; Q22-Q26 PolarHBondContact O-N 3.11Å; Q22-Q26 PolarHBondContact O-NE2 2.64Å; D23-Q26 PolarHBondContact O-N 2.84Å; D23-Q26 VanDerWaalsContact O-N 3.13Å; Q26-L28 VanDerWaalsContact C-N 3.3Å; Q26-L28 PolarHBondContact O-N 2.87Å; Q26-Q29 WeakPolarHBondContact O-CB 3.42Å; Q26-Q29 PolarHBondContact O-N 2.86Å; Q26-L30 PolarHBondContact O-N 2.9Å
27D93.9Very high87.5Confident94 Ų94110.4 Ų110.450%0.50357%0.568SS.*Hα-helixtrans-62.8-38.7177.3-76.4-17.9000111.5D23 L30 A31D23-D27 PolarHBondContact O-N 2.87Å; D27-L30 PolarHBondContact O-N 3.45Å; D27-A31 VanDerWaalsContact O-CB 3.31Å; D27-A31 WeakPolarHBondContact O-CB 3.31Å; D27-A31 PolarHBondContact O-N 3.26Å
28L93.8Very high89.2Confident125 Ų125109.8 Ų109.865%0.65456%0.557SS**Hα-helixtrans-65.5-40.1174.8-17366.8000111.9L24 Q26 A32L24-L28 VanDerWaalsContact O-CB 3.29Å; L24-L28 WeakPolarHBondContact O-CB 3.31Å; L24-L28 PolarHBondContact O-N 2.85Å; Q26-L28 VanDerWaalsContact C-N 3.3Å; Q26-L28 PolarHBondContact O-N 2.87Å; L28-A32 WeakPolarHBondContact O-CB 3.38Å; L28-A32 PolarHBondContact O-N 3.47Å
29Q93.8Very high90.9Very high102 Ų102105.3 Ų105.348%0.47755%0.548SS..Hα-helixtrans-63.2-46.3174.3-76.5171.1-600111.3Q25 Q26 A31 A32 E33Q25-Q29 VanDerWaalsContact O-CG 3.26Å; Q25-Q29 WeakPolarHBondContact O-CG 3.4Å; Q25-Q29 PolarHBondContact O-N 3.39Å; Q26-Q29 WeakPolarHBondContact O-CB 3.42Å; Q26-Q29 PolarHBondContact O-N 2.86Å; Q29-A31 PolarHBondContact O-N 2.78Å; Q29-A32 WeakPolarHBondContact O-CB 3.3Å; Q29-A32 PolarHBondContact O-N 2.72Å; Q29-E33 WeakPolarHBondContact O-CG 3.39Å; Q29-E33 PolarHBondContact O-N 3.49Å
30L95.5Very high92.6Very high108 Ų108101.2 Ų101.257%0.56554%0.537SS*.Hα-helixtrans-63.3-42.3178.1-176.564.8000111.9Q26 D27 A32 E33 L34Q26-L30 PolarHBondContact O-N 2.9Å; D27-L30 PolarHBondContact O-N 3.45Å; L30-A32 VanDerWaalsContact C-N 3.3Å; L30-A32 PolarHBondContact O-N 2.81Å; L30-E33 PolarHBondContact O-N 3.02Å; L30-L34 WeakPolarHBondContact O-CB 3.33Å; L30-L34 PolarHBondContact O-N 3.17Å
31A96.1Very high93.4Very high59 Ų59102.9 Ų102.949%0.48853%0.534SS..Hα-helixtrans-62-39.2174.700000111.8D27 Q29 G35D27-A31 VanDerWaalsContact O-CB 3.31Å; D27-A31 WeakPolarHBondContact O-CB 3.31Å; D27-A31 PolarHBondContact O-N 3.26Å; Q29-A31 PolarHBondContact O-N 2.78Å; A31-G35 PolarHBondContact O-N 3.46Å
32A95.9Very high94.3Very high65 Ų6599.4 Ų99.454%0.53752%0.521SS..Hα-helixtrans-67.7-40.6175.300000112.3L28 Q29 L30 G35 K36L28-A32 WeakPolarHBondContact O-CB 3.38Å; L28-A32 PolarHBondContact O-N 3.47Å; Q29-A32 WeakPolarHBondContact O-CB 3.3Å; Q29-A32 PolarHBondContact O-N 2.72Å; L30-A32 VanDerWaalsContact C-N 3.3Å; L30-A32 PolarHBondContact O-N 2.81Å; A32-G35 PolarHBondContact O-N 3.4Å; A32-K36 WeakPolarHBondContact O-CB 3.06Å; A32-K36 PolarHBondContact O-N 3.14Å
33E96.1Very high95Very high126 Ų12695.5 Ų95.559%0.58951%0.506SS*.Hα-helixtrans-64.6-42.1175.5-74.5-177.8176.300112.3Q29 L30 K36 T37Q29-E33 WeakPolarHBondContact O-CG 3.39Å; Q29-E33 PolarHBondContact O-N 3.49Å; L30-E33 PolarHBondContact O-N 3.02Å; E33-K36 PolarHBondContact O-N 2.82Å; E33-T37 PolarHBondContact O-N 3.35Å; E33-T37 PolarHBondContact O-OG1 2.9Å
34L97.2Very high95.5Very high107 Ų10798 Ų9856%0.5652%0.516SS*.Hα-helixtrans-65.7-44.6174.4-176.366.9000111L30 K36 T37 L38L30-L34 WeakPolarHBondContact O-CB 3.33Å; L30-L34 PolarHBondContact O-N 3.17Å; L34-K36 VanDerWaalsContact C-N 3.31Å; L34-K36 PolarHBondContact O-N 2.79Å; L34-T37 PolarHBondContact O-N 2.95Å; L34-L38 HydrophobicContact CG-CD1 4.22Å; L34-L38 WeakPolarHBondContact O-CB 3.29Å; L34-L38 WeakPolarHBondContact O-CG 3.43Å; L34-L38 PolarHBondContact O-N 3.05Å
35G97.4Very high96Very high37 Ų3798.2 Ų98.238%0.38152%0.517SS..Hα-helixtrans-57.6-44.4175.600000111.8A31 A32 L38 L39A31-G35 PolarHBondContact O-N 3.46Å; A32-G35 PolarHBondContact O-N 3.4Å; G35-L38 PolarHBondContact O-N 2.98Å; G35-L39 WeakPolarHBondContact O-CB 3.2Å; G35-L39 PolarHBondContact O-N 3.48Å
36K97.7Very high96.4Very high138 Ų13898.7 Ų98.760%0.652%0.519SS*.Hα-helixtrans-60.9-47.6174.1-176.5-175.6175.2-171.10111.6A32 E33 L34 L38 L39 D40A32-K36 WeakPolarHBondContact O-CB 3.06Å; A32-K36 PolarHBondContact O-N 3.14Å; E33-K36 PolarHBondContact O-N 2.82Å; L34-K36 VanDerWaalsContact C-N 3.31Å; L34-K36 PolarHBondContact O-N 2.79Å; K36-L38 VanDerWaalsContact C-N 3.33Å; K36-L38 PolarHBondContact O-N 3.37Å; K36-L39 WeakPolarHBondContact O-CB 3.34Å; K36-L39 PolarHBondContact O-N 3.46Å; K36-D40 WeakPolarHBondContact O-CB 3.31Å; K36-D40 PolarHBondContact O-N 3.34Å
37T96.9Very high96.8Very high89 Ų8999.1 Ų99.155%0.54653%0.525SS..Hα-helixtrans-63.1-39.3-179.8-55.90000111.9E33 L34 R41E33-T37 PolarHBondContact O-N 3.35Å; E33-T37 PolarHBondContact O-OG1 2.9Å; L34-T37 PolarHBondContact O-N 2.95Å; T37-R41 WeakPolarHBondContact O-CB 3.22Å; T37-R41 PolarHBondContact O-N 3.38Å
38L98.1Very high96.9Very high105 Ų10598 Ų9855%0.5552%0.524SS..Hα-helixtrans-67.2-39.9175.2-72.8173.8000111.8L34 G35 K36 N42L34-L38 HydrophobicContact CG-CD1 4.22Å; L34-L38 WeakPolarHBondContact O-CB 3.29Å; L34-L38 WeakPolarHBondContact O-CG 3.43Å; L34-L38 PolarHBondContact O-N 3.05Å; G35-L38 PolarHBondContact O-N 2.98Å; K36-L38 VanDerWaalsContact C-N 3.33Å; K36-L38 PolarHBondContact O-N 3.37Å; L38-N42 VanDerWaalsContact O-CB 3.27Å; L38-N42 WeakPolarHBondContact O-CB 3.39Å; L38-N42 PolarHBondContact O-N 3.33Å
39L98.2Very high97.1Very high114 Ų11496 Ų9660%0.59751%0.514SS*.Hα-helixtrans-64.1-48.6175.4-154102.1000110.5G35 K36 R41 N42 T43G35-L39 WeakPolarHBondContact O-CB 3.2Å; G35-L39 PolarHBondContact O-N 3.48Å; K36-L39 WeakPolarHBondContact O-CB 3.34Å; K36-L39 PolarHBondContact O-N 3.46Å; L39-R41 VanDerWaalsContact C-N 3.34Å; L39-R41 PolarHBondContact O-N 2.83Å; L39-N42 WeakPolarHBondContact O-CB 3.08Å; L39-N42 PolarHBondContact O-N 3.22Å; L39-T43 WeakPolarHBondContact O-CG2 3.29Å; L39-T43 PolarHBondContact O-N 3.42Å; L39-T43 PolarHBondContact O-OG1 2.91Å
40D97.4Very high97.3Very high69 Ų6997.3 Ų97.337%0.36952%0.52SS..Hα-helixtrans-57.3-48.2177.6-67.5-17.2000110.1K36 N42 T43 E44K36-D40 WeakPolarHBondContact O-CB 3.31Å; K36-D40 PolarHBondContact O-N 3.34Å; D40-N42 VanDerWaalsContact C-N 3.31Å; D40-N42 PolarHBondContact O-N 3.04Å; D40-T43 WeakPolarHBondContact CA-OG1 3.38Å; D40-T43 PolarHBondContact O-N 3.5Å; D40-T43 PolarHBondContact O-OG1 2.8Å; D40-E44 WeakPolarHBondContact O-CG 3.24Å; D40-E44 PolarHBondContact O-N 3.07Å
41R97.5Very high97.5Very high156 Ų15698.3 Ų98.359%0.58952%0.521SS*.Hα-helixtrans-61.4-37.7175.2-176.3175.9-178.2791.6112.9T37 L39 L45T37-R41 WeakPolarHBondContact O-CB 3.22Å; T37-R41 PolarHBondContact O-N 3.38Å; L39-R41 VanDerWaalsContact C-N 3.34Å; L39-R41 PolarHBondContact O-N 2.83Å; R41-L45 HydrophobicContact CG-CD1 4.44Å; R41-L45 VanDerWaalsContact O-CG 3.28Å; R41-L45 WeakPolarHBondContact O-CG 3.48Å; R41-L45 PolarHBondContact O-N 2.79Å; R41-L45 VanDerWaalsContact O-N 3.12Å
42N97.8Very high97.5Very high84 Ų8499.6 Ų99.645%0.44952%0.518SS..Hα-helixtrans-67.4-42.8177.5-173.1-115000110.8L38 L39 D40 E44 L45 E46L38-N42 VanDerWaalsContact O-CB 3.27Å; L38-N42 WeakPolarHBondContact O-CB 3.39Å; L38-N42 PolarHBondContact O-N 3.33Å; L39-N42 WeakPolarHBondContact O-CB 3.08Å; L39-N42 PolarHBondContact O-N 3.22Å; D40-N42 VanDerWaalsContact C-N 3.31Å; D40-N42 PolarHBondContact O-N 3.04Å; N42-E44 PolarHBondContact O-N 2.84Å; N42-L45 WeakPolarHBondContact O-CB 3.44Å; N42-L45 PolarHBondContact O-N 3.14Å; N42-E46 WeakPolarHBondContact O-CG 3.25Å; N42-E46 PolarHBondContact O-N 2.86Å; N42-E46 PolarHBondContact OD1-OE1 2.87Å
43T97.5Very high97.6Very high56 Ų56103.4 Ų103.434%0.34452%0.52SS..Hα-helixtrans-62.7-40.7174.658.60000112.5L39 D40 L45 E46 D47L39-T43 WeakPolarHBondContact O-CG2 3.29Å; L39-T43 PolarHBondContact O-N 3.42Å; L39-T43 PolarHBondContact O-OG1 2.91Å; D40-T43 WeakPolarHBondContact CA-OG1 3.38Å; D40-T43 PolarHBondContact O-N 3.5Å; D40-T43 PolarHBondContact O-OG1 2.8Å; T43-L45 VanDerWaalsContact C-N 3.31Å; T43-L45 PolarHBondContact O-N 3.27Å; T43-E46 PolarHBondContact O-N 3.25Å; T43-D47 WeakPolarHBondContact O-CB 3.47Å; T43-D47 PolarHBondContact O-N 3.36Å
44E97.9Very high97.7Very high128 Ų128100.7 Ų100.760%0.59851%0.512SS*.Hα-helixtrans-61.9-37.9174.6-72.9174.4-178.300112.5D40 N42 S48D40-E44 WeakPolarHBondContact O-CG 3.24Å; D40-E44 PolarHBondContact O-N 3.07Å; N42-E44 PolarHBondContact O-N 2.84Å; E44-S48 VanDerWaalsContact O-CB 3.29Å; E44-S48 WeakPolarHBondContact O-CB 3.49Å; E44-S48 PolarHBondContact O-N 3.4Å
45L97.9Very high97.8Very high100 Ų10098.1 Ų98.152%0.52450%0.501SS..Hα-helixtrans-69.2-39.9176.6-72.4171.7000111.6R41 N42 T43 S48 L49R41-L45 HydrophobicContact CG-CD1 4.44Å; R41-L45 VanDerWaalsContact O-CG 3.28Å; R41-L45 WeakPolarHBondContact O-CG 3.48Å; R41-L45 PolarHBondContact O-N 2.79Å; R41-L45 VanDerWaalsContact O-N 3.12Å; N42-L45 WeakPolarHBondContact O-CB 3.44Å; N42-L45 PolarHBondContact O-N 3.14Å; T43-L45 VanDerWaalsContact C-N 3.31Å; T43-L45 PolarHBondContact O-N 3.27Å; L45-S48 PolarHBondContact O-N 3.23Å; L45-L49 VanDerWaalsContact O-CB 3.3Å; L45-L49 WeakPolarHBondContact O-CB 3.44Å; L45-L49 PolarHBondContact O-N 3.47Å
46E97.6Very high97.8Very high110 Ų11099.8 Ų99.851%0.51450%0.501SS..Hα-helixtrans-62.9-46.5174.4-71.7177.1164.700111.2N42 T43 S48 L49 Q50N42-E46 WeakPolarHBondContact O-CG 3.25Å; N42-E46 PolarHBondContact O-N 2.86Å; N42-E46 PolarHBondContact OD1-OE1 2.87Å; T43-E46 PolarHBondContact O-N 3.25Å; E46-S48 PolarHBondContact O-N 2.83Å; E46-L49 PolarHBondContact O-N 3.38Å; E46-Q50 WeakPolarHBondContact O-CB 3.35Å; E46-Q50 PolarHBondContact O-N 2.96Å
47D97.9Very high97.9Very high110 Ų11098.3 Ų98.359%0.58850%0.496SS*.Hα-helixtrans-61.6-43.5176.4-77.4-16000111.6T43 L49 Q50 Q51T43-D47 WeakPolarHBondContact O-CB 3.47Å; T43-D47 PolarHBondContact O-N 3.36Å; D47-L49 VanDerWaalsContact C-N 3.35Å; D47-L49 PolarHBondContact O-N 3.4Å; D47-Q50 PolarHBondContact O-N 2.9Å; D47-Q51 WeakPolarHBondContact O-CB 3.45Å; D47-Q51 PolarHBondContact O-N 2.91Å
48S97.7Very high97.9Very high69 Ų6999.8 Ų99.848%0.48350%0.497SS..Hα-helixtrans-63.6-40.7176.8-177.10000111.9E44 L45 E46 Q51 M52E44-S48 VanDerWaalsContact O-CB 3.29Å; E44-S48 WeakPolarHBondContact O-CB 3.49Å; E44-S48 PolarHBondContact O-N 3.4Å; L45-S48 PolarHBondContact O-N 3.23Å; E46-S48 PolarHBondContact O-N 2.83Å; S48-Q51 PolarHBondContact O-N 3.37Å; S48-M52 PolarHBondContact O-N 3.23Å
49L97.9Very high97.9Very high85 Ų85100 Ų10045%0.44550%0.495SS..Hα-helixtrans-65.2-43.7175.8-178.568.5000110.9L45 E46 D47 Q51 M52 Y53L45-L49 VanDerWaalsContact O-CB 3.3Å; L45-L49 WeakPolarHBondContact O-CB 3.44Å; L45-L49 PolarHBondContact O-N 3.47Å; E46-L49 PolarHBondContact O-N 3.38Å; D47-L49 VanDerWaalsContact C-N 3.35Å; D47-L49 PolarHBondContact O-N 3.4Å; L49-Q51 VanDerWaalsContact C-N 3.34Å; L49-Q51 PolarHBondContact O-N 2.86Å; L49-M52 HydrophobicContact CD1-CE 3.75Å; L49-M52 WeakPolarHBondContact O-CB 3.36Å; L49-M52 PolarHBondContact O-N 3.45Å; L49-M52 VanDerWaalsContact O-N 3.15Å; L49-Y53 HydrophobicContact CD1-CD2 4.31Å; L49-Y53 HydrophobicContact CD1-CE2 3.77Å; L49-Y53 HydrophobicContact CD2-CE2 3.88Å; L49-Y53 HydrophobicContact CG-CD2 3.91Å; L49-Y53 HydrophobicContact CG-CE2 3.52Å; L49-Y53 WeakPolarHBondContact O-CD2 3.19Å; L49-Y53 PolarHBondContact O-N 3Å
50Q97.9Very high97.9Very high129 Ų12998.8 Ų98.860%0.60349%0.489SS*.Hα-helixtrans-63.2-41.1177.5-171.9165.7-14.300111.4E46 D47 M52 Y53 T54E46-Q50 WeakPolarHBondContact O-CB 3.35Å; E46-Q50 PolarHBondContact O-N 2.96Å; D47-Q50 PolarHBondContact O-N 2.9Å; Q50-M52 VanDerWaalsContact C-N 3.32Å; Q50-M52 PolarHBondContact O-N 3.38Å; Q50-Y53 PolarHBondContact O-N 2.99Å; Q50-T54 WeakPolarHBondContact O-CG2 3.35Å; Q50-T54 PolarHBondContact O-N 3.36Å; Q50-T54 PolarHBondContact O-OG1 3.42Å
51Q98.2Very high97.9Very high128 Ų128100.9 Ų100.960%0.59850%0.496SS*.Hα-helixtrans-62.1-39.5172.7-172.6-177.815.900112.2D47 S48 L49 T54 T55D47-Q51 WeakPolarHBondContact O-CB 3.45Å; D47-Q51 PolarHBondContact O-N 2.91Å; S48-Q51 PolarHBondContact O-N 3.37Å; L49-Q51 VanDerWaalsContact C-N 3.34Å; L49-Q51 PolarHBondContact O-N 2.86Å; Q51-T54 WeakPolarHBondContact CA-OG1 3.41Å; Q51-T54 PolarHBondContact O-N 2.88Å; Q51-T54 PolarHBondContact O-OG1 2.86Å; Q51-T55 WeakPolarHBondContact O-CB 3.47Å; Q51-T55 VanDerWaalsContact O-CG2 3.32Å; Q51-T55 WeakPolarHBondContact O-CG2 3.43Å; Q51-T55 PolarHBondContact O-N 3.19Å; Q51-T55 PolarHBondContact O-OG1 2.89Å
52M97.3Very high98Very high86 Ų8699.2 Ų99.242%0.42450%0.495SS..Hα-helixtrans-62.7-43.6174.4-173-77.7-60.200110.8S48 L49 Q50 T54 T55 N56S48-M52 PolarHBondContact O-N 3.23Å; L49-M52 HydrophobicContact CD1-CE 3.75Å; L49-M52 WeakPolarHBondContact O-CB 3.36Å; L49-M52 PolarHBondContact O-N 3.45Å; L49-M52 VanDerWaalsContact O-N 3.15Å; Q50-M52 VanDerWaalsContact C-N 3.32Å; Q50-M52 PolarHBondContact O-N 3.38Å; M52-T54 PolarHBondContact O-N 3.48Å; M52-T55 WeakPolarHBondContact CA-OG1 3.29Å; M52-T55 PolarHBondContact O-N 2.97Å; M52-T55 PolarHBondContact O-OG1 2.95Å; M52-N56 VanDerWaalsContact O-CB 3.29Å; M52-N56 WeakPolarHBondContact O-CB 3.24Å; M52-N56 PolarHBondContact O-N 3.26Å; M52-N56 HydrophobicContact SD-CB 4.47Å
53Y98.3Very high98Very high146 Ų146100 Ų10057%0.57350%0.498SS*.Hα-helixtrans-61.6-43.7175.1-78.1-61000113L49 Q50 N56 Q57L49-Y53 HydrophobicContact CD1-CD2 4.31Å; L49-Y53 HydrophobicContact CD1-CE2 3.77Å; L49-Y53 HydrophobicContact CD2-CE2 3.88Å; L49-Y53 HydrophobicContact CG-CD2 3.91Å; L49-Y53 HydrophobicContact CG-CE2 3.52Å; L49-Y53 WeakPolarHBondContact O-CD2 3.19Å; L49-Y53 PolarHBondContact O-N 3Å; Q50-Y53 PolarHBondContact O-N 2.99Å; Y53-N56 PolarHBondContact O-N 3.44Å; Y53-Q57 WeakPolarHBondContact O-CB 3.3Å; Y53-Q57 PolarHBondContact O-N 3.38Å
54T98.2Very high98Very high69 Ų69102.2 Ų102.242%0.42351%0.505SS..Hα-helixtrans-65.2-44.1178.556.90000111.6Q50 Q51 M52 N56 Q57 E58Q50-T54 WeakPolarHBondContact O-CG2 3.35Å; Q50-T54 PolarHBondContact O-N 3.36Å; Q50-T54 PolarHBondContact O-OG1 3.42Å; Q51-T54 WeakPolarHBondContact CA-OG1 3.41Å; Q51-T54 PolarHBondContact O-N 2.88Å; Q51-T54 PolarHBondContact O-OG1 2.86Å; M52-T54 PolarHBondContact O-N 3.48Å; T54-N56 VanDerWaalsContact C-N 3.34Å; T54-N56 PolarHBondContact O-N 3.34Å; T54-Q57 PolarHBondContact O-N 2.86Å; T54-E58 WeakPolarHBondContact O-CG 3.36Å; T54-E58 PolarHBondContact O-N 2.94Å
55T98.1Very high98Very high53 Ų53103.2 Ų103.233%0.32550%0.504SS..Hα-helixtrans-66.3-37178.253.20000112.1Q51 M52 E58 Q59Q51-T55 WeakPolarHBondContact O-CB 3.47Å; Q51-T55 VanDerWaalsContact O-CG2 3.32Å; Q51-T55 WeakPolarHBondContact O-CG2 3.43Å; Q51-T55 PolarHBondContact O-N 3.19Å; Q51-T55 PolarHBondContact O-OG1 2.89Å; M52-T55 WeakPolarHBondContact CA-OG1 3.29Å; M52-T55 PolarHBondContact O-N 2.97Å; M52-T55 PolarHBondContact O-OG1 2.95Å; T55-E58 PolarHBondContact O-N 3.33Å; T55-Q59 VanDerWaalsContact O-CG 3.28Å; T55-Q59 WeakPolarHBondContact O-CG 3.21Å; T55-Q59 PolarHBondContact O-N 3.02Å
56N98.3Very high98.1Very high72 Ų72102.2 Ų102.239%0.38550%0.499SS..Hα-helixtrans-63.1-42.7173.9-171.1-96000111.5M52 Y53 T54 E58 Q59 L60M52-N56 VanDerWaalsContact O-CB 3.29Å; M52-N56 WeakPolarHBondContact O-CB 3.24Å; M52-N56 PolarHBondContact O-N 3.26Å; M52-N56 HydrophobicContact SD-CB 4.47Å; Y53-N56 PolarHBondContact O-N 3.44Å; T54-N56 VanDerWaalsContact C-N 3.34Å; T54-N56 PolarHBondContact O-N 3.34Å; N56-E58 PolarHBondContact O-N 3.29Å; N56-Q59 WeakPolarHBondContact O-CB 3.36Å; N56-Q59 PolarHBondContact O-N 3.47Å; N56-L60 WeakPolarHBondContact O-CG 3.34Å; N56-L60 PolarHBondContact O-N 2.89Å
57Q98.3Very high98.1Very high106 Ų106101 Ų10150%0.49550%0.499SS..Hα-helixtrans-62.5-42.1176.9-171.364.227.300112.2Y53 T54 L60 Q61Y53-Q57 WeakPolarHBondContact O-CB 3.3Å; Y53-Q57 PolarHBondContact O-N 3.38Å; T54-Q57 PolarHBondContact O-N 2.86Å; Q57-L60 PolarHBondContact O-N 3.42Å; Q57-Q61 WeakPolarHBondContact O-CG 3.29Å; Q57-Q61 PolarHBondContact O-N 2.86Å; Q57-Q61 VanDerWaalsContact O-N 3.1Å
58E97.7Very high98.1Very high121 Ų121101.8 Ų101.857%0.56550%0.497SS*.Hα-helixtrans-62.1-43.2174.8-71.2171.9179.300111.6T54 T55 N56 L60 Q61 E62T54-E58 WeakPolarHBondContact O-CG 3.36Å; T54-E58 PolarHBondContact O-N 2.94Å; T55-E58 PolarHBondContact O-N 3.33Å; N56-E58 PolarHBondContact O-N 3.29Å; E58-L60 VanDerWaalsContact C-N 3.34Å; E58-L60 PolarHBondContact O-N 3.47Å; E58-Q61 WeakPolarHBondContact O-CB 3.48Å; E58-Q61 PolarHBondContact O-N 3.04Å; E58-E62 PolarHBondContact O-N 2.96Å
59Q98.1Very high98.1Very high110 Ų110102.9 Ų102.951%0.51450%0.495SS..Hα-helixtrans-62.1-40.2176-73.7173.3-9.900112.1T55 N56 Q61 E62 I63T55-Q59 VanDerWaalsContact O-CG 3.28Å; T55-Q59 WeakPolarHBondContact O-CG 3.21Å; T55-Q59 PolarHBondContact O-N 3.02Å; N56-Q59 WeakPolarHBondContact O-CB 3.36Å; N56-Q59 PolarHBondContact O-N 3.47Å; Q59-Q61 VanDerWaalsContact C-N 3.33Å; Q59-Q61 PolarHBondContact O-N 3.43Å; Q59-E62 PolarHBondContact O-N 3.27Å; Q59-I63 VanDerWaalsContact O-CG1 3.27Å; Q59-I63 WeakPolarHBondContact O-CG1 3.24Å; Q59-I63 PolarHBondContact O-N 3Å
60L98.4Very high98.2Very high87 Ų87103.4 Ų103.446%0.45550%0.502SS..Hα-helixtrans-62.5-41.4175.6-72.4173.1000111.6N56 Q57 E58 I63 E64N56-L60 WeakPolarHBondContact O-CG 3.34Å; N56-L60 PolarHBondContact O-N 2.89Å; Q57-L60 PolarHBondContact O-N 3.42Å; E58-L60 VanDerWaalsContact C-N 3.34Å; E58-L60 PolarHBondContact O-N 3.47Å; L60-I63 PolarHBondContact O-N 3.05Å; L60-E64 PolarHBondContact O-N 2.91Å
61Q98Very high98.2Very high113 Ų113100.7 Ų100.753%0.52849%0.489SS..Hα-helixtrans-64.3-40175.2-69.5174.4-5.700112.1Q57 E58 Q59 E64 Y65Q57-Q61 WeakPolarHBondContact O-CG 3.29Å; Q57-Q61 PolarHBondContact O-N 2.86Å; Q57-Q61 VanDerWaalsContact O-N 3.1Å; E58-Q61 WeakPolarHBondContact O-CB 3.48Å; E58-Q61 PolarHBondContact O-N 3.04Å; Q59-Q61 VanDerWaalsContact C-N 3.33Å; Q59-Q61 PolarHBondContact O-N 3.43Å; Q61-E64 PolarHBondContact O-N 2.91Å; Q61-Y65 PolarHBondContact O-N 3.38Å
62E98.2Very high98.2Very high121 Ų121100 Ų10057%0.56549%0.489SS*.Hα-helixtrans-63.6-45175.3-175.5177.5-175.800111.5E58 Q59 E64 Y65 L66E58-E62 PolarHBondContact O-N 2.96Å; Q59-E62 PolarHBondContact O-N 3.27Å; E62-E64 VanDerWaalsContact C-N 3.3Å; E62-E64 PolarHBondContact O-N 2.95Å; E62-Y65 PolarHBondContact O-N 3.43Å; E62-L66 HydrophobicContact CG-CD1 4.01Å; E62-L66 HydrophobicContact CG-CG 4.41Å; E62-L66 WeakPolarHBondContact O-CB 3.49Å; E62-L66 WeakPolarHBondContact O-CG 3.49Å; E62-L66 PolarHBondContact O-N 2.86Å
63I97.9Very high98.2Very high101 Ų101100.8 Ų100.852%0.51849%0.494SS..Hα-helixtrans-59.1-44.4175.9-69.7165.1000110.2Q59 L60 L66 T67Q59-I63 VanDerWaalsContact O-CG1 3.27Å; Q59-I63 WeakPolarHBondContact O-CG1 3.24Å; Q59-I63 PolarHBondContact O-N 3Å; L60-I63 PolarHBondContact O-N 3.05Å; I63-L66 PolarHBondContact O-N 3.41Å; I63-T67 VanDerWaalsContact O-CB 3.28Å; I63-T67 WeakPolarHBondContact O-CB 3.33Å; I63-T67 PolarHBondContact O-N 3.02Å; I63-T67 PolarHBondContact O-OG1 3.43Å
64E98.4Very high98.2Very high103 Ų10399.8 Ų99.848%0.48149%0.489SS..Hα-helixtrans-63-44.4178.5-167.2-171.3161.100111.7L60 Q61 E62 T67 K68L60-E64 PolarHBondContact O-N 2.91Å; Q61-E64 PolarHBondContact O-N 2.91Å; E62-E64 VanDerWaalsContact C-N 3.3Å; E62-E64 PolarHBondContact O-N 2.95Å; E64-T67 PolarHBondContact O-N 2.97Å; E64-K68 WeakPolarHBondContact O-CG 3.19Å; E64-K68 PolarHBondContact O-N 2.98Å; E64-K68 WeakPolarHBondContact OE1-CE 3.33Å; E64-K68 IonicContact OE1-NZ 2.65Å; E64-K68 PolarHBondContact OE1-NZ 3.46Å
65Y98.5Very high98.2Very high149 Ų149100.9 Ų100.958%0.58449%0.49SS*.Hα-helixtrans-61.5-47.6176.8176.5-97.1000112.1Q61 E62 T67 K68 Q69Q61-Y65 PolarHBondContact O-N 3.38Å; E62-Y65 PolarHBondContact O-N 3.43Å; Y65-T67 VanDerWaalsContact C-N 3.3Å; Y65-T67 PolarHBondContact O-N 2.88Å; Y65-K68 PolarHBondContact O-N 2.85Å; Y65-Q69 PolarHBondContact O-N 3.24Å
66L98.6Very high98.2Very high78 Ų78102.1 Ų102.141%0.40849%0.492SS..Hα-helixtrans-63.4-38.7177.3-70.1173.9000111.4E62 I63 Q69 V70E62-L66 HydrophobicContact CG-CD1 4.01Å; E62-L66 HydrophobicContact CG-CG 4.41Å; E62-L66 WeakPolarHBondContact O-CB 3.49Å; E62-L66 WeakPolarHBondContact O-CG 3.49Å; E62-L66 PolarHBondContact O-N 2.86Å; I63-L66 PolarHBondContact O-N 3.41Å; L66-Q69 PolarHBondContact O-N 2.81Å; L66-V70 WeakPolarHBondContact O-CG2 3.49Å; L66-V70 PolarHBondContact O-N 2.7Å
67T97.9Very high98.2Very high85 Ų85103.6 Ų103.652%0.52150%0.5SS..Hα-helixtrans-62-45.4175.8-58.40000110.9I63 E64 Y65 Q69 V70 E71I63-T67 VanDerWaalsContact O-CB 3.28Å; I63-T67 WeakPolarHBondContact O-CB 3.33Å; I63-T67 PolarHBondContact O-N 3.02Å; I63-T67 PolarHBondContact O-OG1 3.43Å; E64-T67 PolarHBondContact O-N 2.97Å; Y65-T67 VanDerWaalsContact C-N 3.3Å; Y65-T67 PolarHBondContact O-N 2.88Å; T67-Q69 VanDerWaalsContact C-N 3.33Å; T67-Q69 PolarHBondContact O-N 3.47Å; T67-V70 PolarHBondContact O-N 2.92Å; T67-E71 PolarHBondContact O-N 2.8Å
68K98.5Very high98.2Very high126 Ų126102.5 Ų102.555%0.54850%0.495SS..Hα-helixtrans-60.8-41.4174.6-72.6173-176.41680111.9E64 Y65 E71 L72E64-K68 WeakPolarHBondContact O-CG 3.19Å; E64-K68 PolarHBondContact O-N 2.98Å; E64-K68 WeakPolarHBondContact OE1-CE 3.33Å; E64-K68 IonicContact OE1-NZ 2.65Å; E64-K68 PolarHBondContact OE1-NZ 3.46Å; Y65-K68 PolarHBondContact O-N 2.85Å; K68-E71 PolarHBondContact O-N 3.22Å; K68-L72 PolarHBondContact O-N 2.76Å
69Q98.4Very high98.2Very high93 Ų93102 Ų10244%0.43549%0.493SS..Hα-helixtrans-63.7-42.5177.2-171.1176.539.600111.9Y65 L66 T67 L72 L73Y65-Q69 PolarHBondContact O-N 3.24Å; L66-Q69 PolarHBondContact O-N 2.81Å; T67-Q69 VanDerWaalsContact C-N 3.33Å; T67-Q69 PolarHBondContact O-N 3.47Å; Q69-L72 PolarHBondContact O-N 3.49Å; Q69-L73 WeakPolarHBondContact O-CG 3.48Å; Q69-L73 PolarHBondContact O-N 3.01Å
70V98.2Very high98.2Very high96 Ų96100.7 Ų100.758%0.58249%0.487SS*.Hα-helixtrans-65.2-41.3176.3170.50000111.3L66 T67 L72 L73 R74L66-V70 WeakPolarHBondContact O-CG2 3.49Å; L66-V70 PolarHBondContact O-N 2.7Å; T67-V70 PolarHBondContact O-N 2.92Å; V70-L72 PolarHBondContact O-N 3.09Å; V70-L73 PolarHBondContact O-N 3.08Å; V70-R74 PolarHBondContact O-N 3.34Å
71E98.2Very high98.2Very high72 Ų7299 Ų9934%0.33649%0.486SS..Hα-helixtrans-64.5-40.3177.7-176.554.9-151.700111.7T67 K68 L73 R74 Q75T67-E71 PolarHBondContact O-N 2.8Å; K68-E71 PolarHBondContact O-N 3.22Å; E71-L73 PolarHBondContact O-N 3.47Å; E71-R74 WeakPolarHBondContact O-CB 3.31Å; E71-R74 PolarHBondContact O-N 3.41Å; E71-R74 IonicContact OE1-CZ 3.01Å; E71-R74 IonicContact OE1-NE 3.38Å; E71-R74 PolarHBondContact OE1-NE 3.23Å; E71-R74 IonicContact OE1-NH2 3.19Å; E71-R74 PolarHBondContact OE1-NH2 3.41Å; E71-R74 IonicContact OE2-CZ 3.33Å; E71-R74 IonicContact OE2-NE 3.05Å; E71-R74 PolarHBondContact OE2-NE 3.24Å; E71-R74 IonicContact OE2-NH2 3.99Å; E71-Q75 WeakPolarHBondContact O-CG 3.45Å; E71-Q75 PolarHBondContact O-N 3.31Å; E71-Q75 PolarHBondContact OE1-NE2 3.42Å
72L98.3Very high98.2Very high114 Ų11498.4 Ų98.460%0.59748%0.481SS*.Hα-helixtrans-62-42.7173.5-17963.1000111.9K68 Q69 V70 R74 Q75 M76K68-L72 PolarHBondContact O-N 2.76Å; Q69-L72 PolarHBondContact O-N 3.49Å; V70-L72 PolarHBondContact O-N 3.09Å; L72-R74 VanDerWaalsContact C-N 3.31Å; L72-R74 PolarHBondContact O-N 3.35Å; L72-Q75 PolarHBondContact O-N 2.99Å; L72-M76 WeakPolarHBondContact O-CB 3.46Å; L72-M76 PolarHBondContact O-N 3.16Å
73L98.3Very high98.2Very high101 Ų10197.2 Ų97.253%0.52948%0.482SS..Hα-helixtrans-63.3-37.8175.1-72.4172.3000111.7Q69 V70 E71 M76 N77Q69-L73 WeakPolarHBondContact O-CG 3.48Å; Q69-L73 PolarHBondContact O-N 3.01Å; V70-L73 PolarHBondContact O-N 3.08Å; E71-L73 PolarHBondContact O-N 3.47Å; L73-M76 PolarHBondContact O-N 3.18Å; L73-N77 WeakPolarHBondContact O-CB 3.44Å; L73-N77 PolarHBondContact O-N 2.95Å
74R98.3Very high98.2Very high125 Ų12599.9 Ų99.947%0.47249%0.487SS..Hα-helixtrans-61.9-47.6174.3-166-170.673.273.73110.8V70 E71 L72 N77 E78V70-R74 PolarHBondContact O-N 3.34Å; E71-R74 WeakPolarHBondContact O-CB 3.31Å; E71-R74 PolarHBondContact O-N 3.41Å; E71-R74 IonicContact OE1-CZ 3.01Å; E71-R74 IonicContact OE1-NE 3.38Å; E71-R74 PolarHBondContact OE1-NE 3.23Å; E71-R74 IonicContact OE1-NH2 3.19Å; E71-R74 PolarHBondContact OE1-NH2 3.41Å; E71-R74 IonicContact OE2-CZ 3.33Å; E71-R74 IonicContact OE2-NE 3.05Å; E71-R74 PolarHBondContact OE2-NE 3.24Å; E71-R74 IonicContact OE2-NH2 3.99Å; L72-R74 VanDerWaalsContact C-N 3.31Å; L72-R74 PolarHBondContact O-N 3.35Å; R74-N77 PolarHBondContact O-N 3.47Å; R74-E78 IonicContact CZ-OE2 2.75Å; R74-E78 IonicContact NH1-OE2 3.95Å; R74-E78 PolarHBondContact NH1-OE2 2.8Å; R74-E78 WeakPolarHBondContact O-CB 3.36Å; R74-E78 PolarHBondContact O-N 3.4Å
75Q98Very high98.2Very high93 Ų93101.2 Ų101.244%0.43549%0.493SS..Hα-helixtrans-61-46.3177.1-70.41731200111.8E71 L72 N77 E78 Q79E71-Q75 WeakPolarHBondContact O-CG 3.45Å; E71-Q75 PolarHBondContact O-N 3.31Å; E71-Q75 PolarHBondContact OE1-NE2 3.42Å; L72-Q75 PolarHBondContact O-N 2.99Å; Q75-N77 VanDerWaalsContact C-N 3.33Å; Q75-N77 PolarHBondContact O-N 3.29Å; Q75-E78 PolarHBondContact O-N 2.82Å; Q75-Q79 WeakPolarHBondContact O-CG 3.25Å; Q75-Q79 PolarHBondContact O-N 2.92Å
76M97.9Very high98.2Very high78 Ų7899.6 Ų99.638%0.38449%0.491SS..Hα-helixtrans-59.2-44.4176.3-176.9-129.567.700111.4L72 L73 E78 Q79 H80L72-M76 WeakPolarHBondContact O-CB 3.46Å; L72-M76 PolarHBondContact O-N 3.16Å; L73-M76 PolarHBondContact O-N 3.18Å; M76-E78 VanDerWaalsContact C-N 3.31Å; M76-E78 PolarHBondContact O-N 3.34Å; M76-Q79 PolarHBondContact O-N 2.94Å; M76-H80 WeakPolarHBondContact CE-CE1 3.39Å; M76-H80 WeakPolarHBondContact CE-ND1 3.43Å; M76-H80 PolarHBondContact O-CD2 2.88Å; M76-H80 VanDerWaalsContact O-CD2 3.28Å; M76-H80 PolarHBondContact O-N 3.44Å; M76-H80 PolarHBondContact SD-CE1 3.04Å
77N97.6Very high98.2Very high104 Ų104101.1 Ų101.156%0.55650%0.498SS*.Hα-helixtrans-65-37.9178.6-165.725.4000111.6L73 R74 Q75 Q79 H80 A81L73-N77 WeakPolarHBondContact O-CB 3.44Å; L73-N77 PolarHBondContact O-N 2.95Å; R74-N77 PolarHBondContact O-N 3.47Å; Q75-N77 VanDerWaalsContact C-N 3.33Å; Q75-N77 PolarHBondContact O-N 3.29Å; N77-Q79 VanDerWaalsContact C-N 3.35Å; N77-H80 PolarHBondContact O-N 3.04Å; N77-A81 PolarHBondContact O-N 3.43Å
78E98.1Very high98.2Very high82 Ų82101 Ų10138%0.38349%0.494SS..Hα-helixtrans-64.9-37.9174.4-166.1176.4146.900112.1R74 Q75 M76 A81 K82R74-E78 IonicContact CZ-OE2 2.75Å; R74-E78 IonicContact NH1-OE2 3.95Å; R74-E78 PolarHBondContact NH1-OE2 2.8Å; R74-E78 WeakPolarHBondContact O-CB 3.36Å; R74-E78 PolarHBondContact O-N 3.4Å; Q75-E78 PolarHBondContact O-N 2.82Å; M76-E78 VanDerWaalsContact C-N 3.31Å; M76-E78 PolarHBondContact O-N 3.34Å; E78-A81 PolarHBondContact O-N 2.97Å; E78-K82 WeakPolarHBondContact O-CG 3.3Å; E78-K82 PolarHBondContact O-N 3.46Å; E78-K82 VanDerWaalsContact O-N 3.13Å; E78-K82 IonicContact OE1-NZ 3.17Å; E78-K82 PolarHBondContact OE1-NZ 2.85Å
79Q98.2Very high98.2Very high110 Ų11097 Ų9751%0.51448%0.48SS..Hα-helixtrans-65.3-42.1171.8-63.5-58.1-29.300111.7Q75 M76 N77 A81 K82 V83Q75-Q79 WeakPolarHBondContact O-CG 3.25Å; Q75-Q79 PolarHBondContact O-N 2.92Å; M76-Q79 PolarHBondContact O-N 2.94Å; N77-Q79 VanDerWaalsContact C-N 3.35Å; Q79-A81 VanDerWaalsContact C-N 3.34Å; Q79-A81 PolarHBondContact O-N 3.21Å; Q79-K82 PolarHBondContact O-N 3.14Å; Q79-V83 WeakPolarHBondContact O-CG2 3.38Å; Q79-V83 PolarHBondContact O-N 3.34Å
80H98.1Very high98.1Very high83 Ų8394.8 Ų94.838%0.38447%0.474SS..Hα-helixtrans-60.9-43.3175.8-70.5-170.7000111.5M76 N77 K82 V83 Y84M76-H80 WeakPolarHBondContact CE-CE1 3.39Å; M76-H80 WeakPolarHBondContact CE-ND1 3.43Å; M76-H80 PolarHBondContact O-CD2 2.88Å; M76-H80 VanDerWaalsContact O-CD2 3.28Å; M76-H80 PolarHBondContact O-N 3.44Å; M76-H80 PolarHBondContact SD-CE1 3.04Å; N77-H80 PolarHBondContact O-N 3.04Å; H80-K82 VanDerWaalsContact C-N 3.34Å; H80-K82 PolarHBondContact O-N 3.43Å; H80-V83 PolarHBondContact O-N 3.37Å; H80-Y84 HydrophobicContact CB-CE2 4.15Å; H80-Y84 WeakPolarHBondContact O-CD2 3.4Å; H80-Y84 PolarHBondContact O-N 3.47Å
81A97.9Very high98.1Very high53 Ų5392 Ų9244%0.43846%0.461SS..Hα-helixtrans-57.9-44.8175.500000112N77 E78 Q79 V83 Y84 E85N77-A81 PolarHBondContact O-N 3.43Å; E78-A81 PolarHBondContact O-N 2.97Å; Q79-A81 VanDerWaalsContact C-N 3.34Å; Q79-A81 PolarHBondContact O-N 3.21Å; A81-V83 PolarHBondContact O-N 2.88Å; A81-Y84 PolarHBondContact O-N 2.78Å; A81-E85 PolarHBondContact O-N 3.49Å
82K98.4Very high98.1Very high99 Ų9994.2 Ų94.243%0.4347%0.466SS..Hα-helixtrans-61.6-41.9176.1-71170.2-174.1167.30112.5E78 Q79 H80 E85 Q86E78-K82 WeakPolarHBondContact O-CG 3.3Å; E78-K82 PolarHBondContact O-N 3.46Å; E78-K82 VanDerWaalsContact O-N 3.13Å; E78-K82 IonicContact OE1-NZ 3.17Å; E78-K82 PolarHBondContact OE1-NZ 2.85Å; Q79-K82 PolarHBondContact O-N 3.14Å; H80-K82 VanDerWaalsContact C-N 3.34Å; H80-K82 PolarHBondContact O-N 3.43Å; K82-E85 PolarHBondContact O-N 2.87Å; K82-Q86 WeakPolarHBondContact O-CB 3.45Å; K82-Q86 PolarHBondContact O-N 3.34Å
83V98.5Very high98.1Very high96 Ų9693.9 Ų93.958%0.58246%0.461SS*.Hα-helixtrans-65.6-40.9176.8172.50000111.1Q79 H80 A81 Q86 L87Q79-V83 WeakPolarHBondContact O-CG2 3.38Å; Q79-V83 PolarHBondContact O-N 3.34Å; H80-V83 PolarHBondContact O-N 3.37Å; A81-V83 PolarHBondContact O-N 2.88Å; V83-Q86 PolarHBondContact O-N 2.98Å; V83-L87 WeakPolarHBondContact O-CB 3.47Å; V83-L87 PolarHBondContact O-N 3.35Å
84Y98.4Very high98.1Very high158 Ų15894.8 Ų94.862%0.6247%0.466SS*.Hα-helixtrans-65.1-41.6176.1-69.5-48.1000112.4H80 A81 L87 D88H80-Y84 HydrophobicContact CB-CE2 4.15Å; H80-Y84 WeakPolarHBondContact O-CD2 3.4Å; H80-Y84 PolarHBondContact O-N 3.47Å; A81-Y84 PolarHBondContact O-N 2.78Å; Y84-L87 PolarHBondContact O-N 3.43Å; Y84-D88 WeakPolarHBondContact O-CB 3.28Å; Y84-D88 PolarHBondContact O-N 3.03Å
85E97.6Very high98.1Very high131 Ų13194.5 Ų94.561%0.61247%0.47SS*.Hα-helixtrans-61.6-45.6174.7-174.9176.3-172.500111.4A81 K82 L87 D88 V89A81-E85 PolarHBondContact O-N 3.49Å; K82-E85 PolarHBondContact O-N 2.87Å; E85-L87 VanDerWaalsContact C-N 3.34Å; E85-L87 PolarHBondContact O-N 3.41Å; E85-D88 PolarHBondContact O-N 2.9Å; E85-V89 WeakPolarHBondContact O-CG2 3.4Å; E85-V89 PolarHBondContact O-N 3.43Å
86Q98.6Very high98.1Very high115 Ų11596.7 Ų96.754%0.53748%0.48SS..Hα-helixtrans-61.4-42.7176-174.461.950.800111.8K82 V83 D88 V89 T90K82-Q86 WeakPolarHBondContact O-CB 3.45Å; K82-Q86 PolarHBondContact O-N 3.34Å; V83-Q86 PolarHBondContact O-N 2.98Å; Q86-D88 VanDerWaalsContact C-N 3.34Å; Q86-D88 PolarHBondContact O-N 2.91Å; Q86-V89 PolarHBondContact O-N 3.25Å; Q86-T90 WeakPolarHBondContact O-CG2 3.28Å; Q86-T90 PolarHBondContact O-N 3.2Å; Q86-T90 PolarHBondContact O-OG1 2.91Å
87L98.5Very high98.1Very high109 Ų10996.4 Ų96.457%0.57148%0.483SS*.Hα-helixtrans-61.9-43.6177.4-17666000111V83 Y84 E85 T90 A91V83-L87 WeakPolarHBondContact O-CB 3.47Å; V83-L87 PolarHBondContact O-N 3.35Å; Y84-L87 PolarHBondContact O-N 3.43Å; E85-L87 VanDerWaalsContact C-N 3.34Å; E85-L87 PolarHBondContact O-N 3.41Å; L87-T90 WeakPolarHBondContact CA-OG1 3.3Å; L87-T90 PolarHBondContact O-N 3.34Å; L87-T90 PolarHBondContact O-OG1 3.19Å; L87-A91 WeakPolarHBondContact O-CB 3.48Å; L87-A91 PolarHBondContact O-N 3.03Å
88D98.2Very high98.1Very high82 Ų8296.1 Ų96.144%0.43948%0.482SS..Hα-helixtrans-64-41.1178.1-171.127.8000111.8Y84 E85 Q86 A91 R92Y84-D88 WeakPolarHBondContact O-CB 3.28Å; Y84-D88 PolarHBondContact O-N 3.03Å; E85-D88 PolarHBondContact O-N 2.9Å; Q86-D88 VanDerWaalsContact C-N 3.34Å; Q86-D88 PolarHBondContact O-N 2.91Å; D88-A91 PolarHBondContact O-N 2.73Å; D88-R92 WeakPolarHBondContact O-CB 3.41Å; D88-R92 WeakPolarHBondContact O-CG 3.4Å; D88-R92 PolarHBondContact O-N 3.43Å; D88-R92 PolarHBondContact O-NE 3.4Å; D88-R92 IonicContact OD1-CZ 2.78Å; D88-R92 IonicContact OD1-NE 3.81Å; D88-R92 PolarHBondContact OD1-NE 2.89Å; D88-R92 IonicContact OD1-NH2 3.82Å; D88-R92 IonicContact OD2-CZ 2.76Å; D88-R92 IonicContact OD2-NE 2.62Å; D88-R92 PolarHBondContact OD2-NE 3.16Å; D88-R92 IonicContact OD2-NH2 3.34Å; D88-R92 PolarHBondContact OD2-NH2 3Å
89V98.1Very high98.1Very high42 Ų4298.8 Ų98.826%0.25549%0.494SS..Hα-helixtrans-59.5-50.4171.8173.40000111.1E85 Q86 A91 R92 E93E85-V89 WeakPolarHBondContact O-CG2 3.4Å; E85-V89 PolarHBondContact O-N 3.43Å; Q86-V89 PolarHBondContact O-N 3.25Å; V89-A91 VanDerWaalsContact C-N 3.32Å; V89-A91 PolarHBondContact O-N 3.31Å; V89-R92 PolarHBondContact O-N 2.94Å; V89-E93 HydrophobicContact CG1-CG 4.47Å; V89-E93 WeakPolarHBondContact CG1-OE1 3.39Å; V89-E93 WeakPolarHBondContact O-CG 3.35Å; V89-E93 PolarHBondContact O-N 2.86Å
90T97.6Very high98.2Very high47 Ų47100.3 Ų100.329%0.28850%0.499SS..Hα-helixtrans-64.4-35.8-179.959.30000112.9Q86 L87 E93 L94Q86-T90 WeakPolarHBondContact O-CG2 3.28Å; Q86-T90 PolarHBondContact O-N 3.2Å; Q86-T90 PolarHBondContact O-OG1 2.91Å; L87-T90 WeakPolarHBondContact CA-OG1 3.3Å; L87-T90 PolarHBondContact O-N 3.34Å; L87-T90 PolarHBondContact O-OG1 3.19Å; T90-E93 PolarHBondContact O-N 3.11Å; T90-L94 WeakPolarHBondContact O-CB 3.38Å; T90-L94 VanDerWaalsContact O-CG 3.24Å; T90-L94 WeakPolarHBondContact O-CG 3.45Å; T90-L94 PolarHBondContact O-N 3.49Å
91A97.4Very high98.2Very high38 Ų38102 Ų10231%0.31451%0.51SS..Hα-helixtrans-63.6-45.7175.900000110.8L87 D88 V89 L94 E95L87-A91 WeakPolarHBondContact O-CB 3.48Å; L87-A91 PolarHBondContact O-N 3.03Å; D88-A91 PolarHBondContact O-N 2.73Å; V89-A91 VanDerWaalsContact C-N 3.32Å; V89-A91 PolarHBondContact O-N 3.31Å; A91-L94 PolarHBondContact O-N 2.92Å; A91-E95 WeakPolarHBondContact O-CG 3.35Å; A91-E95 PolarHBondContact O-N 3.1Å
92R97.9Very high98.2Very high118 Ų118102.5 Ų102.545%0.44551%0.508SS..Hα-helixtrans-62.7-42.1176.5-72.8-175.4-104.5111.4-16.4112.6D88 V89 L94 E95 E96D88-R92 WeakPolarHBondContact O-CB 3.41Å; D88-R92 WeakPolarHBondContact O-CG 3.4Å; D88-R92 PolarHBondContact O-N 3.43Å; D88-R92 PolarHBondContact O-NE 3.4Å; D88-R92 IonicContact OD1-CZ 2.78Å; D88-R92 IonicContact OD1-NE 3.81Å; D88-R92 PolarHBondContact OD1-NE 2.89Å; D88-R92 IonicContact OD1-NH2 3.82Å; D88-R92 IonicContact OD2-CZ 2.76Å; D88-R92 IonicContact OD2-NE 2.62Å; D88-R92 PolarHBondContact OD2-NE 3.16Å; D88-R92 IonicContact OD2-NH2 3.34Å; D88-R92 PolarHBondContact OD2-NH2 3Å; V89-R92 PolarHBondContact O-N 2.94Å; R92-L94 PolarHBondContact O-N 3.28Å; R92-E95 PolarHBondContact O-N 3.14Å; R92-E96 PolarHBondContact O-N 3.38Å
93E98.4Very high98.2Very high107 Ų107100.4 Ų100.450%0.551%0.509SS..Hα-helixtrans-62.6-40.9174.5-71.1172.6-179.200112.1V89 T90 E96 T97V89-E93 HydrophobicContact CG1-CG 4.47Å; V89-E93 WeakPolarHBondContact CG1-OE1 3.39Å; V89-E93 WeakPolarHBondContact O-CG 3.35Å; V89-E93 PolarHBondContact O-N 2.86Å; T90-E93 PolarHBondContact O-N 3.11Å; E93-E96 PolarHBondContact O-N 2.96Å; E93-T97 VanDerWaalsContact O-CG2 3.29Å; E93-T97 WeakPolarHBondContact O-CG2 3.4Å; E93-T97 PolarHBondContact O-N 3.5Å; E93-T97 PolarHBondContact O-OG1 2.97Å
94L97.9Very high98.2Very high120 Ų120100.1 Ų100.163%0.62850%0.504SS*.Hα-helixtrans-66.2-38.5175.4-73173.8000112.1T90 A91 R92 T97 N98T90-L94 WeakPolarHBondContact O-CB 3.38Å; T90-L94 VanDerWaalsContact O-CG 3.24Å; T90-L94 WeakPolarHBondContact O-CG 3.45Å; T90-L94 PolarHBondContact O-N 3.49Å; A91-L94 PolarHBondContact O-N 2.92Å; R92-L94 PolarHBondContact O-N 3.28Å; L94-T97 WeakPolarHBondContact CA-OG1 3.49Å; L94-T97 PolarHBondContact O-OG1 3.3Å; L94-N98 WeakPolarHBondContact O-CB 3.4Å; L94-N98 PolarHBondContact O-N 2.99Å
95E98.1Very high98.2Very high119 Ų11995.8 Ų95.856%0.55650%0.497SS*.Hα-helixtrans-64.8-44.1174.1-74.5177.1-177.700111.9A91 R92 N98 Q99A91-E95 WeakPolarHBondContact O-CG 3.35Å; A91-E95 PolarHBondContact O-N 3.1Å; R92-E95 PolarHBondContact O-N 3.14Å; E95-N98 PolarHBondContact O-N 2.91Å; E95-Q99 VanDerWaalsContact O-CG 3.3Å; E95-Q99 WeakPolarHBondContact O-CG 3.38Å; E95-Q99 PolarHBondContact O-N 3.32Å
96E98.4Very high98.2Very high139 Ų13995.5 Ų95.565%0.6549%0.493SS*.Hα-helixtrans-62.6-47.8177.7-174-177.4171.400111.5R92 E93 N98 Q99 K100R92-E96 PolarHBondContact O-N 3.38Å; E93-E96 PolarHBondContact O-N 2.96Å; E96-N98 VanDerWaalsContact C-N 3.3Å; E96-N98 PolarHBondContact O-N 2.93Å; E96-Q99 PolarHBondContact O-N 2.88Å; E96-K100 WeakPolarHBondContact O-CB 3.32Å; E96-K100 PolarHBondContact O-N 3.23Å
97T98.2Very high98.2Very high73 Ų7392.5 Ų92.545%0.44849%0.488SS..Hα-helixtrans-62.9-37.8177.454.40000111.8E93 L94 K100 L101E93-T97 VanDerWaalsContact O-CG2 3.29Å; E93-T97 WeakPolarHBondContact O-CG2 3.4Å; E93-T97 PolarHBondContact O-N 3.5Å; E93-T97 PolarHBondContact O-OG1 2.97Å; L94-T97 WeakPolarHBondContact CA-OG1 3.49Å; L94-T97 PolarHBondContact O-OG1 3.3Å; T97-K100 PolarHBondContact O-N 2.94Å; T97-L101 VanDerWaalsContact O-CG 3.3Å; T97-L101 WeakPolarHBondContact O-CG 3.5Å; T97-L101 PolarHBondContact O-N 2.98Å
98N98.1Very high98.2Very high98 Ų9890.1 Ų90.152%0.52448%0.481SS..Hα-helixtrans-64.9-47.7174.7-168.8-27000111.6L94 E95 E96 K100 L101 V102L94-N98 WeakPolarHBondContact O-CB 3.4Å; L94-N98 PolarHBondContact O-N 2.99Å; E95-N98 PolarHBondContact O-N 2.91Å; E96-N98 VanDerWaalsContact C-N 3.3Å; E96-N98 PolarHBondContact O-N 2.93Å; N98-K100 VanDerWaalsContact C-N 3.28Å; N98-K100 PolarHBondContact O-N 2.69Å; N98-L101 PolarHBondContact O-N 3.49Å; N98-V102 WeakPolarHBondContact O-CG2 3.41Å; N98-V102 PolarHBondContact O-N 2.88Å
99Q98.3Very high98.2Very high137 Ų13791.6 Ų91.664%0.6449%0.485SS*.Hα-helixtrans-57.2-42.4175.7-73.1176.826.700111.9E95 E96 V102 A103E95-Q99 VanDerWaalsContact O-CG 3.3Å; E95-Q99 WeakPolarHBondContact O-CG 3.38Å; E95-Q99 PolarHBondContact O-N 3.32Å; E96-Q99 PolarHBondContact O-N 2.88Å; Q99-V102 PolarHBondContact O-N 3.48Å; Q99-A103 WeakPolarHBondContact O-CB 3.48Å; Q99-A103 PolarHBondContact O-N 3.32Å
100K98.5Very high98.2Very high143 Ų14396 Ų9662%0.62250%0.503SS*.Hα-helixtrans-61.7-48.4175.5-174.4177.9180177.90112E96 T97 N98 V102 A103 D104E96-K100 WeakPolarHBondContact O-CB 3.32Å; E96-K100 PolarHBondContact O-N 3.23Å; T97-K100 PolarHBondContact O-N 2.94Å; N98-K100 VanDerWaalsContact C-N 3.28Å; N98-K100 PolarHBondContact O-N 2.69Å; K100-V102 VanDerWaalsContact C-N 3.3Å; K100-V102 PolarHBondContact O-N 2.89Å; K100-A103 WeakPolarHBondContact O-CB 3.48Å; K100-A103 PolarHBondContact O-N 3.1Å; K100-A103 VanDerWaalsContact O-N 3.16Å; K100-D104 PolarHBondContact O-N 3.33Å
101L98.5Very high98.3Very high118 Ų118100.5 Ų100.562%0.61852%0.519SS*.Hα-helixtrans-61.2-38.1176.8-73.1173.2000112.3T97 N98 D104 S105T97-L101 VanDerWaalsContact O-CG 3.3Å; T97-L101 WeakPolarHBondContact O-CG 3.5Å; T97-L101 PolarHBondContact O-N 2.98Å; N98-L101 PolarHBondContact O-N 3.49Å; L101-D104 PolarHBondContact O-N 3.49Å; L101-S105 WeakPolarHBondContact O-CB 3.29Å; L101-S105 PolarHBondContact O-N 3.12Å
102V98.7Very high98.3Very high64 Ų64103.7 Ų103.739%0.38853%0.529SS..Hα-helixtrans-65.7-41.31751700000111.1N98 Q99 K100 S105 K106N98-V102 WeakPolarHBondContact O-CG2 3.41Å; N98-V102 PolarHBondContact O-N 2.88Å; Q99-V102 PolarHBondContact O-N 3.48Å; K100-V102 VanDerWaalsContact C-N 3.3Å; K100-V102 PolarHBondContact O-N 2.89Å; V102-S105 PolarHBondContact O-N 2.89Å; V102-K106 HydrophobicContact CG1-CD 4.3Å; V102-K106 WeakPolarHBondContact O-CB 3.25Å; V102-K106 VanDerWaalsContact O-CG 3.31Å; V102-K106 WeakPolarHBondContact O-CG 3.49Å; V102-K106 PolarHBondContact O-N 2.9Å
103A98.3Very high98.3Very high55 Ų55102.5 Ų102.546%0.45553%0.531SS..Hα-helixtrans-63.8-46.1175.800000111.6Q99 K100 S105 K106 A107Q99-A103 WeakPolarHBondContact O-CB 3.48Å; Q99-A103 PolarHBondContact O-N 3.32Å; K100-A103 WeakPolarHBondContact O-CB 3.48Å; K100-A103 PolarHBondContact O-N 3.1Å; K100-A103 VanDerWaalsContact O-N 3.16Å; A103-S105 PolarHBondContact O-N 3.35Å; A103-K106 PolarHBondContact O-N 3.42Å; A103-A107 WeakPolarHBondContact O-CB 3.46Å; A103-A107 PolarHBondContact O-N 3.47Å
104D98.5Very high98.3Very high90 Ų90100 Ų10048%0.48153%0.525SS..Hα-helixtrans-63.5-41.3177.1-71.8-13.6000111.5K100 L101 A107 S108K100-D104 PolarHBondContact O-N 3.33Å; L101-D104 PolarHBondContact O-N 3.49Å; D104-A107 PolarHBondContact O-N 3.28Å; D104-S108 WeakPolarHBondContact O-CB 3.39Å; D104-S108 PolarHBondContact O-N 3.45Å
105S98.2Very high98.3Very high66 Ų6698.6 Ų98.646%0.46252%0.518SS..Hα-helixtrans-59.3-48.3174-179.70000111.2L101 V102 A103 A107 S108 Q109L101-S105 WeakPolarHBondContact O-CB 3.29Å; L101-S105 PolarHBondContact O-N 3.12Å; V102-S105 PolarHBondContact O-N 2.89Å; A103-S105 PolarHBondContact O-N 3.35Å; S105-A107 PolarHBondContact O-N 2.73Å; S105-S108 PolarHBondContact O-N 3.32Å; S105-S108 PolarHBondContact O-OG 2.96Å; S105-Q109 WeakPolarHBondContact O-CB 3.42Å; S105-Q109 PolarHBondContact O-N 3.49Å
106K98.5Very high98.3Very high125 Ų12595.7 Ų95.754%0.54351%0.509SS..Hα-helixtrans-60.5-43.5175.5-74.5174.6-179.2177.90112.4V102 A103 S108 Q109 Q110V102-K106 HydrophobicContact CG1-CD 4.3Å; V102-K106 WeakPolarHBondContact O-CB 3.25Å; V102-K106 VanDerWaalsContact O-CG 3.31Å; V102-K106 WeakPolarHBondContact O-CG 3.49Å; V102-K106 PolarHBondContact O-N 2.9Å; A103-K106 PolarHBondContact O-N 3.42Å; K106-S108 VanDerWaalsContact C-N 3.35Å; K106-Q109 PolarHBondContact O-N 2.88Å; K106-Q110 WeakPolarHBondContact O-CG 3.44Å; K106-Q110 PolarHBondContact O-N 2.92Å
107A98.4Very high98.3Very high52 Ų5294.7 Ų94.743%0.4350%0.504SS..Hα-helixtrans-63.1-42177.300000111.6A103 D104 S105 Q109 Q110 K111A103-A107 WeakPolarHBondContact O-CB 3.46Å; A103-A107 PolarHBondContact O-N 3.47Å; D104-A107 PolarHBondContact O-N 3.28Å; S105-A107 PolarHBondContact O-N 2.73Å; A107-Q109 VanDerWaalsContact C-N 3.35Å; A107-Q110 PolarHBondContact O-N 3.26Å; A107-K111 PolarHBondContact O-N 2.86Å
108S97.8Very high98.3Very high59 Ų5994.8 Ų94.841%0.41350%0.504SS..Hα-helixtrans-64.6-39.2175.2790000112.1D104 S105 K106 K111 I112D104-S108 WeakPolarHBondContact O-CB 3.39Å; D104-S108 PolarHBondContact O-N 3.45Å; S105-S108 PolarHBondContact O-N 3.32Å; S105-S108 PolarHBondContact O-OG 2.96Å; K106-S108 VanDerWaalsContact C-N 3.35Å; S108-K111 WeakPolarHBondContact O-CB 3.48Å; S108-K111 PolarHBondContact O-N 3.27Å; S108-I112 WeakPolarHBondContact O-CG1 3.36Å; S108-I112 PolarHBondContact O-N 3.05Å
109Q98.4Very high98.3Very high113 Ų11394.3 Ų94.353%0.52850%0.501SS..Hα-helixtrans-64.4-44.1176.5-173.2176.89.300111.3S105 K106 A107 K111 I112 L113S105-Q109 WeakPolarHBondContact O-CB 3.42Å; S105-Q109 PolarHBondContact O-N 3.49Å; K106-Q109 PolarHBondContact O-N 2.88Å; A107-Q109 VanDerWaalsContact C-N 3.35Å; Q109-K111 VanDerWaalsContact C-N 3.3Å; Q109-K111 PolarHBondContact O-N 2.98Å; Q109-I112 PolarHBondContact O-N 2.99Å; Q109-L113 WeakPolarHBondContact O-CG 3.47Å; Q109-L113 PolarHBondContact O-N 3.22Å
110Q98.3Very high98.3Very high136 Ų13693 Ų9364%0.63650%0.495SS*.Hα-helixtrans-59.4-41.7173.7-73173.1-11.200111.6K106 A107 L113 S114K106-Q110 WeakPolarHBondContact O-CG 3.44Å; K106-Q110 PolarHBondContact O-N 2.92Å; A107-Q110 PolarHBondContact O-N 3.26Å; Q110-L113 PolarHBondContact O-N 2.93Å; Q110-S114 PolarHBondContact O-N 2.93Å
111K98.5Very high98.2Very high141 Ų14189.7 Ų89.761%0.61349%0.489SS*.Hα-helixtrans-62.7-43175.6-171.7174.6-177.4176.70111.9A107 S108 Q109 S114 L115A107-K111 PolarHBondContact O-N 2.86Å; S108-K111 WeakPolarHBondContact O-CB 3.48Å; S108-K111 PolarHBondContact O-N 3.27Å; Q109-K111 VanDerWaalsContact C-N 3.3Å; Q109-K111 PolarHBondContact O-N 2.98Å; K111-S114 PolarHBondContact O-N 3.28Å; K111-S114 PolarHBondContact O-OG 2.86Å; K111-L115 HydrophobicContact CG-CD1 4.34Å; K111-L115 WeakPolarHBondContact O-CG 3.43Å; K111-L115 PolarHBondContact O-N 2.82Å
112I98.2Very high98.2Very high104 Ų10489.1 Ų89.153%0.53349%0.486SS..Hα-helixtrans-59.8-48.4175-68.9164.6000110.2S108 Q109 S114 L115 T116S108-I112 WeakPolarHBondContact O-CG1 3.36Å; S108-I112 PolarHBondContact O-N 3.05Å; Q109-I112 PolarHBondContact O-N 2.99Å; I112-S114 PolarHBondContact O-N 2.91Å; I112-L115 PolarHBondContact O-N 2.89Å; I112-T116 PolarHBondContact O-N 2.89Å; I112-T116 PolarHBondContact O-OG1 3.47Å
113L98.3Very high98.1Very high93 Ų9390.9 Ų90.949%0.48749%0.49SS..Hα-helixtrans-58.2-46.8178.4-68.4173.7000111.7Q109 Q110 L115 T116 E117Q109-L113 WeakPolarHBondContact O-CG 3.47Å; Q109-L113 PolarHBondContact O-N 3.22Å; Q110-L113 PolarHBondContact O-N 2.93Å; L113-L115 VanDerWaalsContact C-N 3.31Å; L113-L115 PolarHBondContact O-N 3.18Å; L113-T116 WeakPolarHBondContact O-CB 3.47Å; L113-T116 PolarHBondContact O-N 3.28Å; L113-T116 VanDerWaalsContact O-N 3.16Å; L113-E117 WeakPolarHBondContact O-CG 3.5Å; L113-E117 PolarHBondContact O-N 3.41Å
114S98.4Very high98.1Very high54 Ų5492.3 Ų92.338%0.37849%0.493SS..Hα-helixtrans-59.8-39.8177.171.20000112.9Q110 K111 I112 E117 T118Q110-S114 PolarHBondContact O-N 2.93Å; K111-S114 PolarHBondContact O-N 3.28Å; K111-S114 PolarHBondContact O-OG 2.86Å; I112-S114 PolarHBondContact O-N 2.91Å; S114-E117 PolarHBondContact O-N 3.47Å; S114-T118 WeakPolarHBondContact O-CG2 3.17Å; S114-T118 PolarHBondContact O-N 3.29Å; S114-T118 VanDerWaalsContact O-N 3.09Å
115L97.9Very high98Very high91 Ų9192.6 Ų92.648%0.47650%0.495SS..Hα-helixtrans-69.1-41176.9-71.6172.2000111.1K111 I112 L113 E117 T118 I119K111-L115 HydrophobicContact CG-CD1 4.34Å; K111-L115 WeakPolarHBondContact O-CG 3.43Å; K111-L115 PolarHBondContact O-N 2.82Å; I112-L115 PolarHBondContact O-N 2.89Å; L113-L115 VanDerWaalsContact C-N 3.31Å; L113-L115 PolarHBondContact O-N 3.18Å; L115-E117 VanDerWaalsContact C-N 3.35Å; L115-E117 PolarHBondContact O-N 3.18Å; L115-T118 PolarHBondContact O-N 2.93Å; L115-T118 PolarHBondContact O-OG1 3.38Å; L115-I119 VanDerWaalsContact O-CG1 3.32Å; L115-I119 WeakPolarHBondContact O-CG1 3.35Å; L115-I119 PolarHBondContact O-N 3.35Å
116T97.8Very high97.9Very high58 Ų5893.7 Ų93.736%0.35649%0.494SS..Hα-helixtrans-59.4-45.7174.7-58.30000111.2I112 L113 T118 I119 E120I112-T116 PolarHBondContact O-N 2.89Å; I112-T116 PolarHBondContact O-OG1 3.47Å; L113-T116 WeakPolarHBondContact O-CB 3.47Å; L113-T116 PolarHBondContact O-N 3.28Å; L113-T116 VanDerWaalsContact O-N 3.16Å; T116-T118 VanDerWaalsContact C-N 3.34Å; T116-T118 PolarHBondContact O-N 2.87Å; T116-I119 WeakPolarHBondContact O-CB 3.36Å; T116-I119 PolarHBondContact O-N 2.84Å; T116-I119 VanDerWaalsContact O-N 3.11Å; T116-E120 WeakPolarHBondContact O-CG 3.38Å; T116-E120 PolarHBondContact O-N 2.95Å
117E98.1Very high97.9Very high118 Ų11891.9 Ų91.955%0.55149%0.491SS*.Hα-helixtrans-58.3-44.2175.4-71.8169.8-169.100111.6L113 S114 L115 I119 E120 C121L113-E117 WeakPolarHBondContact O-CG 3.5Å; L113-E117 PolarHBondContact O-N 3.41Å; S114-E117 PolarHBondContact O-N 3.47Å; L115-E117 VanDerWaalsContact C-N 3.35Å; L115-E117 PolarHBondContact O-N 3.18Å; E117-I119 VanDerWaalsContact C-N 3.32Å; E117-I119 PolarHBondContact O-N 2.94Å; E117-E120 PolarHBondContact O-N 3.33Å; E117-C121 PolarHBondContact O-N 3.43Å; E117-C121 PolarHBondContact O-SG 3.02Å; E117-C121 VanDerWaalsContact O-SG 3.35Å
118T97.9Very high97.8Very high75 Ų7594.8 Ų94.846%0.4650%0.495SS..Hα-helixtrans-63.8-37175.862.70000112.8S114 L115 T116 C121 L122S114-T118 WeakPolarHBondContact O-CG2 3.17Å; S114-T118 PolarHBondContact O-N 3.29Å; S114-T118 VanDerWaalsContact O-N 3.09Å; L115-T118 PolarHBondContact O-N 2.93Å; L115-T118 PolarHBondContact O-OG1 3.38Å; T116-T118 VanDerWaalsContact C-N 3.34Å; T116-T118 PolarHBondContact O-N 2.87Å; T118-C121 PolarHBondContact O-N 3.4Å; T118-L122 VanDerWaalsContact O-CG 3.28Å; T118-L122 WeakPolarHBondContact O-CG 3.43Å; T118-L122 PolarHBondContact O-N 3.29Å
119I98.1Very high97.7Very high89 Ų8996.9 Ų96.946%0.45650%0.502SS..Hα-helixtrans-65.7-44.3176.9-70.4166.1000110.1L115 T116 E117 L122 Q123L115-I119 VanDerWaalsContact O-CG1 3.32Å; L115-I119 WeakPolarHBondContact O-CG1 3.35Å; L115-I119 PolarHBondContact O-N 3.35Å; T116-I119 WeakPolarHBondContact O-CB 3.36Å; T116-I119 PolarHBondContact O-N 2.84Å; T116-I119 VanDerWaalsContact O-N 3.11Å; E117-I119 VanDerWaalsContact C-N 3.32Å; E117-I119 PolarHBondContact O-N 2.94Å; I119-L122 PolarHBondContact O-N 3.36Å; I119-L122 VanDerWaalsContact O-N 3.16Å; I119-Q123 HydrophobicContact CG2-CG 4.27Å; I119-Q123 WeakPolarHBondContact O-CB 3.42Å; I119-Q123 VanDerWaalsContact O-CG 3.29Å; I119-Q123 WeakPolarHBondContact O-CG 3.38Å; I119-Q123 PolarHBondContact O-N 2.95Å
120E98Very high97.6Very high108 Ų10897 Ų9751%0.50550%0.502SS..Hα-helixtrans-62.2-42.2176.9-70.9176.2-174.600111.8T116 E117 L122 Q123 T124T116-E120 WeakPolarHBondContact O-CG 3.38Å; T116-E120 PolarHBondContact O-N 2.95Å; E117-E120 PolarHBondContact O-N 3.33Å; E120-L122 VanDerWaalsContact C-N 3.32Å; E120-L122 PolarHBondContact O-N 3.48Å; E120-Q123 PolarHBondContact O-N 2.97Å; E120-T124 WeakPolarHBondContact O-CG2 3.26Å; E120-T124 PolarHBondContact O-N 3.16Å; E120-T124 PolarHBondContact O-OG1 3.49Å; E120-T124 VanDerWaalsContact O-OG1 3.04Å
121C97.9Very high97.5Very high75 Ų7594 Ų9451%0.50750%0.496SS..Hα-helixtrans-60.9-39.5172.5-68.50000112.4E117 T118 T124 N125E117-C121 PolarHBondContact O-N 3.43Å; E117-C121 PolarHBondContact O-SG 3.02Å; E117-C121 VanDerWaalsContact O-SG 3.35Å; T118-C121 PolarHBondContact O-N 3.4Å; C121-T124 WeakPolarHBondContact CA-OG1 3.32Å; C121-T124 PolarHBondContact O-OG1 2.93Å; C121-N125 VanDerWaalsContact O-CG 3.24Å; C121-N125 PolarHBondContact O-N 2.88Å; C121-N125 PolarHBondContact O-ND2 3.43Å
122L97.3Very high97.3Very high105 Ų10591.2 Ų91.255%0.5549%0.485SS..Hα-helixtrans-70.3-39.1176.4-70.8172.8000112.1T118 I119 E120 N125 I126T118-L122 VanDerWaalsContact O-CG 3.28Å; T118-L122 WeakPolarHBondContact O-CG 3.43Å; T118-L122 PolarHBondContact O-N 3.29Å; I119-L122 PolarHBondContact O-N 3.36Å; I119-L122 VanDerWaalsContact O-N 3.16Å; E120-L122 VanDerWaalsContact C-N 3.32Å; E120-L122 PolarHBondContact O-N 3.48Å; L122-N125 PolarHBondContact O-N 3.39Å; L122-I126 VanDerWaalsContact O-CG1 3.3Å; L122-I126 WeakPolarHBondContact O-CG1 3.42Å; L122-I126 PolarHBondContact O-N 3.25Å
123Q97.5Very high97.1Very high102 Ų10290.4 Ų90.448%0.47749%0.485SS..Hα-helixtrans-61.3-48.7176.1-75.7171.2-14.600111.2I119 E120 N125 I126 D127I119-Q123 HydrophobicContact CG2-CG 4.27Å; I119-Q123 WeakPolarHBondContact O-CB 3.42Å; I119-Q123 VanDerWaalsContact O-CG 3.29Å; I119-Q123 WeakPolarHBondContact O-CG 3.38Å; I119-Q123 PolarHBondContact O-N 2.95Å; E120-Q123 PolarHBondContact O-N 2.97Å; Q123-N125 VanDerWaalsContact C-N 3.3Å; Q123-N125 PolarHBondContact O-N 3.26Å; Q123-I126 WeakPolarHBondContact O-CB 3.43Å; Q123-I126 PolarHBondContact O-N 2.93Å; Q123-I126 VanDerWaalsContact O-N 3.08Å; Q123-D127 VanDerWaalsContact O-CG 3.28Å; Q123-D127 PolarHBondContact O-N 3.19Å
124T97.4Very high96.8Very high85 Ų8590.8 Ų90.852%0.52148%0.484SS..Hα-helixtrans-60-38.6176.650.80000112.5E120 C121 D127 H128E120-T124 WeakPolarHBondContact O-CG2 3.26Å; E120-T124 PolarHBondContact O-N 3.16Å; E120-T124 PolarHBondContact O-OG1 3.49Å; E120-T124 VanDerWaalsContact O-OG1 3.04Å; C121-T124 WeakPolarHBondContact CA-OG1 3.32Å; C121-T124 PolarHBondContact O-OG1 2.93Å; T124-D127 PolarHBondContact O-N 2.92Å; T124-H128 WeakPolarHBondContact O-CB 3.45Å; T124-H128 PolarHBondContact O-N 3.3Å
125N96.7Very high96.5Very high96 Ų9694.6 Ų94.651%0.51350%0.496SS..Hα-helixtrans-64.7-41.8173.1-73.8-32.5000112.6C121 L122 Q123 H128 L129C121-N125 VanDerWaalsContact O-CG 3.24Å; C121-N125 PolarHBondContact O-N 2.88Å; C121-N125 PolarHBondContact O-ND2 3.43Å; L122-N125 PolarHBondContact O-N 3.39Å; Q123-N125 VanDerWaalsContact C-N 3.3Å; Q123-N125 PolarHBondContact O-N 3.26Å; N125-H128 PolarHBondContact O-N 2.85Å; N125-L129 WeakPolarHBondContact O-CB 3.31Å; N125-L129 WeakPolarHBondContact O-CG 3.49Å; N125-L129 PolarHBondContact O-N 3.43Å
126I97.3Very high96.1Very high88 Ų8896 Ų9645%0.45150%0.504SS..Hα-helixtrans-62.9-46.2175.8-71.9166.1000110.2L122 Q123 H128 L129 Q130L122-I126 VanDerWaalsContact O-CG1 3.3Å; L122-I126 WeakPolarHBondContact O-CG1 3.42Å; L122-I126 PolarHBondContact O-N 3.25Å; Q123-I126 WeakPolarHBondContact O-CB 3.43Å; Q123-I126 PolarHBondContact O-N 2.93Å; Q123-I126 VanDerWaalsContact O-N 3.08Å; I126-H128 VanDerWaalsContact C-N 3.3Å; I126-H128 PolarHBondContact O-N 2.75Å; I126-L129 PolarHBondContact O-N 3.25Å; I126-Q130 HydrophobicContact CG2-CG 4.22Å; I126-Q130 WeakPolarHBondContact O-CB 3.42Å; I126-Q130 VanDerWaalsContact O-CG 3.28Å; I126-Q130 WeakPolarHBondContact O-CG 3.49Å; I126-Q130 PolarHBondContact O-N 2.98Å
127D97.3Very high95.7Very high88 Ų8899.1 Ų99.147%0.47151%0.512SS..Hα-helixtrans-62.4-38.8179-66.9-20.5000111.5Q123 T124 Q130 S131Q123-D127 VanDerWaalsContact O-CG 3.28Å; Q123-D127 PolarHBondContact O-N 3.19Å; T124-D127 PolarHBondContact O-N 2.92Å; D127-Q130 PolarHBondContact O-N 3Å; D127-S131 WeakPolarHBondContact O-CB 3.46Å; D127-S131 PolarHBondContact O-N 3.43Å; D127-S131 PolarHBondContact O-OG 2.88Å
128H97Very high94.7Very high112 Ų11296.9 Ų96.952%0.51951%0.51SS..Hα-helixtrans-64.2-47174.2-176.462.8000112T124 N125 I126 S131 Q132T124-H128 WeakPolarHBondContact O-CB 3.45Å; T124-H128 PolarHBondContact O-N 3.3Å; N125-H128 PolarHBondContact O-N 2.85Å; I126-H128 VanDerWaalsContact C-N 3.3Å; I126-H128 PolarHBondContact O-N 2.75Å; H128-S131 WeakPolarHBondContact O-CB 3.49Å; H128-S131 PolarHBondContact O-N 2.96Å; H128-Q132 PolarHBondContact CD2-NE2 2.96Å; H128-Q132 PolarHBondContact NE2-NE2 3.43Å; H128-Q132 PolarHBondContact O-N 3.47Å
129L96.3Very high93.6Very high104 Ų10496.3 Ų96.355%0.54551%0.509SS..Hα-helixtrans-63.3-40.9176-72.8172.5000111.9N125 I126 S131 Q132 V133N125-L129 WeakPolarHBondContact O-CB 3.31Å; N125-L129 WeakPolarHBondContact O-CG 3.49Å; N125-L129 PolarHBondContact O-N 3.43Å; I126-L129 PolarHBondContact O-N 3.25Å; L129-S131 VanDerWaalsContact C-N 3.33Å; L129-S131 PolarHBondContact O-N 3.38Å; L129-Q132 PolarHBondContact O-N 3.24Å; L129-V133 WeakPolarHBondContact O-CG2 3.3Å; L129-V133 PolarHBondContact O-N 3.34Å
130Q95.9Very high91.7Very high114 Ų11493.7 Ų93.753%0.53350%0.504SS..Hα-helixtrans-61.3-42.1174.7-75.4178.26.400111.5I126 D127 V133 E134I126-Q130 HydrophobicContact CG2-CG 4.22Å; I126-Q130 WeakPolarHBondContact O-CB 3.42Å; I126-Q130 VanDerWaalsContact O-CG 3.28Å; I126-Q130 WeakPolarHBondContact O-CG 3.49Å; I126-Q130 PolarHBondContact O-N 2.98Å; D127-Q130 PolarHBondContact O-N 3Å; Q130-V133 PolarHBondContact O-N 2.62Å; Q130-E134 PolarHBondContact O-N 3.19Å
131S95.1Very high89.7Confident75 Ų7598.7 Ų98.752%0.52452%0.518SS..Hα-helixtrans-61.2-46.2175.8-60.10000111.6D127 H128 L129 V133 E134 E135D127-S131 WeakPolarHBondContact O-CB 3.46Å; D127-S131 PolarHBondContact O-N 3.43Å; D127-S131 PolarHBondContact O-OG 2.88Å; H128-S131 WeakPolarHBondContact O-CB 3.49Å; H128-S131 PolarHBondContact O-N 2.96Å; L129-S131 VanDerWaalsContact C-N 3.33Å; L129-S131 PolarHBondContact O-N 3.38Å; S131-V133 VanDerWaalsContact C-N 3.34Å; S131-V133 PolarHBondContact O-N 3.33Å; S131-E134 PolarHBondContact O-N 3.45Å; S131-E135 WeakPolarHBondContact O-CB 3.36Å; S131-E135 PolarHBondContact O-N 2.97Å
132Q95.4Very high87.5Confident81 Ų8197.8 Ų97.838%0.37952%0.522SS..Hα-helixtrans-60.7-41174.8-70.8-173.840.800112.3H128 L129 E135 L136H128-Q132 PolarHBondContact CD2-NE2 2.96Å; H128-Q132 PolarHBondContact NE2-NE2 3.43Å; H128-Q132 PolarHBondContact O-N 3.47Å; L129-Q132 PolarHBondContact O-N 3.24Å; Q132-E135 PolarHBondContact O-N 3.5Å; Q132-L136 WeakPolarHBondContact O-CB 3.3Å; Q132-L136 WeakPolarHBondContact O-CG 3.2Å; Q132-L136 PolarHBondContact O-N 3.26Å
133V92.9Very high85.3Confident87 Ų87102.3 Ų102.353%0.52753%0.531SS..Hα-helixtrans-64.6-43.3177.8168.70000111.3L129 Q130 S131 E135 L136 K137L129-V133 WeakPolarHBondContact O-CG2 3.3Å; L129-V133 PolarHBondContact O-N 3.34Å; Q130-V133 PolarHBondContact O-N 2.62Å; S131-V133 VanDerWaalsContact C-N 3.34Å; S131-V133 PolarHBondContact O-N 3.33Å; V133-E135 VanDerWaalsContact C-N 3.35Å; V133-L136 PolarHBondContact O-N 2.89Å; V133-K137 WeakPolarHBondContact O-CB 3.49Å; V133-K137 PolarHBondContact O-N 3.3Å
134E92.9Very high82.8Confident101 Ų101108.6 Ų108.647%0.47255%0.551SS.*Hα-helixtrans-69.1-32.2176.6-70.6-59.9147.700112.2Q130 S131 K137 S138Q130-E134 PolarHBondContact O-N 3.19Å; S131-E134 PolarHBondContact O-N 3.45Å; E134-K137 PolarHBondContact O-N 3.22Å; E134-K137 IonicContact OE1-NZ 2.81Å; E134-K137 PolarHBondContact OE1-NZ 3.44Å; E134-K137 IonicContact OE2-NZ 3.24Å; E134-K137 PolarHBondContact OE2-NZ 2.78Å; E134-S138 VanDerWaalsContact O-CB 3.31Å; E134-S138 WeakPolarHBondContact O-CB 3.45Å; E134-S138 PolarHBondContact O-N 3.02Å; E134-S138 PolarHBondContact O-OG 2.92Å
135E92.6Very high80.5Confident135 Ų135109.3 Ų109.363%0.63156%0.559SS**Hα-helixtrans-65.7-44.1170.6-168.8178.1-176.100112.1S131 Q132 V133 K137 S138 S139S131-E135 WeakPolarHBondContact O-CB 3.36Å; S131-E135 PolarHBondContact O-N 2.97Å; Q132-E135 PolarHBondContact O-N 3.5Å; V133-E135 VanDerWaalsContact C-N 3.35Å; E135-K137 VanDerWaalsContact C-N 3.33Å; E135-K137 PolarHBondContact O-N 3.43Å; E135-S138 WeakPolarHBondContact CA-OG 3.35Å; E135-S138 PolarHBondContact O-N 2.99Å; E135-S138 PolarHBondContact O-OG 3.3Å; E135-S139 VanDerWaalsContact O-CB 3.3Å; E135-S139 WeakPolarHBondContact O-CB 3.48Å; E135-S139 PolarHBondContact O-N 3.44Å; E135-S139 PolarHBondContact O-OG 2.92Å
136L89.2Confident77.9Confident121 Ų121112.4 Ų112.463%0.63457%0.57SS**Hα-helixtrans-65.5-35.8174-73.1174.2000112.4Q132 V133 S139 G140Q132-L136 WeakPolarHBondContact O-CB 3.3Å; Q132-L136 WeakPolarHBondContact O-CG 3.2Å; Q132-L136 PolarHBondContact O-N 3.26Å; V133-L136 PolarHBondContact O-N 2.89Å; L136-S139 VanDerWaalsContact CA-OG 3.29Å; L136-S139 WeakPolarHBondContact CA-OG 3.37Å; L136-S139 PolarHBondContact O-OG 3.25Å; L136-S139 VanDerWaalsContact O-OG 3.07Å; L136-G140 WeakPolarHBondContact O-CA 3.4Å; L136-G140 PolarHBondContact O-N 3.42Å
137K88.3Confident74.9Confident122 Ų122111.5 Ų111.553%0.5358%0.583SS.*Hα-helixtrans-73.7-36.3178.4-175.1173.2159.7-153.20112.3V133 E134 E135 R141V133-K137 WeakPolarHBondContact O-CB 3.49Å; V133-K137 PolarHBondContact O-N 3.3Å; E134-K137 PolarHBondContact O-N 3.22Å; E134-K137 IonicContact OE1-NZ 2.81Å; E134-K137 PolarHBondContact OE1-NZ 3.44Å; E134-K137 IonicContact OE2-NZ 3.24Å; E134-K137 PolarHBondContact OE2-NZ 2.78Å; E135-K137 VanDerWaalsContact C-N 3.33Å; E135-K137 PolarHBondContact O-N 3.43Å; K137-R141 WeakPolarHBondContact O-CB 3.3Å; K137-R141 PolarHBondContact O-N 3.37Å
138S76.8Confident72.5Confident72 Ų72116.9 Ų116.950%0.50360%0.602SS.*Hα-helixtrans-71.7-43.6173.456.90000111.9E134 E135 R141 G142E134-S138 VanDerWaalsContact O-CB 3.31Å; E134-S138 WeakPolarHBondContact O-CB 3.45Å; E134-S138 PolarHBondContact O-N 3.02Å; E134-S138 PolarHBondContact O-OG 2.92Å; E135-S138 WeakPolarHBondContact CA-OG 3.35Å; E135-S138 PolarHBondContact O-N 2.99Å; E135-S138 PolarHBondContact O-OG 3.3Å; S138-R141 WeakPolarHBondContact O-CB 3.48Å; S138-R141 PolarHBondContact O-N 2.95Å; S138-G142 PolarHBondContact O-N 3.49Å
139S75.6Confident69.6Low62 Ų62117.1 Ų117.143%0.43462%0.615SS.*Hα-helixtrans-66.9-35.5173.360.50000112.9E135 L136 G142 R143E135-S139 VanDerWaalsContact O-CB 3.3Å; E135-S139 WeakPolarHBondContact O-CB 3.48Å; E135-S139 PolarHBondContact O-N 3.44Å; E135-S139 PolarHBondContact O-OG 2.92Å; L136-S139 VanDerWaalsContact CA-OG 3.29Å; L136-S139 WeakPolarHBondContact CA-OG 3.37Å; L136-S139 PolarHBondContact O-OG 3.25Å; L136-S139 VanDerWaalsContact O-OG 3.07Å; S139-G142 PolarHBondContact O-N 3.18Å; S139-R143 PolarHBondContact O-N 3.39Å
140G58.7Low66.9Low34 Ų34119 Ų11935%0.35163%0.625SS.*Hα-helixtrans-69.7-27.7173.200000113.9L136 G142 R143L136-G140 WeakPolarHBondContact O-CA 3.4Å; L136-G140 PolarHBondContact O-N 3.42Å; G140-G142 VanDerWaalsContact C-N 3.29Å; G140-G142 PolarHBondContact O-N 3.5Å; G140-R143 PolarHBondContact O-N 2.89Å
141R55.5Low64Low213 Ų213122.8 Ų122.880%0.80464%0.643SS**Hα-helixtrans-67.1-29.7170.4-115.4176.4178-109.62.5112.3K137 S138K137-R141 WeakPolarHBondContact O-CB 3.3Å; K137-R141 PolarHBondContact O-N 3.37Å; S138-R141 WeakPolarHBondContact O-CB 3.48Å; S138-R141 PolarHBondContact O-N 2.95Å
142G51.8Low61.1Low57 Ų57128.1 Ų128.159%0.58866%0.66SS**THydrogen-bonded Turntrans-77.1-14.5173.200000114.9S138 S139 G140S138-G142 PolarHBondContact O-N 3.49Å; S139-G142 PolarHBondContact O-N 3.18Å; G140-G142 VanDerWaalsContact C-N 3.29Å; G140-G142 PolarHBondContact O-N 3.5Å
143R51.4Low58.5Low200 Ų200133.8 Ų133.876%0.75568%0.683SS**THydrogen-bonded Turntrans-106.716.7-177.6-70.6-163-170.5-97.53.9115.3S139 G140 S145S139-R143 PolarHBondContact O-N 3.39Å; G140-R143 PolarHBondContact O-N 2.89Å; R143-S145 PolarHBondContact O-N 3.44Å
144R45.3Very low56.1Low234 Ų234135.8 Ų135.888%0.88370%0.698SS**THydrogen-bonded Turntrans-81.97.5169.3-73.8-170.9-171.1-171.72.3114.3
145S47.8Very low53.7Low100 Ų100135.2 Ų135.270%0.69971%0.71SS**THydrogen-bonded Turntrans-131.119.1178.168.20000115.7R143R143-S145 PolarHBondContact O-N 3.44Å
146Q41.8Very low51.5Low160 Ų160135.1 Ų135.175%0.74872%0.721SS**  trans-129.5105.7173.3-150.993.13.700109.8
147G34.7Very low49.7Very low69 Ų69133.9 Ų133.971%0.71172%0.723SS**  trans-68.2165.2176.700000114.1
148K46.6Very low47.8Very low202 Ų202136.2 Ų136.288%0.87873%0.734SS**  trans22.4120.3145.8-63.3-175.4173.6-173.30118.4
149C36.5Very low46.7Very low117 Ų117135.8 Ų135.879%0.79173%0.734SS**  trans-167.5105.9133.2-129.60000105.1
150D39.3Very low45.7Very low142 Ų142137.2 Ų137.276%0.75974%0.743SS**  34.894.575.6-72.2-26.3000112.7
151Q36Very low45.5Very low194 Ų194140.5 Ų140.591%0.90775%0.752SS**  trans-158.2141.6132-114.6177.245.800112.8
152E33.4Very low45.4Very low188 Ų188138 Ų13888%0.87975%0.747SS**  trans-81.3149.7-168.4-60.9166.4129.900112
153K41.6Very low45.7Very low200 Ų200141.9 Ų141.987%0.8775%0.75SS**  trans-3.6150.7150.9-79.5176.6-179.4175.10118
154P42.7Very low45.9Very low129 Ų129137.3 Ų137.384%0.83874%0.74SS**  -147.8174.254.934.3-10.6000117.8
155A42.8Very low46.3Very low88 Ų88134.6 Ų134.673%0.72773%0.731SS**  trans-58.5149.5-168.900000116.8S157A155-S157 PolarHBondContact O-N 2.89Å
156P46.5Very low46.7Very low133 Ų133134.1 Ų134.186%0.86472%0.721SS**  trans-89.397.415533.5-22.9000108.3
157S50.7Low47.4Very low95 Ų95131.9 Ų131.966%0.66471%0.713SS**  trans-89.2137.7161.5-160.50000108.1A155A155-S157 PolarHBondContact O-N 2.89Å
158F49.3Very low48.3Very low172 Ų172138.2 Ų138.275%0.75472%0.716SS**SBendtrans81.240.8164.7-83.4-87.3000121L161F158-L161 HydrophobicContact CE1-CD1 3.96Å
159A53.1Low48.4Very low63 Ų63136.1 Ų136.152%0.52171%0.709SS.*SBendtrans-107.6-24.2158.600000114.1L161A159-L161 PolarHBondContact O-N 3.32Å
160C53.8Low49.2Very low92 Ų92137.9 Ų137.962%0.62271%0.705SS**Hα-helixtrans-70.1-24.9-173-178.30000114.3L164C160-L164 VanDerWaalsContact O-CG 3.31Å; C160-L164 WeakPolarHBondContact O-CG 3.29Å
161L54.7Low49.8Very low103 Ų103138.6 Ų138.654%0.53970%0.702SS.*Hα-helixtrans-87.1-19-176.6-69.5176.1000114.3F158 A159 Y165F158-L161 HydrophobicContact CE1-CD1 3.96Å; A159-L161 PolarHBondContact O-N 3.32Å; L161-Y165 WeakPolarHBondContact O-CD2 3.14Å
162K54.1Low50.7Low159 Ų159135 Ų13569%0.69169%0.693SS**Hα-helixtrans-82.5-38.4177.9-167.2167.7-178.61770111.5L164 Y165 D166K162-L164 VanDerWaalsContact C-N 3.33Å; K162-L164 PolarHBondContact O-N 3.49Å; K162-Y165 PolarHBondContact O-N 3.31Å; K162-D166 PolarHBondContact O-N 2.95Å
163E58.2Low51.8Low139 Ų139134.4 Ų134.465%0.6568%0.684SS**Hα-helixtrans-66.9-31.9177-68.6177.2174.700112.7Y165 L167E163-Y165 VanDerWaalsContact C-N 3.34Å; E163-Y165 PolarHBondContact O-N 2.95Å; E163-L167 WeakPolarHBondContact O-CB 3.24Å; E163-L167 PolarHBondContact O-N 3.26Å
164L55.4Low52.5Low105 Ų105129.6 Ų129.655%0.5567%0.668SS.*Hα-helixtrans-71.5-25.9176.5-69177.2000113.7C160 K162C160-L164 VanDerWaalsContact O-CG 3.31Å; C160-L164 WeakPolarHBondContact O-CG 3.29Å; K162-L164 VanDerWaalsContact C-N 3.33Å; K162-L164 PolarHBondContact O-N 3.49Å
165Y52.8Low53.2Low176 Ų176130.8 Ų130.869%0.6966%0.662SS**Hα-helixtrans-82.9-34.6176-93.1-94.1000112.3L161 K162 E163 R168L161-Y165 WeakPolarHBondContact O-CD2 3.14Å; K162-Y165 PolarHBondContact O-N 3.31Å; E163-Y165 VanDerWaalsContact C-N 3.34Å; E163-Y165 PolarHBondContact O-N 2.95Å; Y165-R168 PolarHBondContact O-N 3.41Å
166D55.9Low54Low91 Ų91130.8 Ų130.849%0.48765%0.653SS.*Hα-helixtrans-70.3-35.3173.8-75.6-21.2000111.6K162 R168 Q169K162-D166 PolarHBondContact O-N 2.95Å; D166-R168 PolarHBondContact O-N 2.84Å; D166-Q169 PolarHBondContact O-N 3.41Å
167L57.3Low54.7Low113 Ų113129.7 Ų129.759%0.59263%0.634SS**Hα-helixtrans-68.7-22177.6-149.669.8000113.1E163 F171E163-L167 WeakPolarHBondContact O-CB 3.24Å; E163-L167 PolarHBondContact O-N 3.26Å; L167-F171 WeakPolarHBondContact O-CD2 3.39Å; L167-F171 WeakPolarHBondContact O-CE2 3.37Å
168R52.8Low55.2Low201 Ų201126.8 Ų126.876%0.75862%0.616SS**Hα-helixtrans-78-26.8178.1-158.7-178.6-158.1-153.55113.1Y165 D166Y165-R168 PolarHBondContact O-N 3.41Å; D166-R168 PolarHBondContact O-N 2.84Å
169Q48.5Very low55.7Low159 Ų159125.2 Ų125.274%0.74361%0.611SS**Hα-helixtrans-82.7-12.3179.1-78.7-165.5-8.700113.9D166D166-Q169 PolarHBondContact O-N 3.41Å
170H54Low56Low153 Ų153128.9 Ų128.971%0.70862%0.616SS**THydrogen-bonded Turntrans-95.83.4176.5-68.2-24.7000114.6V172H170-V172 PolarHBondContact O-N 3.28Å
171F51.3Low56.4Low158 Ų158127.9 Ų127.969%0.69360%0.603SS**  trans-80.248.3166.6-76.5-82.2000112.1L167 Y173L167-F171 WeakPolarHBondContact O-CD2 3.39Å; L167-F171 WeakPolarHBondContact O-CE2 3.37Å; F171-Y173 PolarHBondContact O-N 2.79Å
172V56.8Low56.7Low119 Ų119127.5 Ų127.572%0.72161%0.605SS**SBendtrans-75.2116.8149.8178.80000103.6H170 D174H170-V172 PolarHBondContact O-N 3.28Å; V172-D174 VanDerWaalsContact C-N 3.31Å; V172-D174 PolarHBondContact O-N 2.92Å
173Y56.5Low56.9Low175 Ų175123.3 Ų123.369%0.68660%0.596SS**  trans-44.197.2178.9-89.4-94.2000110.1F171 H175F171-Y173 PolarHBondContact O-N 2.79Å; Y173-H175 PolarHBondContact O-N 2.94Å; Y173-H175 VanDerWaalsContact O-N 3.11Å; Y173-H175 PolarHBondContact O-ND1 3.01Å
174D55.6Low56.7Low98 Ų98122.4 Ų122.452%0.52460%0.595SS.*  trans-59.3121.4177.5-165.60.5000105.1V172 V176 F177 A178V172-D174 VanDerWaalsContact C-N 3.31Å; V172-D174 PolarHBondContact O-N 2.92Å; D174-V176 PolarHBondContact O-N 3.29Å; D174-F177 HydrophobicContact CB-CB 3.96Å; D174-F177 WeakPolarHBondContact O-CA 3.4Å; D174-F177 WeakPolarHBondContact O-CB 3.21Å; D174-F177 PolarHBondContact O-N 3.17Å; D174-A178 PolarHBondContact O-N 2.91Å
175H56.4Low56.6Low155 Ų155125 Ų12572%0.71860%0.604SS**Hα-helixtrans-59.2-24.2-178.5-73.36.4000110.1Y173 E179Y173-H175 PolarHBondContact O-N 2.94Å; Y173-H175 VanDerWaalsContact O-N 3.11Å; Y173-H175 PolarHBondContact O-ND1 3.01Å; H175-E179 WeakPolarHBondContact O-CB 3.5Å; H175-E179 PolarHBondContact O-N 2.97Å
176V61.1Low56.8Low88 Ų88120.9 Ų120.953%0.53360%0.601SS.*Hα-helixtrans-68.6-35.3170.1-170.80000112.6D174 K180D174-V176 PolarHBondContact O-N 3.29Å; V176-K180 WeakPolarHBondContact O-CB 3.36Å; V176-K180 PolarHBondContact O-N 3.21Å
177F60.3Low57Low109 Ų109123.1 Ų123.148%0.47861%0.609SS.*Hα-helixtrans-76-39.7175.6-174.9-105.7000112D174 K180 I181D174-F177 HydrophobicContact CB-CB 3.96Å; D174-F177 WeakPolarHBondContact O-CA 3.4Å; D174-F177 WeakPolarHBondContact O-CB 3.21Å; D174-F177 PolarHBondContact O-N 3.17Å; F177-K180 PolarHBondContact O-N 2.98Å; F177-I181 HydrophobicContact CD1-CD1 3.57Å; F177-I181 HydrophobicContact CD1-CG1 4.43Å; F177-I181 HydrophobicContact CE1-CD1 3.21Å; F177-I181 HydrophobicContact CE1-CG1 4.23Å; F177-I181 HydrophobicContact CE2-CD1 4.44Å; F177-I181 HydrophobicContact CG-CD1 4.34Å; F177-I181 HydrophobicContact CZ-CD1 3.7Å; F177-I181 HydrophobicContact CZ-CG1 4.36Å; F177-I181 VanDerWaalsContact O-CG1 3.31Å; F177-I181 WeakPolarHBondContact O-CG1 3.38Å; F177-I181 PolarHBondContact O-N 3.39Å
178A61.8Low57.2Low34 Ų34120.6 Ų120.628%0.28160%0.599SS.*Hα-helixtrans-65.3-39.617200000111.5D174 I181 T182D174-A178 PolarHBondContact O-N 2.91Å; A178-I181 PolarHBondContact O-N 2.95Å; A178-T182 VanDerWaalsContact O-CB 3.3Å; A178-T182 WeakPolarHBondContact O-CB 3.47Å; A178-T182 PolarHBondContact O-N 3.2Å; A178-T182 PolarHBondContact O-OG1 3.27Å
179E59.7Low58.1Low139 Ų139113.2 Ų113.265%0.6558%0.578SS**Hα-helixtrans-66.9-36.5173.3-167.9173.6-152.500111.3H175 T182 S183H175-E179 WeakPolarHBondContact O-CB 3.5Å; H175-E179 PolarHBondContact O-N 2.97Å; E179-T182 PolarHBondContact O-N 3.42Å; E179-S183 WeakPolarHBondContact O-CB 3.33Å; E179-S183 PolarHBondContact O-N 2.97Å
180K59.4Low59.5Low141 Ų141109.9 Ų109.961%0.61357%0.571SS**Hα-helixtrans-67.4-38.9171.9-124.5169.8-179.4-179.60113.5V176 F177 L184V176-K180 WeakPolarHBondContact O-CB 3.36Å; V176-K180 PolarHBondContact O-N 3.21Å; F177-K180 PolarHBondContact O-N 2.98Å; K180-L184 WeakPolarHBondContact O-CB 3.45Å; K180-L184 WeakPolarHBondContact O-CD1 3.45Å; K180-L184 WeakPolarHBondContact O-CG 3.39Å; K180-L184 PolarHBondContact O-N 2.89Å
181I61.9Low60.7Low70 Ų70108 Ų10836%0.35957%0.566SS.*Hα-helixtrans-68.4-42.5174.4-69.6168.4000110.1F177 A178 S183 L184 Q185F177-I181 HydrophobicContact CD1-CD1 3.57Å; F177-I181 HydrophobicContact CD1-CG1 4.43Å; F177-I181 HydrophobicContact CE1-CD1 3.21Å; F177-I181 HydrophobicContact CE1-CG1 4.23Å; F177-I181 HydrophobicContact CE2-CD1 4.44Å; F177-I181 HydrophobicContact CG-CD1 4.34Å; F177-I181 HydrophobicContact CZ-CD1 3.7Å; F177-I181 HydrophobicContact CZ-CG1 4.36Å; F177-I181 VanDerWaalsContact O-CG1 3.31Å; F177-I181 WeakPolarHBondContact O-CG1 3.38Å; F177-I181 PolarHBondContact O-N 3.39Å; A178-I181 PolarHBondContact O-N 2.95Å; I181-S183 VanDerWaalsContact C-N 3.32Å; I181-S183 PolarHBondContact O-N 3.11Å; I181-L184 PolarHBondContact O-N 3.37Å; I181-Q185 VanDerWaalsContact O-CB 3.29Å; I181-Q185 WeakPolarHBondContact O-CB 3.35Å; I181-Q185 PolarHBondContact O-N 2.93Å
182T60.4Low62.3Low96 Ų96105.6 Ų105.659%0.58956%0.557SS**Hα-helixtrans-67-34.6177.2-490000111.4A178 E179 Q185 S186A178-T182 VanDerWaalsContact O-CB 3.3Å; A178-T182 WeakPolarHBondContact O-CB 3.47Å; A178-T182 PolarHBondContact O-N 3.2Å; A178-T182 PolarHBondContact O-OG1 3.27Å; E179-T182 PolarHBondContact O-N 3.42Å; T182-Q185 PolarHBondContact O-N 3.29Å; T182-S186 PolarHBondContact O-N 3.04Å; T182-S186 VanDerWaalsContact O-N 3.14Å
183S58.1Low63.8Low70 Ų70104.7 Ų104.749%0.4955%0.545SS..Hα-helixtrans-72.5-31.3172.5159.80000113.6E179 I181 S186E179-S183 WeakPolarHBondContact O-CB 3.33Å; E179-S183 PolarHBondContact O-N 2.97Å; I181-S183 VanDerWaalsContact C-N 3.32Å; I181-S183 PolarHBondContact O-N 3.11Å; S183-S186 PolarHBondContact O-OG 3.04Å
184L54.7Low65.4Low121 Ų121102.7 Ų102.763%0.63454%0.542SS*.Hα-helixtrans-75.1-31.2171.8-76.7164.2000111.1K180 I181 S186 Q187K180-L184 WeakPolarHBondContact O-CB 3.45Å; K180-L184 WeakPolarHBondContact O-CD1 3.45Å; K180-L184 WeakPolarHBondContact O-CG 3.39Å; K180-L184 PolarHBondContact O-N 2.89Å; I181-L184 PolarHBondContact O-N 3.37Å; L184-S186 VanDerWaalsContact C-N 3.29Å; L184-Q187 PolarHBondContact O-N 3.05Å
185Q53Low67.1Low158 Ų158102.1 Ų102.174%0.73854%0.539SS*.THydrogen-bonded Turntrans-79.2-8.6175.6-165.515813.500113.5I181 T182I181-Q185 VanDerWaalsContact O-CB 3.29Å; I181-Q185 WeakPolarHBondContact O-CB 3.35Å; I181-Q185 PolarHBondContact O-N 2.93Å; T182-Q185 PolarHBondContact O-N 3.29Å
186S57.1Low68.8Low91 Ų9199 Ų9964%0.63652%0.524SS*.THydrogen-bonded Turntrans-87.9-8.4169.4660000113.9T182 S183 L184T182-S186 PolarHBondContact O-N 3.04Å; T182-S186 VanDerWaalsContact O-N 3.14Å; S183-S186 PolarHBondContact O-OG 3.04Å; L184-S186 VanDerWaalsContact C-N 3.29Å
187Q60.7Low70.4Confident138 Ų138100.4 Ų100.465%0.64553%0.525SS*.SBendtrans-80.4122.5164-73.2-76.7-2500106.5L184 S189L184-Q187 PolarHBondContact O-N 3.05Å; Q187-S189 PolarHBondContact O-N 3.18Å
188P60.9Low72.1Confident59 Ų59100.6 Ų100.638%0.38353%0.53SS..PPolyproline II helixtrans-56.2128177.226.2-33.4000107.8E192 E193P188-E192 WeakPolarHBondContact CA-OE2 3.08Å; P188-E192 HydrophobicContact CB-CB 4.37Å; P188-E193 HydrophobicContact CB-CG 3.84Å; P188-E193 HydrophobicContact CG-CG 3.82Å; P188-E193 WeakPolarHBondContact CG-OE1 3.44Å
189S71.6Confident73.7Confident46 Ų46103.8 Ų103.832%0.32254%0.538SS..PPolyproline II helixtrans-58.9147.517356.20000108.6Q187 D191 E192 E193Q187-S189 PolarHBondContact O-N 3.18Å; S189-D191 PolarHBondContact O-N 3.47Å; S189-E192 PolarHBondContact N-OE2 3.43Å; S189-E192 WeakPolarHBondContact O-CA 3.24Å; S189-E192 WeakPolarHBondContact O-CB 3.42Å; S189-E192 PolarHBondContact O-N 3.44Å; S189-E192 VanDerWaalsContact OG-CG 3.22Å; S189-E192 WeakPolarHBondContact OG-CG 3.43Å; S189-E192 PolarHBondContact OG-N 3.27Å; S189-E192 PolarHBondContact OG-OE2 3.47Å; S189-E193 PolarHBondContact O-N 3.27Å; S189-E193 VanDerWaalsContact O-N 3.14Å
190P77.4Confident75.5Confident90 Ų90103.1 Ų103.158%0.58453%0.532SS*.Hα-helixtrans-52.6-33.8179.819.3-31.8000111.9E192 E193 E194P190-E192 PolarHBondContact O-N 3.45Å; P190-E193 PolarHBondContact O-N 3.13Å; P190-E194 WeakPolarHBondContact O-CG 3.35Å; P190-E194 PolarHBondContact O-N 3.02Å
191D81.1Confident77.3Confident114 Ų11499.1 Ų99.161%0.6152%0.52SS*.Hα-helixtrans-65.9-33.7175-57.7-16.7000113.1S189 N195S189-D191 PolarHBondContact O-N 3.47Å; D191-N195 VanDerWaalsContact O-CB 3.24Å; D191-N195 WeakPolarHBondContact O-CB 3.44Å; D191-N195 PolarHBondContact O-N 3.23Å
192E85Confident79Confident107 Ų10798.9 Ų98.950%0.552%0.522SS..Hα-helixtrans-72.4-38.5175.2-77.8166.2157.500111.9P188 S189 P190 N195 E196P188-E192 WeakPolarHBondContact CA-OE2 3.08Å; P188-E192 HydrophobicContact CB-CB 4.37Å; S189-E192 PolarHBondContact N-OE2 3.43Å; S189-E192 WeakPolarHBondContact O-CA 3.24Å; S189-E192 WeakPolarHBondContact O-CB 3.42Å; S189-E192 PolarHBondContact O-N 3.44Å; S189-E192 VanDerWaalsContact OG-CG 3.22Å; S189-E192 WeakPolarHBondContact OG-CG 3.43Å; S189-E192 PolarHBondContact OG-N 3.27Å; S189-E192 PolarHBondContact OG-OE2 3.47Å; P190-E192 PolarHBondContact O-N 3.45Å; E192-N195 PolarHBondContact O-N 3.37Å; E192-E196 WeakPolarHBondContact O-CG 3.37Å; E192-E196 PolarHBondContact O-N 2.94Å
193E87.1Confident80.8Confident100 Ų10098.3 Ų98.347%0.46752%0.518SS..Hα-helixtrans-63.3-47.1173.4-62.5-171.3156.900110.6P188 S189 P190 N195 E196 H197P188-E193 HydrophobicContact CB-CG 3.84Å; P188-E193 HydrophobicContact CG-CG 3.82Å; P188-E193 WeakPolarHBondContact CG-OE1 3.44Å; S189-E193 PolarHBondContact O-N 3.27Å; S189-E193 VanDerWaalsContact O-N 3.14Å; P190-E193 PolarHBondContact O-N 3.13Å; E193-N195 VanDerWaalsContact C-N 3.29Å; E193-N195 PolarHBondContact O-N 3.22Å; E193-E196 PolarHBondContact O-N 2.9Å; E193-H197 WeakPolarHBondContact O-CB 3.36Å; E193-H197 PolarHBondContact O-CD2 2.89Å; E193-H197 PolarHBondContact O-N 2.92Å
194E90.9Very high82.7Confident133 Ų133100.3 Ų100.362%0.62152%0.521SS*.Hα-helixtrans-59.2-39.7174.7-74.3-176.1-172.600112P190 H197 L198P190-E194 WeakPolarHBondContact O-CG 3.35Å; P190-E194 PolarHBondContact O-N 3.02Å; E194-H197 PolarHBondContact O-N 2.89Å; E194-L198 VanDerWaalsContact O-CB 3.29Å; E194-L198 WeakPolarHBondContact O-CB 3.48Å; E194-L198 PolarHBondContact O-N 3.43Å
195N90Very high84.7Confident86 Ų8699.4 Ų99.446%0.4652%0.516SS..Hα-helixtrans-67.8-39.7177.1-157.9-23000111.8D191 E192 E193 L198 K199D191-N195 VanDerWaalsContact O-CB 3.24Å; D191-N195 WeakPolarHBondContact O-CB 3.44Å; D191-N195 PolarHBondContact O-N 3.23Å; E192-N195 PolarHBondContact O-N 3.37Å; E193-N195 VanDerWaalsContact C-N 3.29Å; E193-N195 PolarHBondContact O-N 3.22Å; N195-L198 PolarHBondContact O-N 3Å; N195-K199 WeakPolarHBondContact O-CB 3.28Å; N195-K199 VanDerWaalsContact O-CG 3.25Å; N195-K199 WeakPolarHBondContact O-CG 3.47Å; N195-K199 PolarHBondContact O-N 2.94Å; N195-K199 VanDerWaalsContact OD1-CE 3.31Å; N195-K199 WeakPolarHBondContact OD1-CE 3.34Å
196E92.8Very high86.9Confident90 Ų9097.6 Ų97.642%0.42151%0.508SS..Hα-helixtrans-66.6-38.6172.8-73.7-57124.500112.3E192 E193 K199 K200E192-E196 WeakPolarHBondContact O-CG 3.37Å; E192-E196 PolarHBondContact O-N 2.94Å; E193-E196 PolarHBondContact O-N 2.9Å; E196-K199 PolarHBondContact O-N 3.16Å; E196-K199 WeakPolarHBondContact OE1-CD 3.43Å; E196-K199 IonicContact OE1-NZ 2.72Å; E196-K199 PolarHBondContact OE1-NZ 3.39Å; E196-K200 WeakPolarHBondContact O-CB 3.48Å; E196-K200 VanDerWaalsContact O-CG 3.24Å; E196-K200 WeakPolarHBondContact O-CG 3.48Å; E196-K200 PolarHBondContact O-N 2.87Å
197H93.9Very high88.8Confident117 Ų11796 Ų9654%0.54250%0.5SS..Hα-helixtrans-62.6-43.9171.6-79.9-68.6000111.5E193 E194 K200 T201E193-H197 WeakPolarHBondContact O-CB 3.36Å; E193-H197 PolarHBondContact O-CD2 2.89Å; E193-H197 PolarHBondContact O-N 2.92Å; E194-H197 PolarHBondContact O-N 2.89Å; H197-K200 WeakPolarHBondContact O-CB 3.39Å; H197-K200 PolarHBondContact O-N 3.27Å; H197-T201 WeakPolarHBondContact O-CG2 3.31Å; H197-T201 PolarHBondContact O-N 2.91Å; H197-T201 PolarHBondContact O-OG1 3.44Å
198L96.3Very high90.5Very high112 Ų11294.5 Ų94.559%0.58649%0.493SS*.Hα-helixtrans-67.1-38178.6-159.367.8000111.7E194 N195 T201 V202E194-L198 VanDerWaalsContact O-CB 3.29Å; E194-L198 WeakPolarHBondContact O-CB 3.48Å; E194-L198 PolarHBondContact O-N 3.43Å; N195-L198 PolarHBondContact O-N 3Å; L198-T201 WeakPolarHBondContact CA-OG1 3.46Å; L198-T201 PolarHBondContact O-N 3.37Å; L198-T201 PolarHBondContact O-OG1 2.89Å; L198-V202 WeakPolarHBondContact O-CB 3.31Å; L198-V202 WeakPolarHBondContact O-CG2 3.43Å; L198-V202 PolarHBondContact O-N 2.97Å
199K96.6Very high92.3Very high102 Ų10296 Ų9644%0.44350%0.497SS..Hα-helixtrans-62.1-43.5171.5-73.4171.8-163.2167.30111.5N195 E196 V202 T203N195-K199 WeakPolarHBondContact O-CB 3.28Å; N195-K199 VanDerWaalsContact O-CG 3.25Å; N195-K199 WeakPolarHBondContact O-CG 3.47Å; N195-K199 PolarHBondContact O-N 2.94Å; N195-K199 VanDerWaalsContact OD1-CE 3.31Å; N195-K199 WeakPolarHBondContact OD1-CE 3.34Å; E196-K199 PolarHBondContact O-N 3.16Å; E196-K199 WeakPolarHBondContact OE1-CD 3.43Å; E196-K199 IonicContact OE1-NZ 2.72Å; E196-K199 PolarHBondContact OE1-NZ 3.39Å; K199-V202 PolarHBondContact O-N 3.44Å; K199-T203 WeakPolarHBondContact O-CG2 3.21Å; K199-T203 PolarHBondContact O-N 3.49Å; K199-T203 PolarHBondContact O-OG1 2.75Å
200K96.9Very high93.5Very high124 Ų12497 Ų9754%0.53951%0.505SS..Hα-helixtrans-63.4-40.4176.2-72.3167.3-173170.10112.2E196 H197 T203 M204E196-K200 WeakPolarHBondContact O-CB 3.48Å; E196-K200 VanDerWaalsContact O-CG 3.24Å; E196-K200 WeakPolarHBondContact O-CG 3.48Å; E196-K200 PolarHBondContact O-N 2.87Å; H197-K200 WeakPolarHBondContact O-CB 3.39Å; H197-K200 PolarHBondContact O-N 3.27Å; K200-T203 PolarHBondContact O-OG1 3.17Å; K200-M204 VanDerWaalsContact O-CB 3.29Å; K200-M204 WeakPolarHBondContact O-CB 3.43Å; K200-M204 PolarHBondContact O-N 2.9Å
201T97.6Very high94.5Very high58 Ų5896.8 Ų96.836%0.35650%0.498SS..Hα-helixtrans-69.8-39.1176.558.20000111.3H197 L198 M204 L205H197-T201 WeakPolarHBondContact O-CG2 3.31Å; H197-T201 PolarHBondContact O-N 2.91Å; H197-T201 PolarHBondContact O-OG1 3.44Å; L198-T201 WeakPolarHBondContact CA-OG1 3.46Å; L198-T201 PolarHBondContact O-N 3.37Å; L198-T201 PolarHBondContact O-OG1 2.89Å; T201-M204 PolarHBondContact O-N 2.96Å; T201-L205 WeakPolarHBondContact O-CB 3.39Å; T201-L205 VanDerWaalsContact O-CG 3.24Å; T201-L205 WeakPolarHBondContact O-CG 3.09Å; T201-L205 PolarHBondContact O-N 3.32Å
202V97.4Very high95.3Very high65 Ų6595.6 Ų95.639%0.39449%0.489SS..Hα-helixtrans-62.7-45.1175.1168.70000111.3L198 K199 L205 Q206L198-V202 WeakPolarHBondContact O-CB 3.31Å; L198-V202 WeakPolarHBondContact O-CG2 3.43Å; L198-V202 PolarHBondContact O-N 2.97Å; K199-V202 PolarHBondContact O-N 3.44Å; V202-L205 PolarHBondContact O-N 2.96Å; V202-Q206 HydrophobicContact CG1-CG 4.4Å; V202-Q206 WeakPolarHBondContact O-CB 3.41Å; V202-Q206 WeakPolarHBondContact O-CG 3.32Å; V202-Q206 PolarHBondContact O-N 3.31Å
203T97.7Very high95.9Very high83 Ų8398.1 Ų98.151%0.50949%0.494SS..Hα-helixtrans-66.3-38.5177.555.80000112K199 K200 Q206 A207K199-T203 WeakPolarHBondContact O-CG2 3.21Å; K199-T203 PolarHBondContact O-N 3.49Å; K199-T203 PolarHBondContact O-OG1 2.75Å; K200-T203 PolarHBondContact O-OG1 3.17Å; T203-Q206 PolarHBondContact O-N 2.91Å; T203-A207 WeakPolarHBondContact O-CB 3.48Å; T203-A207 PolarHBondContact O-N 3.42Å
204M97.7Very high96.4Very high113 Ų11399.5 Ų99.556%0.55750%0.5SS*.Hα-helixtrans-62.2-47.6173.3-179.3179.668.300111.8K200 T201 Q206 A207 Q208K200-M204 VanDerWaalsContact O-CB 3.29Å; K200-M204 WeakPolarHBondContact O-CB 3.43Å; K200-M204 PolarHBondContact O-N 2.9Å; T201-M204 PolarHBondContact O-N 2.96Å; M204-Q206 VanDerWaalsContact C-N 3.32Å; M204-Q206 PolarHBondContact O-N 2.94Å; M204-A207 PolarHBondContact O-N 3.21Å; M204-Q208 WeakPolarHBondContact O-CB 3.41Å; M204-Q208 PolarHBondContact O-N 3.22Å
205L97.7Very high96.7Very high101 Ų10197.7 Ų97.753%0.52949%0.49SS..Hα-helixtrans-64.9-36.2177.6-71.9173.9000111.8T201 V202 Q208 L209T201-L205 WeakPolarHBondContact O-CB 3.39Å; T201-L205 VanDerWaalsContact O-CG 3.24Å; T201-L205 WeakPolarHBondContact O-CG 3.09Å; T201-L205 PolarHBondContact O-N 3.32Å; V202-L205 PolarHBondContact O-N 2.96Å; L205-Q208 PolarHBondContact O-N 3.47Å; L205-L209 VanDerWaalsContact O-CB 3.3Å; L205-L209 WeakPolarHBondContact O-CB 3.48Å; L205-L209 PolarHBondContact O-N 3.01Å
206Q97.9Very high97.1Very high121 Ų121101.7 Ų101.757%0.56550%0.499SS*.Hα-helixtrans-63.7-42.1173-76.7172.7-6.300112V202 T203 M204 L209 S210V202-Q206 HydrophobicContact CG1-CG 4.4Å; V202-Q206 WeakPolarHBondContact O-CB 3.41Å; V202-Q206 WeakPolarHBondContact O-CG 3.32Å; V202-Q206 PolarHBondContact O-N 3.31Å; T203-Q206 PolarHBondContact O-N 2.91Å; M204-Q206 VanDerWaalsContact C-N 3.32Å; M204-Q206 PolarHBondContact O-N 2.94Å; Q206-L209 PolarHBondContact O-N 2.93Å; Q206-S210 PolarHBondContact O-N 3.3Å; Q206-S210 PolarHBondContact O-OG 3.28Å
207A97.1Very high97.3Very high56 Ų56100.9 Ų100.946%0.46350%0.5SS..Hα-helixtrans-67.8-37.8175.200000112.3T203 M204 S210 L211T203-A207 WeakPolarHBondContact O-CB 3.48Å; T203-A207 PolarHBondContact O-N 3.42Å; M204-A207 PolarHBondContact O-N 3.21Å; A207-S210 PolarHBondContact O-N 3.45Å; A207-S210 PolarHBondContact O-OG 3.4Å; A207-L211 WeakPolarHBondContact O-CB 3.36Å; A207-L211 PolarHBondContact O-N 2.92Å
208Q97.2Very high97.5Very high107 Ų10798 Ų9850%0.549%0.49SS..Hα-helixtrans-65.8-42.3174.4-171.7176.3-1.400111.1M204 L205 S210 L211 E212M204-Q208 WeakPolarHBondContact O-CB 3.41Å; M204-Q208 PolarHBondContact O-N 3.22Å; L205-Q208 PolarHBondContact O-N 3.47Å; Q208-S210 PolarHBondContact O-N 3.43Å; Q208-L211 PolarHBondContact O-N 3.26Å; Q208-E212 WeakPolarHBondContact O-CB 3.41Å; Q208-E212 WeakPolarHBondContact O-CG 3.34Å; Q208-E212 PolarHBondContact O-N 2.9Å
209L97.9Very high97.5Very high90 Ų9098.2 Ų98.247%0.47149%0.49SS..Hα-helixtrans-63.8-39.6176.1-177.667.1000112.1L205 Q206 R213L205-L209 VanDerWaalsContact O-CB 3.3Å; L205-L209 WeakPolarHBondContact O-CB 3.48Å; L205-L209 PolarHBondContact O-N 3.01Å; Q206-L209 PolarHBondContact O-N 2.93Å; L209-R213 WeakPolarHBondContact O-CB 3.29Å; L209-R213 VanDerWaalsContact O-CG 3.25Å; L209-R213 WeakPolarHBondContact O-CG 3.34Å; L209-R213 PolarHBondContact O-N 3.4Å
210S97.3Very high97.6Very high69 Ų6998.1 Ų98.148%0.48349%0.491SS..Hα-helixtrans-67.5-39.2176.664.80000111.9Q206 A207 Q208 R213 Q214Q206-S210 PolarHBondContact O-N 3.3Å; Q206-S210 PolarHBondContact O-OG 3.28Å; A207-S210 PolarHBondContact O-N 3.45Å; A207-S210 PolarHBondContact O-OG 3.4Å; Q208-S210 PolarHBondContact O-N 3.43Å; S210-R213 PolarHBondContact O-N 3.4Å; S210-Q214 PolarHBondContact O-N 2.95Å
211L97.9Very high97.6Very high84 Ų8498.2 Ų98.244%0.4449%0.493SS..Hα-helixtrans-63.3-45.9174.2-178.764.4000111.7A207 Q208 R213 Q214 K215A207-L211 WeakPolarHBondContact O-CB 3.36Å; A207-L211 PolarHBondContact O-N 2.92Å; Q208-L211 PolarHBondContact O-N 3.26Å; L211-R213 VanDerWaalsContact C-N 3.32Å; L211-R213 PolarHBondContact O-N 2.83Å; L211-Q214 PolarHBondContact O-N 3.24Å; L211-K215 WeakPolarHBondContact O-CG 3.44Å; L211-K215 PolarHBondContact O-N 2.99Å
212E97.6Very high97.6Very high89 Ų89100.6 Ų100.642%0.41650%0.5SS..Hα-helixtrans-64.7-36.4177-73.1-55.3129.500112.2Q208 K215 R216Q208-E212 WeakPolarHBondContact O-CB 3.41Å; Q208-E212 WeakPolarHBondContact O-CG 3.34Å; Q208-E212 PolarHBondContact O-N 2.9Å; E212-K215 PolarHBondContact O-N 3.37Å; E212-K215 IonicContact OE1-NZ 3.94Å; E212-K215 PolarHBondContact OE1-NZ 3Å; E212-R216 WeakPolarHBondContact O-CB 3.37Å; E212-R216 PolarHBondContact O-N 2.87Å
213R98Very high97.6Very high161 Ų161104.6 Ų104.661%0.60851%0.51SS*.Hα-helixtrans-62.2-43.4171.6-77.1172.2177.4178.2-0.2111.9L209 S210 L211 R216 V217L209-R213 WeakPolarHBondContact O-CB 3.29Å; L209-R213 VanDerWaalsContact O-CG 3.25Å; L209-R213 WeakPolarHBondContact O-CG 3.34Å; L209-R213 PolarHBondContact O-N 3.4Å; S210-R213 PolarHBondContact O-N 3.4Å; L211-R213 VanDerWaalsContact C-N 3.32Å; L211-R213 PolarHBondContact O-N 2.83Å; R213-R216 PolarHBondContact O-N 2.85Å; R213-V217 WeakPolarHBondContact O-CG2 3.26Å; R213-V217 PolarHBondContact O-N 3.04Å
214Q98Very high97.6Very high128 Ų128101.9 Ų101.960%0.59850%0.498SS*.Hα-helixtrans-63.5-47.7177.5-176.1176.2500111.2S210 L211 R216 V217 T218S210-Q214 PolarHBondContact O-N 2.95Å; L211-Q214 PolarHBondContact O-N 3.24Å; Q214-R216 VanDerWaalsContact C-N 3.28Å; Q214-R216 PolarHBondContact O-N 3.12Å; Q214-V217 PolarHBondContact O-N 2.94Å; Q214-V217 VanDerWaalsContact O-N 3.14Å; Q214-T218 PolarHBondContact O-N 3.43Å
215K97.9Very high97.6Very high95 Ų95101.2 Ų101.241%0.41350%0.496SS..Hα-helixtrans-57.4-42.5174.9-71177.3-174.3169.40111.8L211 E212 V217 T218 M219L211-K215 WeakPolarHBondContact O-CG 3.44Å; L211-K215 PolarHBondContact O-N 2.99Å; E212-K215 PolarHBondContact O-N 3.37Å; E212-K215 IonicContact OE1-NZ 3.94Å; E212-K215 PolarHBondContact OE1-NZ 3Å; K215-V217 VanDerWaalsContact C-N 3.32Å; K215-V217 PolarHBondContact O-N 3.35Å; K215-T218 WeakPolarHBondContact CA-OG1 3.37Å; K215-T218 PolarHBondContact O-N 3.46Å; K215-T218 PolarHBondContact O-OG1 3.35Å; K215-M219 WeakPolarHBondContact O-CB 3.36Å; K215-M219 WeakPolarHBondContact O-CG 3.43Å; K215-M219 PolarHBondContact O-N 3.39Å
216R97.7Very high97.7Very high170 Ų170100.3 Ų100.364%0.64250%0.495SS*.Hα-helixtrans-59.8-43.9176.9179.7178.5168.2163.61.6111.6E212 R213 Q214 M219 E220E212-R216 WeakPolarHBondContact O-CB 3.37Å; E212-R216 PolarHBondContact O-N 2.87Å; R213-R216 PolarHBondContact O-N 2.85Å; Q214-R216 VanDerWaalsContact C-N 3.28Å; Q214-R216 PolarHBondContact O-N 3.12Å; R216-M219 PolarHBondContact O-N 2.89Å; R216-E220 HydrophobicContact CG-CG 4.43Å; R216-E220 IonicContact CZ-OE1 3.37Å; R216-E220 IonicContact NE-OE1 3.18Å; R216-E220 PolarHBondContact NE-OE1 2.98Å; R216-E220 IonicContact NH2-OE1 3.05Å; R216-E220 PolarHBondContact NH2-OE1 3.45Å; R216-E220 WeakPolarHBondContact O-CB 3.43Å; R216-E220 WeakPolarHBondContact O-CG 3.47Å; R216-E220 PolarHBondContact O-N 2.75Å
217V98.1Very high97.7Very high73 Ų7398.5 Ų98.544%0.44249%0.489SS..Hα-helixtrans-63.5-45.4177.6172.90000111R213 Q214 K215 M219 E220 E221R213-V217 WeakPolarHBondContact O-CG2 3.26Å; R213-V217 PolarHBondContact O-N 3.04Å; Q214-V217 PolarHBondContact O-N 2.94Å; Q214-V217 VanDerWaalsContact O-N 3.14Å; K215-V217 VanDerWaalsContact C-N 3.32Å; K215-V217 PolarHBondContact O-N 3.35Å; V217-M219 VanDerWaalsContact C-N 3.34Å; V217-M219 PolarHBondContact O-N 3.32Å; V217-E220 PolarHBondContact O-N 3.05Å; V217-E221 WeakPolarHBondContact O-CG 3.41Å; V217-E221 PolarHBondContact O-N 3.01Å
218T97.8Very high97.7Very high56 Ų56101.9 Ų101.934%0.34449%0.493SS..Hα-helixtrans-63.1-41.6178.259.90000111.8Q214 K215 E221 E222Q214-T218 PolarHBondContact O-N 3.43Å; K215-T218 WeakPolarHBondContact CA-OG1 3.37Å; K215-T218 PolarHBondContact O-N 3.46Å; K215-T218 PolarHBondContact O-OG1 3.35Å; T218-E221 PolarHBondContact O-N 3.47Å; T218-E222 WeakPolarHBondContact O-CG 3.33Å; T218-E222 PolarHBondContact O-N 2.99Å
219M95.6Very high97.8Very high117 Ų117102.4 Ų102.458%0.57650%0.495SS*.Hα-helixtrans-66.2-36.9175.6-64.8-63.8-64.700112.1K215 R216 V217 E222 Y223K215-M219 WeakPolarHBondContact O-CB 3.36Å; K215-M219 WeakPolarHBondContact O-CG 3.43Å; K215-M219 PolarHBondContact O-N 3.39Å; R216-M219 PolarHBondContact O-N 2.89Å; V217-M219 VanDerWaalsContact C-N 3.34Å; V217-M219 PolarHBondContact O-N 3.32Å; M219-E222 PolarHBondContact O-N 3.01Å; M219-Y223 VanDerWaalsContact O-CB 3.25Å; M219-Y223 WeakPolarHBondContact O-CB 3.37Å; M219-Y223 PolarHBondContact O-N 3.49Å
220E97.9Very high97.7Very high101 Ų101101.9 Ų101.947%0.47249%0.493SS..Hα-helixtrans-65.2-37.9174.5-80.4176.7-172.600111.6R216 V217 G224R216-E220 HydrophobicContact CG-CG 4.43Å; R216-E220 IonicContact CZ-OE1 3.37Å; R216-E220 IonicContact NE-OE1 3.18Å; R216-E220 PolarHBondContact NE-OE1 2.98Å; R216-E220 IonicContact NH2-OE1 3.05Å; R216-E220 PolarHBondContact NH2-OE1 3.45Å; R216-E220 WeakPolarHBondContact O-CB 3.43Å; R216-E220 WeakPolarHBondContact O-CG 3.47Å; R216-E220 PolarHBondContact O-N 2.75Å; V217-E220 PolarHBondContact O-N 3.05Å; E220-G224 PolarHBondContact O-N 3.38Å
221E98.1Very high97.7Very high125 Ų125100.9 Ų100.958%0.58449%0.486SS*.Hα-helixtrans-65.2-48173.8-71.9172.317900111.8V217 T218 G224 L225V217-E221 WeakPolarHBondContact O-CG 3.41Å; V217-E221 PolarHBondContact O-N 3.01Å; T218-E221 PolarHBondContact O-N 3.47Å; E221-G224 WeakPolarHBondContact O-CA 3.39Å; E221-G224 PolarHBondContact O-N 3.47Å; E221-G224 VanDerWaalsContact O-N 3.14Å; E221-L225 WeakPolarHBondContact O-CG 3.46Å; E221-L225 PolarHBondContact O-N 2.85Å
222E97.6Very high97.7Very high108 Ų108102.2 Ų102.251%0.50549%0.49SS..Hα-helixtrans-60.1-45.5176.1-72.5174.117900111.6T218 M219 G224 L225 V226T218-E222 WeakPolarHBondContact O-CG 3.33Å; T218-E222 PolarHBondContact O-N 2.99Å; M219-E222 PolarHBondContact O-N 3.01Å; E222-G224 VanDerWaalsContact C-N 3.28Å; E222-G224 PolarHBondContact O-N 2.67Å; E222-L225 WeakPolarHBondContact O-CB 3.29Å; E222-L225 PolarHBondContact O-N 3.24Å; E222-L225 VanDerWaalsContact O-N 3.1Å; E222-V226 WeakPolarHBondContact O-CG2 3.48Å; E222-V226 PolarHBondContact O-N 3.29Å
223Y96.9Very high97.7Very high150 Ų150103 Ų10359%0.58850%0.497SS*.Hα-helixtrans-60.6-39.5174.5-177.8-106.5000111.7M219 L225 V226 L227M219-Y223 VanDerWaalsContact O-CB 3.25Å; M219-Y223 WeakPolarHBondContact O-CB 3.37Å; M219-Y223 PolarHBondContact O-N 3.49Å; Y223-L225 VanDerWaalsContact C-N 3.31Å; Y223-L225 PolarHBondContact O-N 3.43Å; Y223-V226 PolarHBondContact O-N 3.21Å; Y223-L227 HydrophobicContact CD1-CD1 3.8Å; Y223-L227 HydrophobicContact CD1-CG 4.21Å; Y223-L227 HydrophobicContact CE1-CD1 3.31Å; Y223-L227 HydrophobicContact CE1-CD2 4.36Å; Y223-L227 HydrophobicContact CE1-CG 3.82Å; Y223-L227 HydrophobicContact CE2-CG 4.38Å; Y223-L227 WeakPolarHBondContact O-CB 3.28Å; Y223-L227 WeakPolarHBondContact O-CG 3.38Å; Y223-L227 PolarHBondContact O-N 3.48Å
224G98.1Very high97.7Very high26 Ų26101.5 Ų101.527%0.26850%0.496SS..Hα-helixtrans-61.8-35.317400000113.5E220 E221 E222 K228E220-G224 PolarHBondContact O-N 3.38Å; E221-G224 WeakPolarHBondContact O-CA 3.39Å; E221-G224 PolarHBondContact O-N 3.47Å; E221-G224 VanDerWaalsContact O-N 3.14Å; E222-G224 VanDerWaalsContact C-N 3.28Å; E222-G224 PolarHBondContact O-N 2.67Å; G224-K228 WeakPolarHBondContact O-CG 3.31Å; G224-K228 PolarHBondContact O-N 2.94Å
225L98.1Very high97.7Very high99 Ų99102 Ų10252%0.51850%0.498SS..Hα-helixtrans-69.3-47.7173.8-66.4173.9000111.3E221 E222 Y223 L227 K228 E229E221-L225 WeakPolarHBondContact O-CG 3.46Å; E221-L225 PolarHBondContact O-N 2.85Å; E222-L225 WeakPolarHBondContact O-CB 3.29Å; E222-L225 PolarHBondContact O-N 3.24Å; E222-L225 VanDerWaalsContact O-N 3.1Å; Y223-L225 VanDerWaalsContact C-N 3.31Å; Y223-L225 PolarHBondContact O-N 3.43Å; L225-L227 VanDerWaalsContact C-N 3.28Å; L225-L227 PolarHBondContact O-N 3.04Å; L225-K228 WeakPolarHBondContact O-CB 3.36Å; L225-K228 PolarHBondContact O-N 3.47Å; L225-E229 PolarHBondContact O-N 3.31Å
226V98.1Very high97.7Very high82 Ų82103.1 Ų103.150%0.49751%0.505SS..Hα-helixtrans-60-39.5178.1173.80000111.5E222 Y223 K228 E229 N230E222-V226 WeakPolarHBondContact O-CG2 3.48Å; E222-V226 PolarHBondContact O-N 3.29Å; Y223-V226 PolarHBondContact O-N 3.21Å; V226-K228 VanDerWaalsContact C-N 3.33Å; V226-K228 PolarHBondContact O-N 2.91Å; V226-E229 PolarHBondContact O-N 3.45Å; V226-N230 WeakPolarHBondContact O-CB 3.24Å; V226-N230 PolarHBondContact O-N 3Å
227L98.4Very high97.6Very high83 Ų83101 Ų10144%0.43551%0.506SS..Hα-helixtrans-62.3-39.3174.8-79.8-179.3000112.7Y223 L225 N230 S231Y223-L227 HydrophobicContact CD1-CD1 3.8Å; Y223-L227 HydrophobicContact CD1-CG 4.21Å; Y223-L227 HydrophobicContact CE1-CD1 3.31Å; Y223-L227 HydrophobicContact CE1-CD2 4.36Å; Y223-L227 HydrophobicContact CE1-CG 3.82Å; Y223-L227 HydrophobicContact CE2-CG 4.38Å; Y223-L227 WeakPolarHBondContact O-CB 3.28Å; Y223-L227 WeakPolarHBondContact O-CG 3.38Å; Y223-L227 PolarHBondContact O-N 3.48Å; L225-L227 VanDerWaalsContact C-N 3.28Å; L225-L227 PolarHBondContact O-N 3.04Å; L227-N230 PolarHBondContact O-N 2.86Å; L227-S231 PolarHBondContact O-N 2.85Å
228K98.4Very high97.6Very high127 Ų12799.8 Ų99.855%0.55251%0.508SS*.Hα-helixtrans-65.1-49.1176.2-72.1171.3-176.7176.40110.8G224 L225 V226 N230 S231 E232G224-K228 WeakPolarHBondContact O-CG 3.31Å; G224-K228 PolarHBondContact O-N 2.94Å; L225-K228 WeakPolarHBondContact O-CB 3.36Å; L225-K228 PolarHBondContact O-N 3.47Å; V226-K228 VanDerWaalsContact C-N 3.33Å; V226-K228 PolarHBondContact O-N 2.91Å; K228-N230 VanDerWaalsContact C-N 3.28Å; K228-N230 PolarHBondContact O-N 3.05Å; K228-S231 PolarHBondContact O-N 3.14Å; K228-S231 VanDerWaalsContact O-N 3.12Å; K228-S231 PolarHBondContact O-OG 3.33Å; K228-E232 WeakPolarHBondContact O-CG 3.49Å; K228-E232 PolarHBondContact O-N 3.29Å
229E98.2Very high97.6Very high117 Ų11799.1 Ų99.155%0.54751%0.509SS..Hα-helixtrans-57.1-43176.3-69.1177.4-179.600111.5L225 V226 S231 E232 L233L225-E229 PolarHBondContact O-N 3.31Å; V226-E229 PolarHBondContact O-N 3.45Å; E229-S231 PolarHBondContact O-N 2.9Å; E229-E232 PolarHBondContact O-N 3Å; E229-L233 VanDerWaalsContact O-CG 3.3Å; E229-L233 WeakPolarHBondContact O-CG 3.48Å; E229-L233 PolarHBondContact O-N 2.78Å
230N95.8Very high97.6Very high80 Ų8096.8 Ų96.843%0.42850%0.501SS..Hα-helixtrans-61.4-46.1176.3-164.5-24.5000111.4V226 L227 K228 E232 L233 E234V226-N230 WeakPolarHBondContact O-CB 3.24Å; V226-N230 PolarHBondContact O-N 3Å; L227-N230 PolarHBondContact O-N 2.86Å; K228-N230 VanDerWaalsContact C-N 3.28Å; K228-N230 PolarHBondContact O-N 3.05Å; N230-E232 VanDerWaalsContact C-N 3.28Å; N230-E232 PolarHBondContact O-N 3.08Å; N230-L233 PolarHBondContact O-N 3.16Å; N230-E234 WeakPolarHBondContact O-CG 3.29Å; N230-E234 PolarHBondContact O-N 3.03Å
231S98.1Very high97.6Very high48 Ų4893.4 Ų93.434%0.33649%0.493SS..Hα-helixtrans-62-34.6176.475.60000113.3L227 K228 E229 Q235L227-S231 PolarHBondContact O-N 2.85Å; K228-S231 PolarHBondContact O-N 3.14Å; K228-S231 VanDerWaalsContact O-N 3.12Å; K228-S231 PolarHBondContact O-OG 3.33Å; E229-S231 PolarHBondContact O-N 2.9Å; S231-Q235 VanDerWaalsContact O-CG 3.26Å; S231-Q235 WeakPolarHBondContact O-CG 3.38Å; S231-Q235 PolarHBondContact O-N 2.95Å; S231-Q235 VanDerWaalsContact O-N 3.1Å
232E98.3Very high97.6Very high111 Ų11190.3 Ų90.352%0.51949%0.489SS..Hα-helixtrans-69.8-41.9175.2-71.2174.4-169.200111.4K228 E229 N230 Q235 Q236K228-E232 WeakPolarHBondContact O-CG 3.49Å; K228-E232 PolarHBondContact O-N 3.29Å; E229-E232 PolarHBondContact O-N 3Å; N230-E232 VanDerWaalsContact C-N 3.28Å; N230-E232 PolarHBondContact O-N 3.08Å; E232-Q235 WeakPolarHBondContact O-CB 3.18Å; E232-Q235 PolarHBondContact O-N 2.65Å; E232-Q236 WeakPolarHBondContact O-CG 3.46Å; E232-Q236 PolarHBondContact O-N 3.36Å
233L97.4Very high97.6Very high107 Ų10793.1 Ų93.156%0.5650%0.496SS*.Hα-helixtrans-64.2-41.5175.3-70.8173.1000111.9E229 N230 Q235 Q236 L237E229-L233 VanDerWaalsContact O-CG 3.3Å; E229-L233 WeakPolarHBondContact O-CG 3.48Å; E229-L233 PolarHBondContact O-N 2.78Å; N230-L233 PolarHBondContact O-N 3.16Å; L233-Q235 VanDerWaalsContact C-N 3.32Å; L233-Q235 PolarHBondContact O-N 2.96Å; L233-Q236 PolarHBondContact O-N 3.42Å; L233-L237 WeakPolarHBondContact O-CB 3.35Å; L233-L237 PolarHBondContact O-N 3.32Å
234E97.2Very high97.6Very high128 Ų12894.3 Ų94.360%0.59850%0.5SS*.Hα-helixtrans-60.6-41.7173.8-74.8-178.7166.900111.6N230 L237 G238N230-E234 WeakPolarHBondContact O-CG 3.29Å; N230-E234 PolarHBondContact O-N 3.03Å; E234-L237 PolarHBondContact O-N 2.82Å; E234-G238 PolarHBondContact O-N 3.27Å
235Q97.6Very high97.6Very high138 Ų13895.2 Ų95.265%0.64551%0.505SS*.Hα-helixtrans-64-44.1174.8-73.4172.825.900112S231 E232 L233 G238 A239S231-Q235 VanDerWaalsContact O-CG 3.26Å; S231-Q235 WeakPolarHBondContact O-CG 3.38Å; S231-Q235 PolarHBondContact O-N 2.95Å; S231-Q235 VanDerWaalsContact O-N 3.1Å; E232-Q235 WeakPolarHBondContact O-CB 3.18Å; E232-Q235 PolarHBondContact O-N 2.65Å; L233-Q235 VanDerWaalsContact C-N 3.32Å; L233-Q235 PolarHBondContact O-N 2.96Å; Q235-G238 PolarHBondContact O-N 3.32Å; Q235-A239 PolarHBondContact O-N 3.44Å
236Q97.8Very high97.5Very high119 Ų11998.2 Ų98.256%0.55651%0.509SS*.Hα-helixtrans-62.4-42.9175.9-73.2179.73.700111.5E232 L233 G238 A239 T240E232-Q236 WeakPolarHBondContact O-CG 3.46Å; E232-Q236 PolarHBondContact O-N 3.36Å; L233-Q236 PolarHBondContact O-N 3.42Å; Q236-G238 VanDerWaalsContact C-N 3.33Å; Q236-G238 PolarHBondContact O-N 2.85Å; Q236-A239 PolarHBondContact O-N 2.9Å; Q236-T240 VanDerWaalsContact O-CG2 3.24Å; Q236-T240 WeakPolarHBondContact O-CG2 3.27Å; Q236-T240 PolarHBondContact O-N 2.96Å; Q236-T240 PolarHBondContact O-OG1 3.25Å
237L97Very high97.5Very high126 Ų12696.3 Ų96.366%0.6650%0.502SS*.Hα-helixtrans-59.8-46.1175-170.579.5000110.5L233 E234 A239 T240 G241L233-L237 WeakPolarHBondContact O-CB 3.35Å; L233-L237 PolarHBondContact O-N 3.32Å; E234-L237 PolarHBondContact O-N 2.82Å; L237-A239 PolarHBondContact O-N 3.27Å; L237-T240 WeakPolarHBondContact CA-OG1 3.4Å; L237-T240 PolarHBondContact O-N 3.38Å; L237-T240 PolarHBondContact O-OG1 2.93Å; L237-G241 PolarHBondContact O-N 2.94Å
238G97.2Very high97.4Very high47 Ų4797.2 Ų97.249%0.48551%0.507SS..Hα-helixtrans-56.8-46174.700000112.8E234 Q235 Q236 G241 A242E234-G238 PolarHBondContact O-N 3.27Å; Q235-G238 PolarHBondContact O-N 3.32Å; Q236-G238 VanDerWaalsContact C-N 3.33Å; Q236-G238 PolarHBondContact O-N 2.85Å; G238-G241 PolarHBondContact O-N 3.44Å; G238-A242 PolarHBondContact O-N 3.3Å
239A97.7Very high97.4Very high43 Ų4397.6 Ų97.636%0.35551%0.511SS..Hα-helixtrans-62.9-43.8176.600000112.3Q235 Q236 L237 G241 A242 Y243Q235-A239 PolarHBondContact O-N 3.44Å; Q236-A239 PolarHBondContact O-N 2.9Å; L237-A239 PolarHBondContact O-N 3.27Å; A239-G241 VanDerWaalsContact C-N 3.3Å; A239-G241 PolarHBondContact O-N 2.78Å; A239-A242 WeakPolarHBondContact O-CB 3.36Å; A239-A242 PolarHBondContact O-N 3Å; A239-Y243 HydrophobicContact CB-CE2 4.36Å; A239-Y243 WeakPolarHBondContact O-CD2 3.48Å; A239-Y243 PolarHBondContact O-N 3.26Å
240T96.8Very high97.3Very high67 Ų6795.8 Ų95.841%0.41150%0.504SS..Hα-helixtrans-64.3-35.6175.965.90000112.1Q236 L237 Y243 R244Q236-T240 VanDerWaalsContact O-CG2 3.24Å; Q236-T240 WeakPolarHBondContact O-CG2 3.27Å; Q236-T240 PolarHBondContact O-N 2.96Å; Q236-T240 PolarHBondContact O-OG1 3.25Å; L237-T240 WeakPolarHBondContact CA-OG1 3.4Å; L237-T240 PolarHBondContact O-N 3.38Å; L237-T240 PolarHBondContact O-OG1 2.93Å; T240-Y243 PolarHBondContact O-N 2.84Å; T240-R244 WeakPolarHBondContact O-CB 3.32Å; T240-R244 PolarHBondContact O-N 3.36Å
241G97.7Very high97.4Very high30 Ų3098 Ų9831%0.30951%0.512SS..Hα-helixtrans-61.6-43.617200000112.1L237 G238 A239 R244 A245L237-G241 PolarHBondContact O-N 2.94Å; G238-G241 PolarHBondContact O-N 3.44Å; A239-G241 VanDerWaalsContact C-N 3.3Å; A239-G241 PolarHBondContact O-N 2.78Å; G241-R244 PolarHBondContact O-N 3.37Å; G241-A245 PolarHBondContact O-N 2.75Å
242A97.4Very high97.3Very high61 Ų6198 Ų9850%0.50452%0.515SS..Hα-helixtrans-64.2-42.4175.400000112.3G238 A239 R244 A245 R246G238-A242 PolarHBondContact O-N 3.3Å; A239-A242 WeakPolarHBondContact O-CB 3.36Å; A239-A242 PolarHBondContact O-N 3Å; A242-R244 VanDerWaalsContact C-N 3.33Å; A242-R244 PolarHBondContact O-N 2.83Å; A242-A245 PolarHBondContact O-N 3.29Å; A242-R246 PolarHBondContact O-N 2.86Å
243Y96.8Very high97.2Very high167 Ų16798 Ų9866%0.65552%0.515SS*.Hα-helixtrans-63.4-39.3174.2-64.8-47.6000112.3A239 T240 R246 A247A239-Y243 HydrophobicContact CB-CE2 4.36Å; A239-Y243 WeakPolarHBondContact O-CD2 3.48Å; A239-Y243 PolarHBondContact O-N 3.26Å; T240-Y243 PolarHBondContact O-N 2.84Å; Y243-R246 PolarHBondContact O-N 3.29Å; Y243-A247 WeakPolarHBondContact O-CB 3.28Å; Y243-A247 PolarHBondContact O-N 2.8Å
244R97.9Very high97.1Very high174 Ų17495.8 Ų95.866%0.65751%0.506SS*.Hα-helixtrans-63.8-44.1175.5-175.1-177.6-66.2147.70.9111.7T240 G241 A242 R246 A247 L248T240-R244 WeakPolarHBondContact O-CB 3.32Å; T240-R244 PolarHBondContact O-N 3.36Å; G241-R244 PolarHBondContact O-N 3.37Å; A242-R244 VanDerWaalsContact C-N 3.33Å; A242-R244 PolarHBondContact O-N 2.83Å; R244-R246 PolarHBondContact O-N 2.89Å; R244-A247 PolarHBondContact O-N 3.23Å; R244-L248 WeakPolarHBondContact O-CG 3.42Å; R244-L248 PolarHBondContact O-N 3.43Å
245A96.9Very high97Very high45 Ų4592.1 Ų92.137%0.37250%0.498SS..Hα-helixtrans-60-46.3176.200000111.3G241 A242 A247 L248 E249G241-A245 PolarHBondContact O-N 2.75Å; A242-A245 PolarHBondContact O-N 3.29Å; A245-A247 VanDerWaalsContact C-N 3.31Å; A245-A247 PolarHBondContact O-N 3.33Å; A245-L248 PolarHBondContact O-N 2.84Å; A245-E249 WeakPolarHBondContact O-CG 3.21Å; A245-E249 PolarHBondContact O-N 3.48Å
246R97.5Very high96.9Very high162 Ų16291.3 Ų91.361%0.61149%0.494SS*.Hα-helixtrans-62.1-37.4176-173.3174.3-177.5-123.5-2.2112.8A242 Y243 R244 E249 L250A242-R246 PolarHBondContact O-N 2.86Å; Y243-R246 PolarHBondContact O-N 3.29Å; R244-R246 PolarHBondContact O-N 2.89Å; R246-E249 PolarHBondContact O-N 3.49Å; R246-L250 HydrophobicContact CG-CD1 4.33Å; R246-L250 WeakPolarHBondContact O-CG 3.43Å; R246-L250 PolarHBondContact O-N 2.93Å
247A96.8Very high96.6Very high43 Ų4390.5 Ų90.536%0.35549%0.492SS..Hα-helixtrans-63-43.9175.300000111.3Y243 R244 A245 E249 L250 E251Y243-A247 WeakPolarHBondContact O-CB 3.28Å; Y243-A247 PolarHBondContact O-N 2.8Å; R244-A247 PolarHBondContact O-N 3.23Å; A245-A247 VanDerWaalsContact C-N 3.31Å; A245-A247 PolarHBondContact O-N 3.33Å; A247-E249 PolarHBondContact O-N 3.23Å; A247-L250 PolarHBondContact O-N 2.88Å; A247-E251 WeakPolarHBondContact O-CG 3.24Å; A247-E251 PolarHBondContact O-N 3.39Å
248L97.4Very high96.5Very high102 Ų10292 Ų9253%0.53449%0.488SS..Hα-helixtrans-63.4-39.8176.1-68.3172.1000112.5R244 A245 E251 A252R244-L248 WeakPolarHBondContact O-CG 3.42Å; R244-L248 PolarHBondContact O-N 3.43Å; A245-L248 PolarHBondContact O-N 2.84Å; L248-E251 PolarHBondContact O-N 3.11Å; L248-A252 PolarHBondContact O-N 2.89Å
249E97.3Very high96.2Very high135 Ų13596.2 Ų96.263%0.63150%0.495SS*.Hα-helixtrans-60.9-45.4174.3-71.8171.2-176.900111.7A245 R246 A247 A252 E253A245-E249 WeakPolarHBondContact O-CG 3.21Å; A245-E249 PolarHBondContact O-N 3.48Å; R246-E249 PolarHBondContact O-N 3.49Å; A247-E249 PolarHBondContact O-N 3.23Å; E249-A252 WeakPolarHBondContact O-CB 3.44Å; E249-A252 PolarHBondContact O-N 3.45Å; E249-E253 PolarHBondContact O-N 3.44Å
250L97.6Very high95.7Very high79 Ų7999.1 Ų99.141%0.41450%0.503SS..Hα-helixtrans-66.4-37.5177-70.5170.8000112.3R246 A247 A252 E253 V254R246-L250 HydrophobicContact CG-CD1 4.33Å; R246-L250 WeakPolarHBondContact O-CG 3.43Å; R246-L250 PolarHBondContact O-N 2.93Å; A247-L250 PolarHBondContact O-N 2.88Å; L250-A252 VanDerWaalsContact C-N 3.31Å; L250-E253 PolarHBondContact O-N 2.8Å; L250-V254 WeakPolarHBondContact O-CB 3.2Å; L250-V254 VanDerWaalsContact O-CG2 3.28Å; L250-V254 WeakPolarHBondContact O-CG2 3.39Å; L250-V254 PolarHBondContact O-N 3.34Å
251E96.9Very high95.2Very high126 Ų126100.7 Ų100.759%0.58951%0.508SS*.Hα-helixtrans-62.3-40.3173.7-76.2173.2-173.700111.5A247 L248 V254 A255A247-E251 WeakPolarHBondContact O-CG 3.24Å; A247-E251 PolarHBondContact O-N 3.39Å; L248-E251 PolarHBondContact O-N 3.11Å; E251-V254 PolarHBondContact O-N 2.99Å; E251-A255 WeakPolarHBondContact O-CB 3.01Å; E251-A255 PolarHBondContact O-N 3.34Å
252A96.3Very high94.5Very high49 Ų49105.9 Ų105.941%0.40552%0.524SS..Hα-helixtrans-64.9-45.9174.500000111.9L248 E249 L250 V254 A255 E256L248-A252 PolarHBondContact O-N 2.89Å; E249-A252 WeakPolarHBondContact O-CB 3.44Å; E249-A252 PolarHBondContact O-N 3.45Å; L250-A252 VanDerWaalsContact C-N 3.31Å; A252-V254 VanDerWaalsContact C-N 3.34Å; A252-V254 PolarHBondContact O-N 2.87Å; A252-A255 WeakPolarHBondContact O-CB 3.27Å; A252-A255 PolarHBondContact O-N 3.3Å; A252-A255 VanDerWaalsContact O-N 3.11Å; A252-E256 WeakPolarHBondContact O-CG 3.27Å; A252-E256 PolarHBondContact O-N 3.1Å
253E96.6Very high93.6Very high110 Ų110106.9 Ų106.951%0.51453%0.528SS..Hα-helixtrans-60.2-42.7176.2-173.3178.1-174.100111.6E249 L250 A255 E256 M257E249-E253 PolarHBondContact O-N 3.44Å; L250-E253 PolarHBondContact O-N 2.8Å; E253-A255 VanDerWaalsContact C-N 3.32Å; E253-A255 PolarHBondContact O-N 3.03Å; E253-E256 PolarHBondContact O-N 3.26Å; E253-M257 WeakPolarHBondContact O-CG 3.46Å; E253-M257 PolarHBondContact O-N 3.29Å
254V95.6Very high92.5Very high60 Ų60105.8 Ų105.836%0.36453%0.529SS..Hα-helixtrans-63.4-38.5174.9169.40000111.5L250 E251 A252 M257 R258L250-V254 WeakPolarHBondContact O-CB 3.2Å; L250-V254 VanDerWaalsContact O-CG2 3.28Å; L250-V254 WeakPolarHBondContact O-CG2 3.39Å; L250-V254 PolarHBondContact O-N 3.34Å; E251-V254 PolarHBondContact O-N 2.99Å; A252-V254 VanDerWaalsContact C-N 3.34Å; A252-V254 PolarHBondContact O-N 2.87Å; V254-M257 PolarHBondContact O-N 3.23Å; V254-R258 VanDerWaalsContact O-CG 3.29Å; V254-R258 WeakPolarHBondContact O-CG 3.4Å; V254-R258 PolarHBondContact O-N 3.13Å
255A94.6Very high90.6Very high52 Ų52103 Ų10343%0.4352%0.523SS..Hα-helixtrans-64.6-42.1175.500000111.7E251 A252 E253 R258 Q259E251-A255 WeakPolarHBondContact O-CB 3.01Å; E251-A255 PolarHBondContact O-N 3.34Å; A252-A255 WeakPolarHBondContact O-CB 3.27Å; A252-A255 PolarHBondContact O-N 3.3Å; A252-A255 VanDerWaalsContact O-N 3.11Å; E253-A255 VanDerWaalsContact C-N 3.32Å; E253-A255 PolarHBondContact O-N 3.03Å; A255-R258 PolarHBondContact O-N 2.96Å; A255-Q259 PolarHBondContact O-N 3.45Å
256E95Very high88.7Confident120 Ų120105.6 Ų105.656%0.56154%0.536SS*.Hα-helixtrans-62-45.4173.8-70.8-178.7179.700111.6A252 E253 R258 Q259 M260A252-E256 WeakPolarHBondContact O-CG 3.27Å; A252-E256 PolarHBondContact O-N 3.1Å; E253-E256 PolarHBondContact O-N 3.26Å; E256-R258 VanDerWaalsContact C-N 3.32Å; E256-R258 PolarHBondContact O-N 2.99Å; E256-Q259 WeakPolarHBondContact O-CB 3.25Å; E256-Q259 PolarHBondContact O-N 2.92Å; E256-Q259 VanDerWaalsContact O-N 3.16Å; E256-M260 WeakPolarHBondContact O-CG 3.04Å; E256-M260 PolarHBondContact O-N 2.95Å
257M93Very high86.5Confident103 Ų103106.5 Ų106.551%0.50755%0.545SS..Hα-helixtrans-59.6-41.2175.7-70.9-175.874.800112.3E253 V254 M260 L261E253-M257 WeakPolarHBondContact O-CG 3.46Å; E253-M257 PolarHBondContact O-N 3.29Å; V254-M257 PolarHBondContact O-N 3.23Å; M257-M260 HydrophobicContact CG-CE 4.16Å; M257-M260 PolarHBondContact O-N 3.49Å; M257-L261 WeakPolarHBondContact O-CG 3.25Å; M257-L261 PolarHBondContact O-N 3.26Å
258R92.8Very high84.1Confident158 Ų158110.9 Ų110.960%0.59657%0.567SS**Hα-helixtrans-63.2-42.3175-74.4170.7179.6159.31.6111.6V254 A255 E256 L261 Q262V254-R258 VanDerWaalsContact O-CG 3.29Å; V254-R258 WeakPolarHBondContact O-CG 3.4Å; V254-R258 PolarHBondContact O-N 3.13Å; A255-R258 PolarHBondContact O-N 2.96Å; E256-R258 VanDerWaalsContact C-N 3.32Å; E256-R258 PolarHBondContact O-N 2.99Å; R258-L261 PolarHBondContact O-N 2.99Å; R258-Q262 VanDerWaalsContact O-CG 3.29Å; R258-Q262 WeakPolarHBondContact O-CG 3.38Å; R258-Q262 PolarHBondContact O-N 2.79Å
259Q91.4Very high81.9Confident134 Ų134113.9 Ų113.963%0.62658%0.583SS**Hα-helixtrans-64.3-42.1177-172.8178.617.200111.6A255 E256 Q262 S263A255-Q259 PolarHBondContact O-N 3.45Å; E256-Q259 WeakPolarHBondContact O-CB 3.25Å; E256-Q259 PolarHBondContact O-N 2.92Å; E256-Q259 VanDerWaalsContact O-N 3.16Å; Q259-Q262 PolarHBondContact O-N 3.47Å; Q259-S263 WeakPolarHBondContact O-CB 3.36Å; Q259-S263 PolarHBondContact O-N 3.31Å; Q259-S263 PolarHBondContact O-OG 2.9Å
260M88.1Confident79.8Confident104 Ų104110.5 Ų110.551%0.51259%0.585SS.*Hα-helixtrans-60.8-47.6175.9-72.1-170.1-67.500111.3E256 M257 Q262 S263 E264E256-M260 WeakPolarHBondContact O-CG 3.04Å; E256-M260 PolarHBondContact O-N 2.95Å; M257-M260 HydrophobicContact CG-CE 4.16Å; M257-M260 PolarHBondContact O-N 3.49Å; M260-Q262 VanDerWaalsContact C-N 3.32Å; M260-Q262 PolarHBondContact O-N 2.79Å; M260-S263 WeakPolarHBondContact CA-OG 3.47Å; M260-S263 PolarHBondContact O-N 2.69Å; M260-S263 PolarHBondContact O-OG 3.43Å; M260-E264 PolarHBondContact O-N 2.85Å
261L85.1Confident77.4Confident101 Ų101112.9 Ų112.953%0.52960%0.603SS.*Hα-helixtrans-59.2-40.3176.8-72.9171.3000112.8M257 R258 S263 H265M257-L261 WeakPolarHBondContact O-CG 3.25Å; M257-L261 PolarHBondContact O-N 3.26Å; R258-L261 PolarHBondContact O-N 2.99Å; L261-S263 VanDerWaalsContact C-N 3.34Å; L261-H265 PolarHBondContact O-N 2.87Å; L261-H265 VanDerWaalsContact O-N 3.08Å; L261-H265 PolarHBondContact O-ND1 2.73Å; L261-H265 VanDerWaalsContact O-ND1 3.16Å
262Q83.9Confident75.1Confident138 Ų138115.4 Ų115.465%0.64561%0.614SS**Hα-helixtrans-66.5-34174.6-71.6172.27.200112.6R258 Q259 M260 H265R258-Q262 VanDerWaalsContact O-CG 3.29Å; R258-Q262 WeakPolarHBondContact O-CG 3.38Å; R258-Q262 PolarHBondContact O-N 2.79Å; Q259-Q262 PolarHBondContact O-N 3.47Å; M260-Q262 VanDerWaalsContact C-N 3.32Å; M260-Q262 PolarHBondContact O-N 2.79Å; Q262-H265 CarbonylContact O-C 3.58Å; Q262-H265 VanDerWaalsContact O-C 3.22Å
263S78.4Confident73Confident83 Ų83122.5 Ų122.558%0.5864%0.636SS**Hα-helixtrans-78.6-29.5178.873.70000113.9Q259 M260 L261 P266Q259-S263 WeakPolarHBondContact O-CB 3.36Å; Q259-S263 PolarHBondContact O-N 3.31Å; Q259-S263 PolarHBondContact O-OG 2.9Å; M260-S263 WeakPolarHBondContact CA-OG 3.47Å; M260-S263 PolarHBondContact O-N 2.69Å; M260-S263 PolarHBondContact O-OG 3.43Å; L261-S263 VanDerWaalsContact C-N 3.34Å; S263-P266 WeakPolarHBondContact O-CD 3.38Å
264E73.3Confident70.8Confident143 Ų143125 Ų12567%0.66865%0.652SS**Hα-helixtrans-77.8-27.4173.4-72.3-175.2160.500112M260 P266M260-E264 PolarHBondContact O-N 2.85Å; E264-P266 VanDerWaalsContact O-CD 3.29Å; E264-P266 WeakPolarHBondContact O-CD 3.19Å
265H58.4Low68.3Low116 Ų116128.3 Ų128.354%0.53767%0.672SS.*SBendtrans-11767173.4-56.275.6000110.5L261 Q262 F267L261-H265 PolarHBondContact O-N 2.87Å; L261-H265 VanDerWaalsContact O-N 3.08Å; L261-H265 PolarHBondContact O-ND1 2.73Å; L261-H265 VanDerWaalsContact O-ND1 3.16Å; Q262-H265 CarbonylContact O-C 3.58Å; Q262-H265 VanDerWaalsContact O-C 3.22Å; H265-F267 PolarHBondContact O-N 3.46Å
266P57.9Low66Low100 Ų100131.1 Ų131.165%0.64969%0.686SS**  trans-67.195.2169.627.6-27.2000106.4S263 E264 V268S263-P266 WeakPolarHBondContact O-CD 3.38Å; E264-P266 VanDerWaalsContact O-CD 3.29Å; E264-P266 WeakPolarHBondContact O-CD 3.19Å; P266-V268 PolarHBondContact O-N 3.45Å; P266-V268 VanDerWaalsContact O-N 3.13Å
267F50.4Low63.5Low180 Ų180132.9 Ų132.979%0.78970%0.699SS**  trans-49.1126.1171.5-79.3-86.2000107.6H265 N269H265-F267 PolarHBondContact O-N 3.46Å; F267-N269 PolarHBondContact O-N 3.2Å
268V47.5Very low61.6Low135 Ų135132.7 Ų132.782%0.81871%0.708SS**  trans-53.7115.2174.2-179.10000106.7P266 G270P266-V268 PolarHBondContact O-N 3.45Å; P266-V268 VanDerWaalsContact O-N 3.13Å; V268-G270 PolarHBondContact O-N 2.82Å
269N51Low59.5Low165 Ų165132.9 Ų132.988%0.88272%0.72SS**THydrogen-bonded Turntrans-71.357.9-165.6-135.9-1.9000112.6F267F267-N269 PolarHBondContact O-N 3.2Å
270G52.1Low57.2Low65 Ų65135.4 Ų135.467%0.6773%0.729SS**THydrogen-bonded Turntrans-153.20.5-170.700000117V268V268-G270 PolarHBondContact O-N 2.82Å
271V47.1Very low54.9Low129 Ų129136.4 Ų136.478%0.78274%0.741SS**  trans-131.634.5-179.5-159.80000112.6
272E49.5Very low52.7Low179 Ų179137 Ų13784%0.83675%0.75SS**  trans-104.453.1168-82.3-172.9160.200111.4
273K51.1Low50.4Low198 Ų198139.2 Ų139.286%0.86176%0.758SS**SBendtrans-136.49.4168.6-91.9-164.2178.9-1790116.1
274L49.9Very low48.4Very low162 Ų162144.1 Ų144.185%0.84877%0.769SS**SBendtrans-138.832.8-176.1-70.9174.5000115.5
275V43Very low46.6Very low129 Ų129144.8 Ų144.878%0.78277%0.772SS**SBendtrans-142.8130.7160.2-173.10000109.4D277V275-D277 PolarHBondContact O-N 2.87Å
276P46.9Very low45.5Very low111 Ų111145.1 Ų145.172%0.72179%0.785SS**  trans-62.2126.7-178.5-24.634.5000114.8S278P276-S278 VanDerWaalsContact C-N 3.32Å; P276-S278 PolarHBondContact O-N 2.83Å
277D42.3Very low44.3Very low158 Ų158144.9 Ų144.985%0.84579%0.786SS**  trans-61.774.7168.9-85-34.8000113.1V275V275-D277 PolarHBondContact O-N 2.87Å
278S52.8Low44Very low98 Ų98146 Ų14669%0.68579%0.793SS**  trans-115.7-0.6176.9-49.70000115.1P276P276-S278 VanDerWaalsContact C-N 3.32Å; P276-S278 PolarHBondContact O-N 2.83Å
279L49.7Very low43.5Very low163 Ų163144 Ų14485%0.85379%0.785SS**SBendtrans-132.44.1-175.6-67.3176.9000116.1
280F43.4Very low42.9Very low186 Ų186143.9 Ų143.982%0.81678%0.784SS**  trans-105.5103.8168.5-76.8-80.7000109.5P282F280-P282 WeakPolarHBondContact O-CD 3.41Å
281V40Very low42.4Very low126 Ų126149 Ų14976%0.76480%0.795SS**  trans-65.7115.5165.9-179.40000107F283V281-F283 PolarHBondContact O-N 3.36Å
282P37.6Very low41.9Very low112 Ų112151.8 Ų151.873%0.72780%0.8SS**  trans-66109.6166-12.429.2000106.3F280 K284F280-P282 WeakPolarHBondContact O-CD 3.41Å; P282-K284 PolarHBondContact O-N 3.46Å
283F35.9Very low41.3Very low185 Ų185151.7 Ų151.781%0.81180%0.799SS**  trans-69.587.2170.4-161.2-93.7000107.1V281 E285V281-F283 PolarHBondContact O-N 3.36Å; F283-E285 PolarHBondContact O-N 2.79Å
284K36.2Very low40.6Very low187 Ų187149.8 Ų149.881%0.81380%0.795SS**  trans-77.3109171.9-168.8169.3-176.4178.70107P282P282-K284 PolarHBondContact O-N 3.46Å
285E35Very low39.7Very low156 Ų156150.8 Ų150.873%0.72979%0.793SS**  trans-47.1130.7166.5-81.9163.4129.600110.3F283 S287F283-E285 PolarHBondContact O-N 2.79Å; E285-S287 VanDerWaalsContact C-N 3.34Å; E285-S287 PolarHBondContact O-N 3.25Å
286P36.3Very low39.2Very low123 Ų123152.3 Ų152.380%0.79980%0.796SS**  trans-75.593.9171.429.4-29000108.3Q288P286-Q288 PolarHBondContact O-N 3.19Å
287S33.1Very low38.3Very low95 Ų95152.9 Ų152.966%0.66480%0.797SS**  trans-59.7132.1163.351.70000110E285 S289E285-S287 VanDerWaalsContact C-N 3.34Å; E285-S287 PolarHBondContact O-N 3.25Å; S287-S289 PolarHBondContact O-N 2.83Å
288Q42.8Very low37.8Very low204 Ų204151.5 Ų151.595%0.95380%0.795SS**SBendtrans-54.194.2171.4-62.6162.2-2.600111.3P286P286-Q288 PolarHBondContact O-N 3.19Å
289S37.8Very low37.1Very low93 Ų93152.4 Ų152.465%0.6580%0.798SS**  trans-165.440169.370.80000115S287S287-S289 PolarHBondContact O-N 2.83Å
290L38.1Very low36.3Very low163 Ų163152.1 Ų152.185%0.85379%0.792SS**  trans-11954.2172.6-87.3174.6000111.6
291L41.3Very low36Very low173 Ų173148 Ų14891%0.90678%0.784SS**SBendtrans-116.412.5167.3-158.4123.9000112.6
292E37.9Very low35.5Very low187 Ų187149.4 Ų149.487%0.87478%0.782SS**SBendtrans-143.647.8-170-155.3154.5-161.300113.5
293E36.6Very low35.3Very low177 Ų177156.2 Ų156.283%0.82779%0.793SS**  trans-143.245.3165.3-137.1174.4-166.500111
294M36Very low35.2Very low157 Ų157156.3 Ų156.377%0.77379%0.793SS**  trans-89.1140.2151.9-111.216853.900106.6
295F31Very low35.4Very low184 Ų184153.5 Ų153.581%0.80779%0.794SS**  trans90.491.5-174.3-52.5-71.9000114.7
296L32.2Very low35.4Very low160 Ų160154 Ų15484%0.83880%0.801SS**  174.3112.7109.8-83.8163.4000111.9
297T28.6Very low35.3Very low123 Ų123158 Ų15876%0.75581%0.806SS**  trans48.1109.3134.6-9.30000122.4
298V31.3Very low35.5Very low130 Ų130165 Ų16579%0.78882%0.818SS**  trans-4.2156134.9177.60000117.7
299P38.2Very low34.9Very low117 Ų117161.2 Ų161.276%0.7681%0.813SS**  cis-133.6173.27.420.65.7000118.2
300E32.4Very low35.1Very low157 Ų157161.8 Ų161.873%0.73482%0.817SS**  trans-43158.8164.8-133.3-141.9144.200115.7H302E300-H302 PolarHBondContact OE1-N 3.41Å; E300-H302 VanDerWaalsContact OE1-N 3.11Å
301P37.3Very low35.3Very low98 Ų98159.4 Ų159.464%0.63681%0.814SS**  -157157.382.140.4-19.5000119.6
302H29.7Very low35.1Very low157 Ų157159.9 Ų159.973%0.72781%0.812SS**  trans67.7110144-60.8-37000121E300E300-H302 PolarHBondContact OE1-N 3.41Å; E300-H302 VanDerWaalsContact OE1-N 3.11Å
303R33.5Very low35.7Very low254 Ų254157.4 Ų157.496%0.95881%0.81SS**  trans-139.4137.6140.2-73.7-162.3176.9175.61.3113.4
304K34.6Very low36.3Very low187 Ų187156.2 Ų156.281%0.81381%0.808SS**PPolyproline II helixtrans-74.5154.4-172.2-62.2164.8-179.51740112
305P39.7Very low36.7Very low129 Ų129156.4 Ų156.484%0.83881%0.811SS**PPolyproline II helixtrans-80.7121.1174.731.2-29.9000110.7
306L34.3Very low37.2Very low167 Ų167153.4 Ų153.487%0.87481%0.813SS**PPolyproline II helixtrans-82.6131.6170.2-93.184.7000110.5
307K34.5Very low37.7Very low205 Ų205151 Ų15189%0.89181%0.81SS**PPolyproline II helixtrans-61135.7-177.5-74.9178.7169.7-177.70112.5
308R37.3Very low38.7Very low244 Ų244152.5 Ų152.592%0.92181%0.812SS**PPolyproline II helixtrans-70127.9162.1-64.3177.771143.70.7109.2
309S30Very low39.7Very low123 Ų123150.7 Ų150.786%0.8681%0.811SS**PPolyproline II helixtrans-85.4136164.8-171.70000108.6
310S42.4Very low40.4Very low105 Ų105147.3 Ų147.373%0.73480%0.797SS**  trans-118.2121.1-175.944.60000109.5
311S41.9Very low41.4Very low113 Ų113142.4 Ų142.479%0.7978%0.78SS**  trans-175.4133.8159.4-55.70000103.5
312E38.1Very low42.4Very low184 Ų184143.8 Ų143.886%0.8678%0.782SS**  cis-146.1120.632.9-73.3170.3131.400109.6
313T50.9Low44Very low134 Ų134142.6 Ų142.682%0.82278%0.78SS**  trans-78.4117.2151.1-56.10000105.3
314I49.4Very low45.4Very low153 Ų153135.3 Ų135.379%0.78576%0.763SS**  trans172134.1149.6-83.9145.3000106.2
315L43.9Very low47.1Very low160 Ų160132 Ų13284%0.83875%0.749SS**  trans95.354.9-177-46.4-171.7000117.2
316S40.9Very low48.7Very low121 Ų121127.2 Ų127.285%0.84672%0.723SS**  trans-128.282.7155.2-65.70000109.2
317S42.3Very low50.8Low111 Ų111125.3 Ų125.378%0.77671%0.709SS**  trans-108.1109.6179.7-166.50000110.3
318L50.4Low52.9Low154 Ų154121 Ų12181%0.80669%0.692SS**SBend103.916.1124-144.661.5000122.4
319A51.9Low54.9Low91 Ų91113.8 Ų113.875%0.75267%0.669SS**SBendtrans-152.1-29.5163.300000116
320G53.3Low57.3Low47 Ų47111.3 Ų111.349%0.48565%0.649SS.*SBendtrans-98.5-14-174.900000115.7V324G320-V324 WeakPolarHBondContact O-CG2 3.32Å; G320-V324 PolarHBondContact O-N 2.83Å
321S53.3Low59.1Low53 Ų53109.1 Ų109.137%0.37163%0.632SS.*Hα-helixtrans-69-37.5-17355.90000113I323 K325S321-I323 PolarHBondContact O-N 2.96Å; S321-K325 WeakPolarHBondContact O-CB 3.45Å; S321-K325 PolarHBondContact O-N 3.48Å
322D59.2Low61Low127 Ų127107.2 Ų107.268%0.67961%0.613SS**Hα-helixtrans-75.8-29.4-170.7-68.9-8.1000112.5G326D322-G326 WeakPolarHBondContact O-CA 3.29Å; D322-G326 PolarHBondContact O-N 3.15Å
323I61.6Low63.1Low133 Ų133105.9 Ų105.968%0.68260%0.6SS**Hα-helixtrans-76.2-43.6176.1-57.8175.1000110.1S321 H327S321-I323 PolarHBondContact O-N 2.96Å; I323-H327 VanDerWaalsContact O-CB 3.29Å; I323-H327 WeakPolarHBondContact O-CB 3.49Å; I323-H327 PolarHBondContact O-N 3.41Å
324V63.6Low64.4Low100 Ų100108.7 Ų108.761%0.60660%0.595SS**Hα-helixtrans-68-44.8178.4176.60000110.7G320 H327 E328G320-V324 WeakPolarHBondContact O-CG2 3.32Å; G320-V324 PolarHBondContact O-N 2.83Å; V324-H327 PolarHBondContact O-N 3.4Å; V324-E328 WeakPolarHBondContact O-CB 3.49Å; V324-E328 PolarHBondContact O-N 2.84Å
325K69.4Low65.6Low119 Ų119103.7 Ų103.752%0.51758%0.577SS.*Hα-helixtrans-67.6-38.9177-165.8176.2-178.8-177.50111.9S321 E328 E329S321-K325 WeakPolarHBondContact O-CB 3.45Å; S321-K325 PolarHBondContact O-N 3.48Å; K325-E328 PolarHBondContact O-N 3.45Å; K325-E329 VanDerWaalsContact O-CB 3.31Å; K325-E329 WeakPolarHBondContact O-CB 3.28Å; K325-E329 WeakPolarHBondContact O-CG 3.16Å; K325-E329 PolarHBondContact O-N 3.16Å
326G73.9Confident67.2Low27 Ų27102.5 Ų102.528%0.27857%0.565SS.*Hα-helixtrans-63.7-39.6172.800000112.7D322 T330D322-G326 WeakPolarHBondContact O-CA 3.29Å; D322-G326 PolarHBondContact O-N 3.15Å; G326-T330 VanDerWaalsContact O-CB 3.23Å; G326-T330 WeakPolarHBondContact O-CB 3.28Å; G326-T330 PolarHBondContact O-N 2.93Å; G326-T330 PolarHBondContact O-OG1 2.79Å
327H78.3Confident68.6Low128 Ų12899.5 Ų99.559%0.59355%0.548SS*.Hα-helixtrans-68.3-43174.8-176.470.5000112I323 V324 T330 C331I323-H327 VanDerWaalsContact O-CB 3.29Å; I323-H327 WeakPolarHBondContact O-CB 3.49Å; I323-H327 PolarHBondContact O-N 3.41Å; V324-H327 PolarHBondContact O-N 3.4Å; H327-T330 PolarHBondContact O-N 2.9Å; H327-C331 PolarHBondContact NE2-SG 2.89Å; H327-C331 WeakPolarHBondContact O-CB 3.25Å; H327-C331 PolarHBondContact O-N 3.49Å; H327-C331 PolarHBondContact O-SG 3.02Å
328E79.1Confident69.8Low115 Ų11598.6 Ų98.654%0.53754%0.538SS..Hα-helixtrans-61.9-48.6176.2-174.2178.4-175.200111.3V324 K325 T330 C331 I332V324-E328 WeakPolarHBondContact O-CB 3.49Å; V324-E328 PolarHBondContact O-N 2.84Å; K325-E328 PolarHBondContact O-N 3.45Å; E328-T330 VanDerWaalsContact C-N 3.26Å; E328-T330 PolarHBondContact O-N 2.95Å; E328-C331 PolarHBondContact O-N 3.41Å; E328-I332 HydrophobicContact CG-CD1 3.92Å; E328-I332 WeakPolarHBondContact O-CB 3.32Å; E328-I332 WeakPolarHBondContact O-CG1 3.39Å; E328-I332 PolarHBondContact O-N 3.4Å
329E79.6Confident70.7Confident91 Ų9198.7 Ų98.743%0.42553%0.532SS..Hα-helixtrans-62.8-33.4175.6-72.8173.6-170.700112.4K325 R333K325-E329 VanDerWaalsContact O-CB 3.31Å; K325-E329 WeakPolarHBondContact O-CB 3.28Å; K325-E329 WeakPolarHBondContact O-CG 3.16Å; K325-E329 PolarHBondContact O-N 3.16Å; E329-R333 VanDerWaalsContact O-CB 3.31Å; E329-R333 WeakPolarHBondContact O-CB 3.28Å; E329-R333 VanDerWaalsContact O-CG 3.25Å; E329-R333 WeakPolarHBondContact O-CG 3.3Å; E329-R333 PolarHBondContact O-N 3.48Å; E329-R333 PolarHBondContact O-NE 2.72Å
330T79.4Confident71.3Confident72 Ų72101.2 Ų101.244%0.44253%0.528SS..Hα-helixtrans-74-38.4175.9-57.70000111.3G326 H327 E328 R333 R334G326-T330 VanDerWaalsContact O-CB 3.23Å; G326-T330 WeakPolarHBondContact O-CB 3.28Å; G326-T330 PolarHBondContact O-N 2.93Å; G326-T330 PolarHBondContact O-OG1 2.79Å; H327-T330 PolarHBondContact O-N 2.9Å; E328-T330 VanDerWaalsContact C-N 3.26Å; E328-T330 PolarHBondContact O-N 2.95Å; T330-R333 PolarHBondContact O-N 3.48Å; T330-R334 VanDerWaalsContact O-CB 3.27Å; T330-R334 WeakPolarHBondContact O-CB 3.34Å; T330-R334 PolarHBondContact O-N 2.91Å
331C80.4Confident72Confident58 Ų58110.1 Ų110.139%0.39255%0.547SS..Hα-helixtrans-65.3-42.4173.3-72.30000111.5H327 E328 R334 A335H327-C331 PolarHBondContact NE2-SG 2.89Å; H327-C331 WeakPolarHBondContact O-CB 3.25Å; H327-C331 PolarHBondContact O-N 3.49Å; H327-C331 PolarHBondContact O-SG 3.02Å; E328-C331 PolarHBondContact O-N 3.41Å; C331-R334 PolarHBondContact O-N 3.42Å; C331-A335 VanDerWaalsContact O-CB 3.28Å; C331-A335 WeakPolarHBondContact O-CB 3.21Å; C331-A335 PolarHBondContact O-N 2.93Å
332I82.9Confident72.5Confident74 Ų74110.5 Ų110.538%0.37956%0.559SS.*Hα-helixtrans-63.7-44.4175.1-68164.5000110.5E328 A335 K336E328-I332 HydrophobicContact CG-CD1 3.92Å; E328-I332 WeakPolarHBondContact O-CB 3.32Å; E328-I332 WeakPolarHBondContact O-CG1 3.39Å; E328-I332 PolarHBondContact O-N 3.4Å; I332-A335 PolarHBondContact O-N 3.42Å; I332-K336 HydrophobicContact CG2-CD 4.01Å; I332-K336 HydrophobicContact CG2-CG 4.5Å; I332-K336 WeakPolarHBondContact O-CB 3.25Å; I332-K336 VanDerWaalsContact O-CG 3.3Å; I332-K336 WeakPolarHBondContact O-CG 3.22Å; I332-K336 PolarHBondContact O-N 3.48Å
333R81Confident72.8Confident156 Ų156107.9 Ų107.959%0.58954%0.544SS*.Hα-helixtrans-64.7-40.6176.4-79.1-176.2-77160-8.8112E329 T330 K336 A337E329-R333 VanDerWaalsContact O-CB 3.31Å; E329-R333 WeakPolarHBondContact O-CB 3.28Å; E329-R333 VanDerWaalsContact O-CG 3.25Å; E329-R333 WeakPolarHBondContact O-CG 3.3Å; E329-R333 PolarHBondContact O-N 3.48Å; E329-R333 PolarHBondContact O-NE 2.72Å; T330-R333 PolarHBondContact O-N 3.48Å; R333-K336 PolarHBondContact O-N 2.96Å; R333-A337 VanDerWaalsContact O-CB 3.25Å; R333-A337 WeakPolarHBondContact O-CB 3.23Å; R333-A337 PolarHBondContact O-N 2.93Å
334R77.9Confident73.4Confident192 Ų192104.9 Ų104.973%0.72554%0.535SS*.Hα-helixtrans-64.8-45.6175.5-171.2177.7-177.2175.40.3111.3T330 C331 A337 V338T330-R334 VanDerWaalsContact O-CB 3.27Å; T330-R334 WeakPolarHBondContact O-CB 3.34Å; T330-R334 PolarHBondContact O-N 2.91Å; C331-R334 PolarHBondContact O-N 3.42Å; R334-A337 PolarHBondContact O-N 3.15Å; R334-V338 WeakPolarHBondContact O-CB 3.39Å; R334-V338 WeakPolarHBondContact O-CG2 3.48Å; R334-V338 PolarHBondContact O-N 2.89Å
335A75.9Confident74.1Confident49 Ų49106.3 Ų106.341%0.40554%0.538SS..Hα-helixtrans-63.7-41.5176.700000111.9C331 I332 V338 K339C331-A335 VanDerWaalsContact O-CB 3.28Å; C331-A335 WeakPolarHBondContact O-CB 3.21Å; C331-A335 PolarHBondContact O-N 2.93Å; I332-A335 PolarHBondContact O-N 3.42Å; A335-V338 PolarHBondContact O-N 2.97Å; A335-K339 WeakPolarHBondContact O-CB 3.31Å; A335-K339 VanDerWaalsContact O-CG 3.25Å; A335-K339 WeakPolarHBondContact O-CG 3.2Å; A335-K339 PolarHBondContact O-N 3.46Å
336K76.2Confident74.9Confident134 Ų134106 Ų10658%0.58354%0.542SS*.Hα-helixtrans-65.3-44.2173.9-75176.5-179.9175.60111.7I332 R333 V338 K339 Q340I332-K336 HydrophobicContact CG2-CD 4.01Å; I332-K336 HydrophobicContact CG2-CG 4.5Å; I332-K336 WeakPolarHBondContact O-CB 3.25Å; I332-K336 VanDerWaalsContact O-CG 3.3Å; I332-K336 WeakPolarHBondContact O-CG 3.22Å; I332-K336 PolarHBondContact O-N 3.48Å; R333-K336 PolarHBondContact O-N 2.96Å; K336-V338 PolarHBondContact O-N 2.94Å; K336-K339 PolarHBondContact O-N 3.42Å; K336-Q340 WeakPolarHBondContact O-CB 3.18Å; K336-Q340 WeakPolarHBondContact O-CG 3.29Å; K336-Q340 PolarHBondContact O-N 3.16Å
337A70.6Confident75.5Confident59 Ų59110.1 Ų110.149%0.48855%0.554SS.*Hα-helixtrans-64.5-38.5177.200000112.3R333 R334 Q340 R341R333-A337 VanDerWaalsContact O-CB 3.25Å; R333-A337 WeakPolarHBondContact O-CB 3.23Å; R333-A337 PolarHBondContact O-N 2.93Å; R334-A337 PolarHBondContact O-N 3.15Å; A337-Q340 PolarHBondContact O-N 3.04Å; A337-R341 VanDerWaalsContact O-CB 3.31Å; A337-R341 WeakPolarHBondContact O-CB 3.48Å; A337-R341 PolarHBondContact O-N 3.48Å
338V68.8Low75.9Confident92 Ų92109.1 Ų109.156%0.55855%0.549SS*.Hα-helixtrans-67.3-41.5174.1171.20000110.9R334 A335 K336 Q340 R341 G342R334-V338 WeakPolarHBondContact O-CB 3.39Å; R334-V338 WeakPolarHBondContact O-CG2 3.48Å; R334-V338 PolarHBondContact O-N 2.89Å; A335-V338 PolarHBondContact O-N 2.97Å; K336-V338 PolarHBondContact O-N 2.94Å; V338-Q340 VanDerWaalsContact C-N 3.31Å; V338-Q340 PolarHBondContact O-N 3.36Å; V338-R341 PolarHBondContact O-N 3.17Å; V338-G342 PolarHBondContact O-N 2.89Å
339K68.6Low76.5Confident156 Ų156107 Ų10768%0.67854%0.544SS*.Hα-helixtrans-60.2-39.9172.1-76.3176.9-178.9-171.20112.1A335 K336 I343A335-K339 WeakPolarHBondContact O-CB 3.31Å; A335-K339 VanDerWaalsContact O-CG 3.25Å; A335-K339 WeakPolarHBondContact O-CG 3.2Å; A335-K339 PolarHBondContact O-N 3.46Å; K336-K339 PolarHBondContact O-N 3.42Å; K339-I343 WeakPolarHBondContact O-CG1 3.49Å; K339-I343 PolarHBondContact O-N 2.84Å
340Q64Low77.2Confident143 Ų143106.7 Ų106.767%0.66855%0.545SS*.Hα-helixtrans-74.2-23.9178.2-66.3-66.8-37.800113.5K336 A337 V338 I343K336-Q340 WeakPolarHBondContact O-CB 3.18Å; K336-Q340 WeakPolarHBondContact O-CG 3.29Å; K336-Q340 PolarHBondContact O-N 3.16Å; A337-Q340 PolarHBondContact O-N 3.04Å; V338-Q340 VanDerWaalsContact C-N 3.31Å; V338-Q340 PolarHBondContact O-N 3.36Å; Q340-I343 WeakPolarHBondContact O-CD1 3.21Å; Q340-I343 WeakPolarHBondContact O-CG1 3.45Å
341R68.4Low77.8Confident235 Ų235106.9 Ų106.989%0.88755%0.546SS*.Hα-helixtrans-92.2-21.3176.9-154.2174-173.1168.61.2113A337 V338A337-R341 VanDerWaalsContact O-CB 3.31Å; A337-R341 WeakPolarHBondContact O-CB 3.48Å; A337-R341 PolarHBondContact O-N 3.48Å; V338-R341 PolarHBondContact O-N 3.17Å
342G63.7Low78.5Confident60 Ų60109.6 Ų109.662%0.61955%0.553SS**SBendtrans-10214.2176.700000113.9V338 S344V338-G342 PolarHBondContact O-N 2.89Å; G342-S344 PolarHBondContact O-N 3.46Å
343I64.9Low79Confident73 Ų73113.5 Ų113.537%0.37456%0.564SS.*  trans-66.7104.6169.1-37.8169.9000106.4K339 Q340 H347K339-I343 WeakPolarHBondContact O-CG1 3.49Å; K339-I343 PolarHBondContact O-N 2.84Å; Q340-I343 WeakPolarHBondContact O-CD1 3.21Å; Q340-I343 WeakPolarHBondContact O-CG1 3.45Å; I343-H347 HydrophobicContact CG2-CB 3.85Å; I343-H347 WeakPolarHBondContact CG2-CD2 3.4Å
344S75Confident79.7Confident70 Ų70109.1 Ų109.149%0.4956%0.557SS.*  trans-60.5145.1175.9177.20000109.6G342 L346 H347 E348G342-S344 PolarHBondContact O-N 3.46Å; S344-L346 PolarHBondContact O-N 3.3Å; S344-L346 PolarHBondContact OG-N 3.47Å; S344-H347 WeakPolarHBondContact O-CB 3.46Å; S344-H347 PolarHBondContact O-N 2.84Å; S344-E348 PolarHBondContact O-N 2.96Å
345L77Confident80.6Confident130 Ų130102.5 Ų102.568%0.68154%0.543SS*.Hα-helixtrans-48.1-32170.3-17865.7000111.1E348 V349L345-E348 PolarHBondContact O-N 2.84Å; L345-V349 HydrophobicContact CG-CG2 4.41Å; L345-V349 WeakPolarHBondContact O-CB 3.2Å; L345-V349 WeakPolarHBondContact O-CG2 3.41Å; L345-V349 PolarHBondContact O-N 2.99Å
346L86.5Confident81.5Confident113 Ų113104.2 Ų104.259%0.59255%0.546SS*.Hα-helixtrans-64.5-38.8175.6-170.863.5000113.5S344 E348 V349 D350S344-L346 PolarHBondContact O-N 3.3Å; S344-L346 PolarHBondContact OG-N 3.47Å; L346-E348 VanDerWaalsContact C-N 3.35Å; L346-V349 PolarHBondContact O-N 2.89Å; L346-D350 WeakPolarHBondContact O-CB 3.3Å; L346-D350 PolarHBondContact O-N 2.63Å
347H86.3Confident82.4Confident113 Ų113103.1 Ų103.152%0.52354%0.541SS..Hα-helixtrans-70.3-34.5176.7-177.778.5000111.6I343 S344 T351I343-H347 HydrophobicContact CG2-CB 3.85Å; I343-H347 WeakPolarHBondContact CG2-CD2 3.4Å; S344-H347 WeakPolarHBondContact O-CB 3.46Å; S344-H347 PolarHBondContact O-N 2.84Å; H347-T351 WeakPolarHBondContact O-CB 3.27Å; H347-T351 PolarHBondContact O-N 3.31Å; H347-T351 PolarHBondContact O-OG1 3.11Å
348E88.2Confident83.6Confident107 Ų107103.7 Ų103.750%0.554%0.538SS..Hα-helixtrans-67-44172-176167.1-157.900111S344 L345 L346 T351 Q352S344-E348 PolarHBondContact O-N 2.96Å; L345-E348 PolarHBondContact O-N 2.84Å; L346-E348 VanDerWaalsContact C-N 3.35Å; E348-T351 PolarHBondContact O-N 3.43Å; E348-Q352 WeakPolarHBondContact O-CB 3.32Å; E348-Q352 VanDerWaalsContact O-CG 3.24Å; E348-Q352 WeakPolarHBondContact O-CG 3.49Å; E348-Q352 PolarHBondContact O-N 3.32Å
349V91.7Very high84.9Confident69 Ų69106.3 Ų106.342%0.41854%0.542SS..Hα-helixtrans-61.8-42.3173.9170.40000111.5L345 L346 Q352 Y353L345-V349 HydrophobicContact CG-CG2 4.41Å; L345-V349 WeakPolarHBondContact O-CB 3.2Å; L345-V349 WeakPolarHBondContact O-CG2 3.41Å; L345-V349 PolarHBondContact O-N 2.99Å; L346-V349 PolarHBondContact O-N 2.89Å; V349-Q352 PolarHBondContact O-N 2.86Å; V349-Y353 VanDerWaalsContact O-CB 3.28Å; V349-Y353 WeakPolarHBondContact O-CB 3.32Å; V349-Y353 PolarHBondContact O-N 3.4Å
350D94.1Very high86.1Confident86 Ų86105.5 Ų105.546%0.4654%0.535SS..Hα-helixtrans-66-37.7175.7-87.1-8000112L346 Y353 S354L346-D350 WeakPolarHBondContact O-CB 3.3Å; L346-D350 PolarHBondContact O-N 2.63Å; D350-Y353 PolarHBondContact O-N 3.25Å; D350-S354 WeakPolarHBondContact O-CB 3.49Å; D350-S354 PolarHBondContact O-N 3.08Å; D350-S354 PolarHBondContact O-OG 3.47Å
351T92.3Very high87.6Confident75 Ų75102.6 Ų102.646%0.4652%0.522SS..Hα-helixtrans-66.2-42.6175-57.60000110.2H347 E348 A355H347-T351 WeakPolarHBondContact O-CB 3.27Å; H347-T351 PolarHBondContact O-N 3.31Å; H347-T351 PolarHBondContact O-OG1 3.11Å; E348-T351 PolarHBondContact O-N 3.43Å; T351-A355 WeakPolarHBondContact O-CB 3.45Å; T351-A355 PolarHBondContact O-N 2.78Å
352Q93.9Very high88.9Confident115 Ų11596.1 Ų96.154%0.53750%0.502SS..Hα-helixtrans-65.3-43.2175.4-72178.416.300111.6E348 V349 A355 L356E348-Q352 WeakPolarHBondContact O-CB 3.32Å; E348-Q352 VanDerWaalsContact O-CG 3.24Å; E348-Q352 WeakPolarHBondContact O-CG 3.49Å; E348-Q352 PolarHBondContact O-N 3.32Å; V349-Q352 PolarHBondContact O-N 2.86Å; Q352-A355 PolarHBondContact O-N 2.9Å; Q352-L356 VanDerWaalsContact O-CB 3.25Å; Q352-L356 WeakPolarHBondContact O-CB 3.21Å; Q352-L356 PolarHBondContact O-N 3.44Å
353Y94.9Very high90.3Very high157 Ų15797.9 Ų97.962%0.61650%0.496SS*.Hα-helixtrans-65.3-43.5177-177.1-97.5000111.4V349 D350 L356 K357V349-Y353 VanDerWaalsContact O-CB 3.28Å; V349-Y353 WeakPolarHBondContact O-CB 3.32Å; V349-Y353 PolarHBondContact O-N 3.4Å; D350-Y353 PolarHBondContact O-N 3.25Å; Y353-L356 PolarHBondContact O-N 3.47Å; Y353-K357 VanDerWaalsContact O-CB 3.28Å; Y353-K357 WeakPolarHBondContact O-CB 3.45Å; Y353-K357 PolarHBondContact O-N 2.91Å
354S95Very high91.4Very high64 Ų64100 Ų10045%0.44851%0.508SS..Hα-helixtrans-65.1-42.4176.3-60.50000111.4D350 K357 V358D350-S354 WeakPolarHBondContact O-CB 3.49Å; D350-S354 PolarHBondContact O-N 3.08Å; D350-S354 PolarHBondContact O-OG 3.47Å; S354-K357 PolarHBondContact O-N 3.22Å; S354-V358 VanDerWaalsContact O-CG2 3.32Å; S354-V358 WeakPolarHBondContact O-CG2 3.39Å; S354-V358 PolarHBondContact O-N 3.46Å
355A95.8Very high92.2Very high52 Ų52103.3 Ų103.343%0.4351%0.514SS..Hα-helixtrans-63.6-40.8174.500000111.9T351 Q352 V358 K359T351-A355 WeakPolarHBondContact O-CB 3.45Å; T351-A355 PolarHBondContact O-N 2.78Å; Q352-A355 PolarHBondContact O-N 2.9Å; A355-V358 PolarHBondContact O-N 3.24Å; A355-K359 WeakPolarHBondContact O-CG 3.25Å; A355-K359 PolarHBondContact O-N 3.47Å
356L96.3Very high92.7Very high86 Ų86103.3 Ų103.345%0.4551%0.508SS..Hα-helixtrans-65.4-43.5175.9-176.760.9000111.2Q352 Y353 V358 K359 Y360Q352-L356 VanDerWaalsContact O-CB 3.25Å; Q352-L356 WeakPolarHBondContact O-CB 3.21Å; Q352-L356 PolarHBondContact O-N 3.44Å; Y353-L356 PolarHBondContact O-N 3.47Å; L356-V358 PolarHBondContact O-N 2.92Å; L356-K359 WeakPolarHBondContact O-CB 3.33Å; L356-K359 PolarHBondContact O-N 3.48Å; L356-K359 VanDerWaalsContact O-N 3.16Å; L356-Y360 HydrophobicContact CD1-CD2 3.93Å; L356-Y360 HydrophobicContact CD1-CE2 3.56Å; L356-Y360 HydrophobicContact CD2-CE2 4.08Å; L356-Y360 HydrophobicContact CG-CD2 3.79Å; L356-Y360 HydrophobicContact CG-CE2 3.61Å; L356-Y360 VanDerWaalsContact O-CD2 3.27Å; L356-Y360 WeakPolarHBondContact O-CD2 3.21Å; L356-Y360 PolarHBondContact O-N 3.32Å
357K94.1Very high92.5Very high111 Ų111101 Ų10148%0.48350%0.501SS..Hα-helixtrans-58.3-46.5175.2-175.8-178.7177.3-173.50111.3Y353 S354 K359 Y360 E361Y353-K357 VanDerWaalsContact O-CB 3.28Å; Y353-K357 WeakPolarHBondContact O-CB 3.45Å; Y353-K357 PolarHBondContact O-N 2.91Å; S354-K357 PolarHBondContact O-N 3.22Å; K357-K359 VanDerWaalsContact C-N 3.32Å; K357-K359 PolarHBondContact O-N 3.2Å; K357-Y360 PolarHBondContact O-N 2.85Å; K357-E361 WeakPolarHBondContact CE-OE1 3.31Å; K357-E361 WeakPolarHBondContact O-CG 3.42Å; K357-E361 PolarHBondContact O-N 2.96Å
358V96.2Very high92.3Very high71 Ų71101 Ų10143%0.4350%0.501SS..Hα-helixtrans-60.3-42.1175.5171.80000111.1S354 A355 L356 Y360 E361 E362S354-V358 VanDerWaalsContact O-CG2 3.32Å; S354-V358 WeakPolarHBondContact O-CG2 3.39Å; S354-V358 PolarHBondContact O-N 3.46Å; A355-V358 PolarHBondContact O-N 3.24Å; L356-V358 PolarHBondContact O-N 2.92Å; V358-Y360 PolarHBondContact O-N 3.49Å; V358-E361 PolarHBondContact O-N 3.25Å; V358-E362 HydrophobicContact CG1-CG 4.47Å; V358-E362 WeakPolarHBondContact O-CB 3.36Å; V358-E362 WeakPolarHBondContact O-CG 3.45Å; V358-E362 PolarHBondContact O-N 3.46Å
359K95.4Very high91.7Very high147 Ų147102 Ų10264%0.63951%0.506SS*.Hα-helixtrans-63.8-38.3175.2-73.8-172.7179.8-1780113.1A355 L356 K357 E362 L363A355-K359 WeakPolarHBondContact O-CG 3.25Å; A355-K359 PolarHBondContact O-N 3.47Å; L356-K359 WeakPolarHBondContact O-CB 3.33Å; L356-K359 PolarHBondContact O-N 3.48Å; L356-K359 VanDerWaalsContact O-N 3.16Å; K357-K359 VanDerWaalsContact C-N 3.32Å; K357-K359 PolarHBondContact O-N 3.2Å; K359-E362 PolarHBondContact O-N 2.93Å; K359-L363 WeakPolarHBondContact O-CB 3.46Å; K359-L363 PolarHBondContact O-N 2.88Å
360Y95.2Very high90.6Very high138 Ų138104.8 Ų104.854%0.54151%0.514SS..Hα-helixtrans-67.5-40.2173.7-85.4-69.2000112.1L356 K357 V358 E362 L363 L364L356-Y360 HydrophobicContact CD1-CD2 3.93Å; L356-Y360 HydrophobicContact CD1-CE2 3.56Å; L356-Y360 HydrophobicContact CD2-CE2 4.08Å; L356-Y360 HydrophobicContact CG-CD2 3.79Å; L356-Y360 HydrophobicContact CG-CE2 3.61Å; L356-Y360 VanDerWaalsContact O-CD2 3.27Å; L356-Y360 WeakPolarHBondContact O-CD2 3.21Å; L356-Y360 PolarHBondContact O-N 3.32Å; K357-Y360 PolarHBondContact O-N 2.85Å; V358-Y360 PolarHBondContact O-N 3.49Å; Y360-E362 VanDerWaalsContact C-N 3.34Å; Y360-L363 PolarHBondContact O-N 2.88Å; Y360-L364 WeakPolarHBondContact O-CB 3.5Å; Y360-L364 VanDerWaalsContact O-CG 3.31Å; Y360-L364 WeakPolarHBondContact O-CG 3.38Å; Y360-L364 PolarHBondContact O-N 2.81Å
361E95.2Very high89.1Confident83 Ų83106.8 Ų106.839%0.38852%0.521SS..Hα-helixtrans-64.4-39174.2-73.1175.8-172.200111.6K357 V358 K365K357-E361 WeakPolarHBondContact CE-OE1 3.31Å; K357-E361 WeakPolarHBondContact O-CG 3.42Å; K357-E361 PolarHBondContact O-N 2.96Å; V358-E361 PolarHBondContact O-N 3.25Å; E361-K365 WeakPolarHBondContact O-CB 3.46Å; E361-K365 VanDerWaalsContact O-CG 3.24Å; E361-K365 WeakPolarHBondContact O-CG 3.36Å; E361-K365 PolarHBondContact O-N 3.44Å
362E94.3Very high87.5Confident98 Ų98106.9 Ų106.946%0.45852%0.518SS..Hα-helixtrans-65.4-40.4172.5-75.6176.9-174.300112.2V358 K359 Y360 K365 K366V358-E362 HydrophobicContact CG1-CG 4.47Å; V358-E362 WeakPolarHBondContact O-CB 3.36Å; V358-E362 WeakPolarHBondContact O-CG 3.45Å; V358-E362 PolarHBondContact O-N 3.46Å; K359-E362 PolarHBondContact O-N 2.93Å; Y360-E362 VanDerWaalsContact C-N 3.34Å; E362-K365 PolarHBondContact O-N 3.35Å; E362-K366 WeakPolarHBondContact O-CB 3.44Å; E362-K366 VanDerWaalsContact O-CG 3.3Å; E362-K366 WeakPolarHBondContact O-CG 3.41Å; E362-K366 PolarHBondContact O-N 3.28Å
363L93.9Very high85.9Confident97 Ų97105.2 Ų105.251%0.50852%0.52SS..Hα-helixtrans-65.8-44.5175.9-174.366.7000111.1K359 Y360 K365 K366 C367K359-L363 WeakPolarHBondContact O-CB 3.46Å; K359-L363 PolarHBondContact O-N 2.88Å; Y360-L363 PolarHBondContact O-N 2.88Å; L363-K365 VanDerWaalsContact C-N 3.34Å; L363-K365 PolarHBondContact O-N 3.12Å; L363-K366 WeakPolarHBondContact O-CB 3.4Å; L363-K366 PolarHBondContact O-N 2.83Å; L363-K366 VanDerWaalsContact O-N 3.15Å; L363-C367 PolarHBondContact O-N 3.46Å; L363-C367 PolarHBondContact O-SG 3.27Å; L363-C367 VanDerWaalsContact O-SG 3.35Å
364L88.5Confident83.9Confident118 Ų118103.7 Ų103.762%0.61852%0.521SS*.Hα-helixtrans-60.1-44.1174.1-78166.6000111.1Y360 K366 C367 Q368Y360-L364 WeakPolarHBondContact O-CB 3.5Å; Y360-L364 VanDerWaalsContact O-CG 3.31Å; Y360-L364 WeakPolarHBondContact O-CG 3.38Å; Y360-L364 PolarHBondContact O-N 2.81Å; L364-K366 VanDerWaalsContact C-N 3.33Å; L364-K366 PolarHBondContact O-N 3.15Å; L364-C367 PolarHBondContact O-N 3.48Å; L364-Q368 WeakPolarHBondContact O-CB 3.43Å; L364-Q368 PolarHBondContact O-N 2.88Å
365K90.8Very high81.9Confident140 Ų140103.9 Ų103.961%0.60952%0.522SS*.Hα-helixtrans-61.4-39.6173.8-77.9173.2-177.4172.40112E361 E362 L363 Q368 Q369E361-K365 WeakPolarHBondContact O-CB 3.46Å; E361-K365 VanDerWaalsContact O-CG 3.24Å; E361-K365 WeakPolarHBondContact O-CG 3.36Å; E361-K365 PolarHBondContact O-N 3.44Å; E362-K365 PolarHBondContact O-N 3.35Å; L363-K365 VanDerWaalsContact C-N 3.34Å; L363-K365 PolarHBondContact O-N 3.12Å; K365-Q368 PolarHBondContact O-N 3.11Å; K365-Q369 WeakPolarHBondContact O-CB 3.31Å; K365-Q369 PolarHBondContact O-N 3.22Å
366K88.8Confident79.7Confident129 Ų129109.2 Ų109.256%0.56154%0.538SS*.Hα-helixtrans-66.1-42.4175.6-75.8172.4-178.4174.40112.1E362 L363 L364 Q369 E370E362-K366 WeakPolarHBondContact O-CB 3.44Å; E362-K366 VanDerWaalsContact O-CG 3.3Å; E362-K366 WeakPolarHBondContact O-CG 3.41Å; E362-K366 PolarHBondContact O-N 3.28Å; L363-K366 WeakPolarHBondContact O-CB 3.4Å; L363-K366 PolarHBondContact O-N 2.83Å; L363-K366 VanDerWaalsContact O-N 3.15Å; L364-K366 VanDerWaalsContact C-N 3.33Å; L364-K366 PolarHBondContact O-N 3.15Å; K366-Q369 PolarHBondContact O-N 3.05Å; K366-E370 WeakPolarHBondContact O-CB 3.28Å; K366-E370 PolarHBondContact O-N 2.9Å
367C82.8Confident77.7Confident65 Ų65114.2 Ų114.244%0.43956%0.556SS.*Hα-helixtrans-64.7-41.6174.7-66.40000111.8L363 L364 E370 Q371L363-C367 PolarHBondContact O-N 3.46Å; L363-C367 PolarHBondContact O-SG 3.27Å; L363-C367 VanDerWaalsContact O-SG 3.35Å; L364-C367 PolarHBondContact O-N 3.48Å; C367-E370 PolarHBondContact O-N 2.87Å; C367-Q371 WeakPolarHBondContact O-CB 3.29Å; C367-Q371 PolarHBondContact O-N 3.49Å
368Q81.7Confident75.1Confident114 Ų114112.5 Ų112.553%0.53356%0.563SS.*Hα-helixtrans-63.3-43.2174.4-162.681.541.900110.9L364 K365 Q371 D372L364-Q368 WeakPolarHBondContact O-CB 3.43Å; L364-Q368 PolarHBondContact O-N 2.88Å; K365-Q368 PolarHBondContact O-N 3.11Å; Q368-Q371 CarbonylContact O-C 3.58Å; Q368-Q371 WeakPolarHBondContact O-CB 3.46Å; Q368-Q371 PolarHBondContact O-N 2.85Å; Q368-D372 WeakPolarHBondContact O-CB 3.37Å; Q368-D372 VanDerWaalsContact O-CG 3.24Å; Q368-D372 PolarHBondContact O-N 3.39Å
369Q75.4Confident72.5Confident128 Ų128115.4 Ų115.460%0.59858%0.581SS**Hα-helixtrans-73.7-30.5-179.3-168.3162.616.900112.7K365 K366 S373K365-Q369 WeakPolarHBondContact O-CB 3.31Å; K365-Q369 PolarHBondContact O-N 3.22Å; K366-Q369 PolarHBondContact O-N 3.05Å; Q369-S373 WeakPolarHBondContact O-CB 3.34Å; Q369-S373 PolarHBondContact O-N 2.68Å; Q369-S373 PolarHBondContact O-OG 3.45Å
370E68.6Low70.3Confident127 Ų127117 Ų11759%0.59359%0.59SS**Hα-helixtrans-67-40.7167-86.2-177.4151.600111K366 C367 D372 S373 L374K366-E370 WeakPolarHBondContact O-CB 3.28Å; K366-E370 PolarHBondContact O-N 2.9Å; C367-E370 PolarHBondContact O-N 2.87Å; E370-D372 VanDerWaalsContact C-N 3.34Å; E370-S373 PolarHBondContact O-N 3.38Å; E370-L374 VanDerWaalsContact O-CB 3.23Å; E370-L374 WeakPolarHBondContact O-CB 3.35Å; E370-L374 WeakPolarHBondContact O-CD1 3.42Å; E370-L374 VanDerWaalsContact O-CG 3.23Å; E370-L374 WeakPolarHBondContact O-CG 3.01Å; E370-L374 PolarHBondContact O-N 3.32Å
371Q62.8Low67.5Low127 Ų127117 Ų11759%0.59361%0.605SS**Hα-helixtrans-65.2-37.7175.1-167.4162.714.200112C367 Q368 S375C367-Q371 WeakPolarHBondContact O-CB 3.29Å; C367-Q371 PolarHBondContact O-N 3.49Å; Q368-Q371 CarbonylContact O-C 3.58Å; Q368-Q371 WeakPolarHBondContact O-CB 3.46Å; Q368-Q371 PolarHBondContact O-N 2.85Å; Q371-S375 VanDerWaalsContact O-CB 3.23Å; Q371-S375 WeakPolarHBondContact O-CB 3.45Å; Q371-S375 PolarHBondContact O-N 2.86Å; Q371-S375 PolarHBondContact O-OG 3.41Å
372D58.3Low65.1Low77 Ų77118.8 Ų118.841%0.41263%0.627SS.*Hα-helixtrans-74.3-35.3174.1-67.5-25000111.9Q368 E370 S375 H376Q368-D372 WeakPolarHBondContact O-CB 3.37Å; Q368-D372 VanDerWaalsContact O-CG 3.24Å; Q368-D372 PolarHBondContact O-N 3.39Å; E370-D372 VanDerWaalsContact C-N 3.34Å; D372-S375 WeakPolarHBondContact CA-OG 3.49Å; D372-S375 PolarHBondContact O-N 3.33Å; D372-S375 PolarHBondContact O-OG 2.79Å; D372-H376 PolarHBondContact O-CD2 2.94Å; D372-H376 PolarHBondContact O-N 3.45Å
373S59.2Low62.1Low81 Ų81125.9 Ų125.957%0.56665%0.649SS**Hα-helixtrans-70.2-31.7174.4-600000112.4Q369 E370Q369-S373 WeakPolarHBondContact O-CB 3.34Å; Q369-S373 PolarHBondContact O-N 2.68Å; Q369-S373 PolarHBondContact O-OG 3.45Å; E370-S373 PolarHBondContact O-N 3.38Å
374L54.7Low59.3Low125 Ų125125.4 Ų125.465%0.65466%0.659SS**Hα-helixtrans-80.8-32.5174.5-74.9160.9000112.3E370 H376 K377 A378E370-L374 VanDerWaalsContact O-CB 3.23Å; E370-L374 WeakPolarHBondContact O-CB 3.35Å; E370-L374 WeakPolarHBondContact O-CD1 3.42Å; E370-L374 VanDerWaalsContact O-CG 3.23Å; E370-L374 WeakPolarHBondContact O-CG 3.01Å; E370-L374 PolarHBondContact O-N 3.32Å; L374-H376 VanDerWaalsContact C-N 3.28Å; L374-H376 PolarHBondContact O-N 3.49Å; L374-K377 PolarHBondContact O-N 2.93Å; L374-A378 PolarHBondContact O-N 3.43Å
375S51.3Low57.4Low67 Ų67126 Ų12647%0.46967%0.67SS.*Hα-helixtrans-70-24.7176.575.80000112.8Q371 D372 K377Q371-S375 VanDerWaalsContact O-CB 3.23Å; Q371-S375 WeakPolarHBondContact O-CB 3.45Å; Q371-S375 PolarHBondContact O-N 2.86Å; Q371-S375 PolarHBondContact O-OG 3.41Å; D372-S375 WeakPolarHBondContact CA-OG 3.49Å; D372-S375 PolarHBondContact O-N 3.33Å; D372-S375 PolarHBondContact O-OG 2.79Å; S375-K377 VanDerWaalsContact C-N 3.3Å; S375-K377 PolarHBondContact O-N 3.18Å
376H50.5Low54.7Low164 Ų164124.3 Ų124.376%0.75968%0.682SS**THydrogen-bonded Turntrans-83.23.5173-69-53.8000114.8D372 L374D372-H376 PolarHBondContact O-CD2 2.94Å; D372-H376 PolarHBondContact O-N 3.45Å; L374-H376 VanDerWaalsContact C-N 3.28Å; L374-H376 PolarHBondContact O-N 3.49Å
377K54.1Low52.2Low191 Ų191127.8 Ų127.883%0.8370%0.698SS**THydrogen-bonded Turntrans-132.1-1174.6-132.4177-176.4-178.60115.5L374 S375 V379L374-K377 PolarHBondContact O-N 2.93Å; S375-K377 VanDerWaalsContact C-N 3.3Å; S375-K377 PolarHBondContact O-N 3.18Å; K377-V379 PolarHBondContact O-N 2.88Å
378A40.4Very low50Low76 Ų76131.9 Ų131.963%0.62872%0.715SS**  trans-91.2104.8172.600000110.7L374L374-A378 PolarHBondContact O-N 3.43Å
379V40.8Very low47.8Very low131 Ų131134.3 Ų134.379%0.79473%0.731SS**  trans-45.7136.4166.4169.50000111.4K377 T381K377-V379 PolarHBondContact O-N 2.88Å; V379-T381 PolarHBondContact O-N 3.4Å
380Q49.8Very low45.8Very low180 Ų180134.7 Ų134.784%0.84174%0.742SS**  trans-27.4114.6162.7-68.6167.7-30.900113.7
381T36.7Very low44Very low138 Ų138131.9 Ų131.985%0.84775%0.747SS**  trans-131.8119.3134.251.60000108V379V379-T381 PolarHBondContact O-N 3.4Å
382S42.9Very low42.5Very low121 Ų121132 Ų13285%0.84676%0.756SS**  trans-68.6137.6174.748.50000109.9
383R32.4Very low41.1Very low247 Ų247135.8 Ų135.893%0.93278%0.776SS**  trans-146.7103148.7-163.3166178.9165.4-2.4110.2
384A33.8Very low39.8Very low87 Ų87135.8 Ų135.872%0.71978%0.781SS**  trans-84.8163.5163.500000109.7
385P50.6Low38.6Very low131 Ų131138.5 Ų138.585%0.85179%0.791SS**  trans-93.7160.4-145.837.1-34.9000113.3
386A33.4Very low37.7Very low104 Ų104140.6 Ų140.686%0.8681%0.806SS**  trans-126.9127171.500000110.9
387K36.1Very low36.7Very low203 Ų203141 Ų14188%0.88381%0.807SS**  trans-59156.9179-87166.8164.4173.90114.3
388D35.8Very low36.2Very low150 Ų150136.9 Ų136.980%0.80280%0.801SS**  trans-32.6145.3157-61.3-52.3000115.2
389L36.8Very low35.5Very low165 Ų165139.1 Ų139.186%0.86481%0.806SS**  -175.2116.2128.9-93.4160000110.5
390T33Very low35Very low136 Ų136137 Ų13783%0.83480%0.802SS**  trans4.1136.314624.10000120.5
391G30.2Very low34.1Very low69 Ų69134 Ų13471%0.71180%0.801SS**  trans147.899136.300000118.8
392V31.8Very low33.7Very low128 Ų128130.6 Ų130.678%0.77679%0.794SS**  trans77.3116.8132.11790000120.8
393N28.4Very low33.1Very low157 Ų157136.7 Ų136.784%0.8480%0.799SS**  trans59.4146.6144.8-72.4-12.6000119.4
394A32.5Very low33Very low81 Ų81133.9 Ų133.967%0.66980%0.796SS**  cis-163.41596.300000107.9
395Q30Very low32.9Very low183 Ų183138.1 Ų138.186%0.85581%0.806SS**  trans31.7129.5151.6-58.5-166.6-50.100118.3
396S32.4Very low31.9Very low111 Ų111136 Ų13678%0.77680%0.799SS**  179.1134.264.7-42.60000108.5
397E29.3Very low31.9Very low171 Ų171136.7 Ų136.780%0.79980%0.797SS**  trans-68.1165149.6-86.6-92.5153.300108.5
398P42.4Very low31.6Very low106 Ų106133.4 Ų133.469%0.68879%0.794SS**  cis-154.6-178.833.440.9-17.7000118.6
399V25.9Very low31.5Very low123 Ų123132.6 Ų132.675%0.74579%0.79SS**  trans86.8107.6145.5-179.70000120.7
400A31.1Very low31.6Very low86 Ų86130.1 Ų130.171%0.71178%0.784SS**  52.2155.6122.800000124
401S29.9Very low31.7Very low116 Ų116131.5 Ų131.581%0.81178%0.781SS**  trans83.7126.5174.878.20000113.9
402G28.6Very low32.5Very low68 Ų68133.4 Ų133.470%0.70178%0.78SS**  cis130.280.818.100000106.7
403W31.1Very low32.7Very low249 Ų249133.9 Ų133.994%0.94378%0.783SS**  trans-12096.6-177.7-67.7-10000110.9
404E29.8Very low33.3Very low187 Ų187132.3 Ų132.387%0.87478%0.784SS**  trans-66136.4143.5-76.8178.4133.700108.2
405L32.1Very low33.6Very low177 Ų177132.2 Ų132.293%0.92778%0.779SS**  trans-143.6127.6153.7-134.881.6000111.1
406A29.5Very low34.3Very low85 Ų85129.5 Ų129.570%0.70278%0.777SS**  trans-70.9147.5-17700000113.8
407S32.8Very low35.1Very low119 Ų119129.5 Ų129.583%0.83277%0.773SS**  trans10.4110.3137.7-174.50000118.1
408V29.5Very low36.5Very low134 Ų134127 Ų12781%0.81277%0.769SS**  trans-137.8122.9149.3176.50000108.2
409N33.6Very low37.5Very low134 Ų134125.6 Ų125.672%0.71776%0.76SS**  trans-118.2132.9168.6-164.420.3000107.9
410P39.8Very low39.9Very low113 Ų113122.5 Ų122.573%0.73474%0.743SS**  trans-135.7125.3140.124.8-5.2000112.1
411E34.5Very low42.2Very low165 Ų165126.8 Ų126.877%0.77175%0.748SS**  trans-83.1173.6163.7-97.6-168.8-178.800110.7
412P46.7Very low44.8Very low108 Ų108127.8 Ų127.870%0.70174%0.735SS**  cis-136.1138.27.931.2-9.7000115
413V37.3Very low47.6Very low139 Ų139130 Ų13084%0.84273%0.725SS**  trans-128.9119.7158.5177.20000108.6S415V413-S415 PolarHBondContact O-N 2.89Å; V413-S415 VanDerWaalsContact O-N 3.15Å
414S41.7Very low50.2Low123 Ų123120.6 Ų120.686%0.8670%0.701SS**  trans-61.9105179.151.80000112.1
415S38.1Very low53Low79 Ų79116.3 Ų116.355%0.55268%0.683SS**  trans-143.1145151.462.30000107.1V413 T417V413-S415 PolarHBondContact O-N 2.89Å; V413-S415 VanDerWaalsContact O-N 3.15Å; S415-T417 PolarHBondContact O-N 3.35Å
416P45.2Very low55.9Low127 Ų127113.2 Ų113.283%0.82566%0.662SS**  trans-77.177.5-176.432.6-31.5000107.8T418P416-T418 PolarHBondContact O-N 2.95Å
417T47.7Very low58.8Low111 Ų111116.6 Ų116.668%0.68166%0.661SS**  trans-74.987168.7-38.20000106.2S415 P419S415-T417 PolarHBondContact O-N 3.35Å; T417-P419 VanDerWaalsContact O-N 3.12Å
418T58.9Low61.6Low118 Ų118116.8 Ų116.872%0.72465%0.649SS**PPolyproline II helixtrans-47122.6159.932.40000106.6P416P416-T418 PolarHBondContact O-N 2.95Å
419P64.1Low64.6Low76 Ų76114 Ų11449%0.49463%0.628SS.*PPolyproline II helixtrans-58135179.723.6-31.9000107.4T417 E421 K423T417-P419 VanDerWaalsContact O-N 3.12Å; P419-E421 PolarHBondContact O-N 2.88Å; P419-K423 HydrophobicContact CB-CB 4.24Å
420P76.4Confident67.5Low59 Ų59113.4 Ų113.438%0.38362%0.62SS.*PPolyproline II helixtrans-54.2142.9-17920.2-32.2000110.2Y422 K423P420-Y422 HydrophobicContact CB-CD1 3.63Å; P420-Y422 HydrophobicContact CB-CE1 3.45Å; P420-Y422 VanDerWaalsContact CB-CE1 3.45Å; P420-Y422 HydrophobicContact CG-CD1 3.87Å; P420-Y422 HydrophobicContact CG-CE1 3.22Å; P420-Y422 PolarHBondContact O-N 2.78Å; P420-K423 WeakPolarHBondContact O-CB 3.43Å; P420-K423 PolarHBondContact O-N 2.93Å
421E80Confident70.1Confident176 Ų176110.7 Ų110.782%0.82260%0.604SS**Hα-helixtrans-51.3-33.9-167.3-66.4-178.3173.900113.2P419 K423 A424 L425P419-E421 PolarHBondContact O-N 2.88Å; E421-K423 VanDerWaalsContact C-N 3.3Å; E421-K423 PolarHBondContact O-N 3.41Å; E421-A424 WeakPolarHBondContact O-CB 3.34Å; E421-A424 PolarHBondContact O-N 2.79Å; E421-A424 VanDerWaalsContact O-N 3.08Å; E421-L425 PolarHBondContact O-N 3.01Å
422Y83.1Confident72.7Confident137 Ų137105.9 Ų105.954%0.53759%0.588SS.*Hα-helixtrans-60-36.2175.779.5-92.7000112.9P420 L425 F426P420-Y422 HydrophobicContact CB-CD1 3.63Å; P420-Y422 HydrophobicContact CB-CE1 3.45Å; P420-Y422 VanDerWaalsContact CB-CE1 3.45Å; P420-Y422 HydrophobicContact CG-CD1 3.87Å; P420-Y422 HydrophobicContact CG-CE1 3.22Å; P420-Y422 PolarHBondContact O-N 2.78Å; Y422-L425 PolarHBondContact O-N 2.79Å; Y422-F426 HydrophobicContact CD2-CD2 4.04Å; Y422-F426 HydrophobicContact CD2-CE2 4.25Å; Y422-F426 WeakPolarHBondContact O-CB 3.47Å; Y422-F426 WeakPolarHBondContact O-CD2 3.43Å; Y422-F426 PolarHBondContact O-N 2.86Å
423K87.3Confident75Confident115 Ų115105.4 Ų105.450%0.558%0.578SS.*Hα-helixtrans-68.5-33.9175.4-94.8-171.2175.61780112P419 P420 E421 K427P419-K423 HydrophobicContact CB-CB 4.24Å; P420-K423 WeakPolarHBondContact O-CB 3.43Å; P420-K423 PolarHBondContact O-N 2.93Å; E421-K423 VanDerWaalsContact C-N 3.3Å; E421-K423 PolarHBondContact O-N 3.41Å; K423-K427 WeakPolarHBondContact O-CG 3.24Å; K423-K427 PolarHBondContact O-N 2.93Å; K423-K427 VanDerWaalsContact O-N 3.11Å
424A87Confident77.6Confident51 Ų51106 Ų10642%0.42157%0.569SS.*Hα-helixtrans-69-44.5173.900000110.5E421 F426 K427 E428E421-A424 WeakPolarHBondContact O-CB 3.34Å; E421-A424 PolarHBondContact O-N 2.79Å; E421-A424 VanDerWaalsContact O-N 3.08Å; A424-F426 PolarHBondContact O-N 3.48Å; A424-K427 WeakPolarHBondContact O-CB 3.33Å; A424-K427 PolarHBondContact O-N 3.37Å; A424-K427 VanDerWaalsContact O-N 3.16Å; A424-E428 PolarHBondContact O-N 2.83Å
425L88.6Confident80.1Confident96 Ų96106.2 Ų106.250%0.50356%0.555SS.*Hα-helixtrans-60-45.3175-173.771.5000111.9E421 Y422 K427 E428 I429E421-L425 PolarHBondContact O-N 3.01Å; Y422-L425 PolarHBondContact O-N 2.79Å; L425-K427 VanDerWaalsContact C-N 3.32Å; L425-K427 PolarHBondContact O-N 3.33Å; L425-E428 PolarHBondContact O-N 2.82Å; L425-E428 VanDerWaalsContact O-N 3.15Å; L425-I429 HydrophobicContact CD1-CD1 4.44Å; L425-I429 HydrophobicContact CD2-CD1 4.29Å; L425-I429 HydrophobicContact CG-CD1 3.84Å; L425-I429 HydrophobicContact CG-CG1 4.38Å; L425-I429 WeakPolarHBondContact O-CB 3.27Å; L425-I429 VanDerWaalsContact O-CG1 3.27Å; L425-I429 WeakPolarHBondContact O-CG1 3.33Å; L425-I429 PolarHBondContact O-N 3.23Å
426F91.9Very high82.7Confident112 Ų112106 Ų10649%0.49155%0.55SS..Hα-helixtrans-61.2-41.6175.3-90.1-70000111.7Y422 A424 E428 I429 F430Y422-F426 HydrophobicContact CD2-CD2 4.04Å; Y422-F426 HydrophobicContact CD2-CE2 4.25Å; Y422-F426 WeakPolarHBondContact O-CB 3.47Å; Y422-F426 WeakPolarHBondContact O-CD2 3.43Å; Y422-F426 PolarHBondContact O-N 2.86Å; A424-F426 PolarHBondContact O-N 3.48Å; F426-E428 VanDerWaalsContact C-N 3.31Å; F426-E428 PolarHBondContact O-N 3.41Å; F426-I429 PolarHBondContact O-N 3.2Å; F426-F430 HydrophobicContact CB-CD2 4.4Å; F426-F430 HydrophobicContact CB-CE2 4.44Å; F426-F430 HydrophobicContact CD1-CD2 4.46Å; F426-F430 AromaticContact CD1-CE2 3.87Å; F426-F430 HydrophobicContact CD1-CE2 3.87Å; F426-F430 WeakPolarHBondContact O-CB 3.42Å; F426-F430 WeakPolarHBondContact O-CD2 3.49Å; F426-F430 PolarHBondContact O-N 3.43Å
427K90.2Very high85Confident156 Ų156106.3 Ų106.368%0.67854%0.539SS*.Hα-helixtrans-62.2-39.3174.7-77.5-178.2177.2-174.50111.9K423 A424 L425 S431K423-K427 WeakPolarHBondContact O-CG 3.24Å; K423-K427 PolarHBondContact O-N 2.93Å; K423-K427 VanDerWaalsContact O-N 3.11Å; A424-K427 WeakPolarHBondContact O-CB 3.33Å; A424-K427 PolarHBondContact O-N 3.37Å; A424-K427 VanDerWaalsContact O-N 3.16Å; L425-K427 VanDerWaalsContact C-N 3.32Å; L425-K427 PolarHBondContact O-N 3.33Å; K427-S431 WeakPolarHBondContact O-CB 3.38Å; K427-S431 PolarHBondContact O-N 3.4Å
428E92.3Very high87.1Confident124 Ų124106.6 Ų106.658%0.57953%0.532SS*.Hα-helixtrans-67.2-47.2176.5-171.7173.5-176.400111.7A424 L425 F426 F430 S431 C432A424-E428 PolarHBondContact O-N 2.83Å; L425-E428 PolarHBondContact O-N 2.82Å; L425-E428 VanDerWaalsContact O-N 3.15Å; F426-E428 VanDerWaalsContact C-N 3.31Å; F426-E428 PolarHBondContact O-N 3.41Å; E428-F430 PolarHBondContact O-N 3.43Å; E428-S431 CarbonylContact O-C 3.22Å; E428-S431 WeakPolarHBondContact O-CB 3.49Å; E428-S431 PolarHBondContact O-N 2.86Å; E428-S431 VanDerWaalsContact O-N 3.11Å; E428-C432 PolarHBondContact O-N 2.87Å
429I92.9Very high88.6Confident74 Ų74106.1 Ų106.138%0.37952%0.522SS..Hα-helixtrans-57.8-49.1174.9-68.8167.9000110.4L425 F426 S431 C432 I433L425-I429 HydrophobicContact CD1-CD1 4.44Å; L425-I429 HydrophobicContact CD2-CD1 4.29Å; L425-I429 HydrophobicContact CG-CD1 3.84Å; L425-I429 HydrophobicContact CG-CG1 4.38Å; L425-I429 WeakPolarHBondContact O-CB 3.27Å; L425-I429 VanDerWaalsContact O-CG1 3.27Å; L425-I429 WeakPolarHBondContact O-CG1 3.33Å; L425-I429 PolarHBondContact O-N 3.23Å; F426-I429 PolarHBondContact O-N 3.2Å; I429-S431 VanDerWaalsContact C-N 3.29Å; I429-S431 PolarHBondContact O-N 2.81Å; I429-C432 PolarHBondContact O-N 2.94Å; I429-I433 HydrophobicContact CG2-CD1 3.65Å; I429-I433 HydrophobicContact CG2-CG1 4.36Å; I429-I433 WeakPolarHBondContact O-CB 3.38Å; I429-I433 VanDerWaalsContact O-CG1 3.24Å; I429-I433 WeakPolarHBondContact O-CG1 3.23Å; I429-I433 PolarHBondContact O-N 2.64Å
430F94.2Very high89.8Confident122 Ų122106 Ų10654%0.53552%0.516SS..Hα-helixtrans-65.8-31.8177.6-78.2-61.6000112.6F426 E428 K434F426-F430 HydrophobicContact CB-CD2 4.4Å; F426-F430 HydrophobicContact CB-CE2 4.44Å; F426-F430 HydrophobicContact CD1-CD2 4.46Å; F426-F430 AromaticContact CD1-CE2 3.87Å; F426-F430 HydrophobicContact CD1-CE2 3.87Å; F426-F430 WeakPolarHBondContact O-CB 3.42Å; F426-F430 WeakPolarHBondContact O-CD2 3.49Å; F426-F430 PolarHBondContact O-N 3.43Å; E428-F430 PolarHBondContact O-N 3.43Å; F430-K434 WeakPolarHBondContact O-CB 3.1Å; F430-K434 VanDerWaalsContact O-CG 3.25Å; F430-K434 WeakPolarHBondContact O-CG 3.3Å; F430-K434 PolarHBondContact O-N 2.85Å
431S93.6Very high90.3Very high57 Ų57106.6 Ų106.640%0.39952%0.516SS..Hα-helixtrans-67.9-45.9173.6-170.90000111.3K427 E428 I429 K434 K435K427-S431 WeakPolarHBondContact O-CB 3.38Å; K427-S431 PolarHBondContact O-N 3.4Å; E428-S431 CarbonylContact O-C 3.22Å; E428-S431 WeakPolarHBondContact O-CB 3.49Å; E428-S431 PolarHBondContact O-N 2.86Å; E428-S431 VanDerWaalsContact O-N 3.11Å; I429-S431 VanDerWaalsContact C-N 3.29Å; I429-S431 PolarHBondContact O-N 2.81Å; S431-K434 PolarHBondContact O-N 2.91Å; S431-K435 WeakPolarHBondContact O-CG 3.48Å; S431-K435 PolarHBondContact O-N 2.85Å
432C90.8Very high90.7Very high64 Ų64102 Ų10243%0.43250%0.495SS..Hα-helixtrans-62.1-47.1175.4-75.40000111.6E428 I429 K434 K435 T436E428-C432 PolarHBondContact O-N 2.87Å; I429-C432 PolarHBondContact O-N 2.94Å; C432-K434 VanDerWaalsContact C-N 3.29Å; C432-K434 PolarHBondContact O-N 3.15Å; C432-K435 PolarHBondContact O-N 2.77Å; C432-K435 VanDerWaalsContact O-N 3.14Å; C432-T436 PolarHBondContact O-N 2.83Å; C432-T436 PolarHBondContact O-OG1 3.22Å; C432-T436 VanDerWaalsContact O-OG1 3.05Å
433I93.9Very high90.8Very high97 Ų97100.7 Ų100.750%0.49749%0.493SS..Hα-helixtrans-59.2-41.1176.6-68.1168.1000111I429 K437I429-I433 HydrophobicContact CG2-CD1 3.65Å; I429-I433 HydrophobicContact CG2-CG1 4.36Å; I429-I433 WeakPolarHBondContact O-CB 3.38Å; I429-I433 VanDerWaalsContact O-CG1 3.24Å; I429-I433 WeakPolarHBondContact O-CG1 3.23Å; I429-I433 PolarHBondContact O-N 2.64Å; I433-K437 WeakPolarHBondContact O-CB 3.46Å; I433-K437 PolarHBondContact O-N 3.25Å
434K92.4Very high90.6Very high152 Ų152103.4 Ų103.466%0.66150%0.501SS*.Hα-helixtrans-65.6-41.6176-79178.2-178.9-176.90112.4F430 S431 C432 K437 Q438F430-K434 WeakPolarHBondContact O-CB 3.1Å; F430-K434 VanDerWaalsContact O-CG 3.25Å; F430-K434 WeakPolarHBondContact O-CG 3.3Å; F430-K434 PolarHBondContact O-N 2.85Å; S431-K434 PolarHBondContact O-N 2.91Å; C432-K434 VanDerWaalsContact C-N 3.29Å; C432-K434 PolarHBondContact O-N 3.15Å; K434-K437 PolarHBondContact O-N 3.44Å; K434-Q438 WeakPolarHBondContact O-CB 3.4Å; K434-Q438 PolarHBondContact O-N 3.25Å
435K93.5Very high90.2Very high128 Ų128105.2 Ų105.256%0.55751%0.506SS*.Hα-helixtrans-62.2-48.6174.9-77.2-177.7178-178.50111.5S431 C432 K437 Q438 E439S431-K435 WeakPolarHBondContact O-CG 3.48Å; S431-K435 PolarHBondContact O-N 2.85Å; C432-K435 PolarHBondContact O-N 2.77Å; C432-K435 VanDerWaalsContact O-N 3.14Å; K435-K437 VanDerWaalsContact C-N 3.3Å; K435-K437 PolarHBondContact O-N 3.04Å; K435-Q438 PolarHBondContact O-N 3.48Å; K435-Q438 VanDerWaalsContact O-N 3.12Å; K435-E439 WeakPolarHBondContact O-CG 3.31Å; K435-E439 PolarHBondContact O-N 3.17Å
436T93.8Very high89.7Confident73 Ų73106.5 Ų106.545%0.44851%0.508SS..Hα-helixtrans-61-39.9177.3-54.50000111.5C432 E439 I440C432-T436 PolarHBondContact O-N 2.83Å; C432-T436 PolarHBondContact O-OG1 3.22Å; C432-T436 VanDerWaalsContact O-OG1 3.05Å; T436-E439 PolarHBondContact O-N 2.96Å; T436-I440 HydrophobicContact CG2-CD1 4.05Å; T436-I440 VanDerWaalsContact O-CG1 3.26Å; T436-I440 WeakPolarHBondContact O-CG1 3.35Å; T436-I440 PolarHBondContact O-N 3.47Å
437K93Very high88.6Confident135 Ų135109.3 Ų109.359%0.58752%0.516SS*.Hα-helixtrans-61.3-45.8173.9-176179.8176.2-178.50111.6I433 K434 K435 I440 D441I433-K437 WeakPolarHBondContact O-CB 3.46Å; I433-K437 PolarHBondContact O-N 3.25Å; K434-K437 PolarHBondContact O-N 3.44Å; K435-K437 VanDerWaalsContact C-N 3.3Å; K435-K437 PolarHBondContact O-N 3.04Å; K437-I440 PolarHBondContact O-N 2.7Å; K437-D441 PolarHBondContact O-N 3.06Å
438Q90.4Very high87.7Confident117 Ų117111.3 Ų111.355%0.54752%0.52SS..Hα-helixtrans-63.3-42.2177.7-174.7179.9-17.700111.9K434 K435 I440 D441 E442K434-Q438 WeakPolarHBondContact O-CB 3.4Å; K434-Q438 PolarHBondContact O-N 3.25Å; K435-Q438 PolarHBondContact O-N 3.48Å; K435-Q438 VanDerWaalsContact O-N 3.12Å; Q438-I440 VanDerWaalsContact C-N 3.35Å; Q438-I440 PolarHBondContact O-N 2.83Å; Q438-D441 PolarHBondContact O-N 3.17Å; Q438-E442 HydrophobicContact CG-CG 4.49Å; Q438-E442 PolarHBondContact NE2-OE1 3.3Å; Q438-E442 WeakPolarHBondContact O-CB 3.44Å; Q438-E442 WeakPolarHBondContact O-CG 3.23Å; Q438-E442 PolarHBondContact O-N 2.97Å
439E90.8Very high86.3Confident108 Ų108108.4 Ų108.451%0.50551%0.513SS..Hα-helixtrans-61.6-41.1175.9-76174.4-175.900112.2K435 T436 E442 Q443K435-E439 WeakPolarHBondContact O-CG 3.31Å; K435-E439 PolarHBondContact O-N 3.17Å; T436-E439 PolarHBondContact O-N 2.96Å; E439-E442 PolarHBondContact O-N 2.86Å; E439-Q443 WeakPolarHBondContact O-CB 3.17Å; E439-Q443 VanDerWaalsContact O-CG 3.31Å; E439-Q443 WeakPolarHBondContact O-CG 3.36Å; E439-Q443 PolarHBondContact O-N 2.77Å
440I89.9Confident84.7Confident72 Ų72110.9 Ų110.937%0.36953%0.527SS..Hα-helixtrans-64.5-42.3175.4-69.3166.7000110.8T436 K437 Q438 Q443 R444T436-I440 HydrophobicContact CG2-CD1 4.05Å; T436-I440 VanDerWaalsContact O-CG1 3.26Å; T436-I440 WeakPolarHBondContact O-CG1 3.35Å; T436-I440 PolarHBondContact O-N 3.47Å; K437-I440 PolarHBondContact O-N 2.7Å; Q438-I440 VanDerWaalsContact C-N 3.35Å; Q438-I440 PolarHBondContact O-N 2.83Å; I440-Q443 PolarHBondContact O-N 3.02Å; I440-R444 WeakPolarHBondContact O-CB 3.23Å; I440-R444 VanDerWaalsContact O-CG 3.31Å; I440-R444 WeakPolarHBondContact O-CG 3.29Å; I440-R444 PolarHBondContact O-N 3.18Å
441D86.6Confident82.9Confident72 Ų72109.5 Ų109.539%0.38553%0.532SS..Hα-helixtrans-67.8-37.1177.8-71.5-25.3000111.6K437 Q438 R444 T445K437-D441 PolarHBondContact O-N 3.06Å; Q438-D441 PolarHBondContact O-N 3.17Å; D441-R444 PolarHBondContact O-N 3.45Å; D441-T445 WeakPolarHBondContact O-CG2 3.44Å; D441-T445 PolarHBondContact O-N 3.48Å; D441-T445 PolarHBondContact O-OG1 2.8Å
442E88.8Confident81.1Confident80 Ų80110.8 Ų110.837%0.37454%0.541SS..Hα-helixtrans-65.6-40.5172.2-76.7178.9-160.500112.4Q438 E439 T445 K446Q438-E442 HydrophobicContact CG-CG 4.49Å; Q438-E442 PolarHBondContact NE2-OE1 3.3Å; Q438-E442 WeakPolarHBondContact O-CB 3.44Å; Q438-E442 WeakPolarHBondContact O-CG 3.23Å; Q438-E442 PolarHBondContact O-N 2.97Å; E439-E442 PolarHBondContact O-N 2.86Å; E442-T445 VanDerWaalsContact CA-OG1 3.32Å; E442-T445 WeakPolarHBondContact CA-OG1 3.35Å; E442-T445 PolarHBondContact O-OG1 3.41Å; E442-K446 WeakPolarHBondContact O-CB 3.48Å; E442-K446 WeakPolarHBondContact O-CD 3.41Å; E442-K446 WeakPolarHBondContact O-CG 3.42Å; E442-K446 PolarHBondContact O-N 2.88Å
443Q84.1Confident79.4Confident110 Ų110116.3 Ų116.351%0.51456%0.56SS.*Hα-helixtrans-64.9-46.3173.7-74.5179.8-0.500110.9E439 I440 T445 K446 Y447E439-Q443 WeakPolarHBondContact O-CB 3.17Å; E439-Q443 VanDerWaalsContact O-CG 3.31Å; E439-Q443 WeakPolarHBondContact O-CG 3.36Å; E439-Q443 PolarHBondContact O-N 2.77Å; I440-Q443 PolarHBondContact O-N 3.02Å; Q443-T445 VanDerWaalsContact C-N 3.32Å; Q443-T445 PolarHBondContact O-N 2.72Å; Q443-K446 PolarHBondContact O-N 3.4Å; Q443-Y447 HydrophobicContact CB-CE2 4.48Å; Q443-Y447 WeakPolarHBondContact O-CD2 3.26Å; Q443-Y447 PolarHBondContact O-N 2.91Å
444R84.3Confident77Confident172 Ų172119.6 Ų119.665%0.64959%0.591SS**Hα-helixtrans-59.5-40.5177.3-77.5175.1173.2-179.9-2.8112.6I440 D441 R448I440-R444 WeakPolarHBondContact O-CB 3.23Å; I440-R444 VanDerWaalsContact O-CG 3.31Å; I440-R444 WeakPolarHBondContact O-CG 3.29Å; I440-R444 PolarHBondContact O-N 3.18Å; D441-R444 PolarHBondContact O-N 3.45Å; R444-R448 WeakPolarHBondContact O-CB 3.45Å; R444-R448 PolarHBondContact O-N 3.07Å
445T78.6Confident76.2Confident88 Ų88118 Ų11854%0.5459%0.588SS.*Hα-helixtrans-69.8-38.8176.7480000112.4D441 E442 Q443 R448 S449D441-T445 WeakPolarHBondContact O-CG2 3.44Å; D441-T445 PolarHBondContact O-N 3.48Å; D441-T445 PolarHBondContact O-OG1 2.8Å; E442-T445 VanDerWaalsContact CA-OG1 3.32Å; E442-T445 WeakPolarHBondContact CA-OG1 3.35Å; E442-T445 PolarHBondContact O-OG1 3.41Å; Q443-T445 VanDerWaalsContact C-N 3.32Å; Q443-T445 PolarHBondContact O-N 2.72Å; T445-R448 PolarHBondContact O-N 2.84Å; T445-S449 PolarHBondContact O-N 3.16Å; T445-S449 PolarHBondContact O-OG 3.31Å
446K77.8Confident75.3Confident124 Ų124117.4 Ų117.454%0.53959%0.59SS.*Hα-helixtrans-62.6-41.3172.7-73.6168-174.4169.40112.8E442 Q443 S449 L450E442-K446 WeakPolarHBondContact O-CB 3.48Å; E442-K446 WeakPolarHBondContact O-CD 3.41Å; E442-K446 WeakPolarHBondContact O-CG 3.42Å; E442-K446 PolarHBondContact O-N 2.88Å; Q443-K446 PolarHBondContact O-N 3.4Å; K446-S449 PolarHBondContact O-OG 3.26Å; K446-L450 WeakPolarHBondContact O-CD1 3.34Å; K446-L450 WeakPolarHBondContact O-CG 3.46Å; K446-L450 PolarHBondContact O-N 2.92Å
447Y68.8Low74.3Confident171 Ų171119.9 Ų119.967%0.67160%0.597SS**Hα-helixtrans-69-34.4175.1-77.3-69.3000112.3Q443 S451Q443-Y447 HydrophobicContact CB-CE2 4.48Å; Q443-Y447 WeakPolarHBondContact O-CD2 3.26Å; Q443-Y447 PolarHBondContact O-N 2.91Å; Y447-S451 PolarHBondContact O-N 2.89Å
448R70.9Confident73.2Confident197 Ų197119 Ų11974%0.74360%0.598SS**Hα-helixtrans-69.5-39.4177.3-162.3171.4-151.4-170.25112.9R444 T445 S451 S452R444-R448 WeakPolarHBondContact O-CB 3.45Å; R444-R448 PolarHBondContact O-N 3.07Å; T445-R448 PolarHBondContact O-N 2.84Å; R448-S451 PolarHBondContact O-N 2.97Å; R448-S452 PolarHBondContact O-N 3.32Å; R448-S452 PolarHBondContact O-OG 3.19Å
449S63.4Low72.1Confident64 Ų64119.1 Ų119.145%0.44860%0.601SS.*Hα-helixtrans-69.3-35.417656.40000113T445 K446 S451 S452T445-S449 PolarHBondContact O-N 3.16Å; T445-S449 PolarHBondContact O-OG 3.31Å; K446-S449 PolarHBondContact O-OG 3.26Å; S449-S451 VanDerWaalsContact C-N 3.35Å; S449-S452 PolarHBondContact O-N 3.13Å
450L58.8Low70.9Confident126 Ų126119.9 Ų119.966%0.6661%0.608SS**Hα-helixtrans-65.9-35.7173.4-73.8164.6000112.5K446 S452K446-L450 WeakPolarHBondContact O-CD1 3.34Å; K446-L450 WeakPolarHBondContact O-CG 3.46Å; K446-L450 PolarHBondContact O-N 2.92Å; L450-S452 PolarHBondContact O-N 2.98Å
451S56.2Low69.5Low92 Ų92123.3 Ų123.364%0.64363%0.625SS**THydrogen-bonded Turntrans-71.4-10.4175.1-175.60000114.2Y447 R448 S449Y447-S451 PolarHBondContact O-N 2.89Å; R448-S451 PolarHBondContact O-N 2.97Å; S449-S451 VanDerWaalsContact C-N 3.35Å
452S56Low68.2Low85 Ų85127.2 Ų127.259%0.59464%0.643SS**THydrogen-bonded Turntrans-98.1-5.6-177.4-49.70000113.1R448 S449 L450R448-S452 PolarHBondContact O-N 3.32Å; R448-S452 PolarHBondContact O-OG 3.19Å; S449-S452 PolarHBondContact O-N 3.13Å; L450-S452 PolarHBondContact O-N 2.98Å
453H55.3Low66.5Low180 Ų180131.2 Ų131.283%0.83367%0.666SS**  trans-114.914.8-179.4-80.7-62.7000113.4
454S43.5Very low64.9Low165 Ų165133.1 Ų133.1100%1.15468%0.679SS**  trans-115.90161.6-172.60000109

Retrieved 454 of 454 residues in 234.3 ms (Link to these results)